# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-12-24T18:00:24+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (year = 1999 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
"1000500","17.0051","0.0002","17.0051","0.0002","6.8607","0.0001","90","","90","","120","","1718.1","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Lanthanum molybdenum oxide (7/7/30)","","- La7 Mo7 O30 -","- La7 Mo7 O30 -","- La21 Mo21 O90 -","3","0.166667","","Goutenoire, F; Retoux, R; Suard, E; Lacorre, P","Ab initio determination of the novel perovskite-related structure of La7 Mo7 O30 from powder diffraction","Journal of Solid State Chemistry","1999","142","","228","235","10.1006/jssc.1998.8070","","","","","","0.0418","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1000501","17.00639","0.0002","17.00639","0.0002","6.8613","0.0001","90","","90","","120","","1718.5","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Lanthanum molybdenum oxide (7/7/30)","","- La7 Mo7 O30 -","- La7 Mo7 O30 -","- La21 Mo21 O90 -","3","0.166667","","Goutenoire, F; Retoux, R; Suard, E; Lacorre, P","Ab initio determination of the novel perovskite-related structure of La7 Mo7 O30 from powder diffraction","Journal of Solid State Chemistry","1999","142","","228","235","10.1006/jssc.1998.8070","","","","","","0.0515","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1000502","10.695","0.006","6.32","0.004","10.328","0.006","90","","117.8","0.04","90","","617.5","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Sodium gadolinium oxide bis(borate)","","- B2 Gd2 Na2 O7 -","- B2 Gd2 Na2 O7 -","- B8 Gd8 Na8 O28 -","4","1","","Corbel, G; Leblanc, M; Antic-Fidancev, E; Lemaitre-Blaise, M","Crystal structure of sodium rare earth oxyborates Na2 Ln2 (B O3)2 O(Ln = Sm, Eu, and Gd) and optical analysis of Na2 Gd2 (B O3)2 O:Eu(3+)","Journal of Solid State Chemistry","1999","144","","35","44","10.1006/jssc.1998.8107","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000503","3.88","","3.88","","32.39999","","90","","90","","90","","487.8","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Lithium lanthanum niobium titanium oxide","","- La2.25 Li2 Nb1.25 O13 Ti2.75 -","- La2.25 Li2 Nb1.25 O13 Ti2.75 -","- La4.5 Li4 Nb2.5 O26 Ti5.5 -","2","0.0625","","Crosnier-Lopez, M P; Bhuvanesh, N S P; Duroy, H; Fourquet, J L","Irreversible electron-induced structural change during HREM imaging in lithium Ruddlesden-Popper phases in the series Li2 La(x) (Nb(2n-3x) Ti(3x-n) O(3n-1)) (n = 2,3,4) and Li2 Sr1.5 (Nb(3-x) Fe(x)) O(10-x)","Journal of Solid State Chemistry","1999","145","","136","149","10.1006/jssc.1999.8232","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004008","6.221","0.001","10.7702","0.0005","6.935","0.003","90","","107.09","0.02","90","","444.14","","","","","","","","","","","","","4","C 1 2 1","","5","","Copper(I) Chromium Hexaselenodiphosphate(IV)","","- Cr Cu P2 Se6 -","- Cr Cu P2 Se6 -","- Cr2 Cu2 P4 Se12 -","2","0.5","","Bourdon, X.; Maisonneuve, V.; Cajipe, V. B.; Payen, C.; Fischer, J. E.","Copper sublattice ordering in layered Cu M P~2~ Se~6~ (M = In, Cr)","Journal of Alloys and Compounds","1999","283","1-2","122","127","10.1016/S0925-8388(98)00899-8","","","","","","0.046","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1004009","6.4024","0.0001","6.4024","0.0001","13.358","0.0004","90","","90","","120","","474.2","","","","","","","","","","","","","4","P -3 1 c","","163","","Copper(I) Indium Hexaselenodiphosphate(IV)","","- Cu In P2 Se6 -","- Cu In P2 Se6 -","- Cu2 In2 P4 Se12 -","2","0.166667","","Bourdon, X.; Maisonneuve, V.; Cajipe, V. B.; Payen, C.; Fischer, J. E.","Copper sublattice ordering in layered Cu M P~2~ Se~6~ (M = In, Cr)","Journal of Alloys and Compounds","1999","283","1-2","122","127","10.1016/S0925-8388(98)00899-8","","","","","","0.118","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1004134","11.7525","0.0002","5.8005","0.0001","24.8024","0.0004","90","","102.867","0.001","90","","1648.3","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Bismuth molybdenum oxide (26.4/9.6/68.4)","","- Bi26.4 Mo9.6 O68.4 -","- Bi26.4 Mo9.6 O68.4 -","- Bi26.4 Mo9.6 O68.4 -","1","0.25","","Vannier, R-N; Abraham, F; Nowogrocki, G; Mairesse, G","New structural and electrical data on Bi-Mo mixed oxides with a structure based on (B12 O14)(infinite) columns","Journal of Solid State Chemistry","1999","142","","294","304","10.1006/jssc.1998.8034","","","","","","0.0476","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004135","4.0242","0.0002","4.0242","0.0002","27.59999","0.001","90","","90","","120","","387.1","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Bismuth lanthanum oxide (0.78/0.23/1.5)","","- Bi0.775 La0.225 O1.5 -","- Bi0.775 La0.225 O1.5 -","- Bi6.975 La2.025 O13.5 -","9","0.25","","Drache, M; Obbade, S; Wignacourt, J P; Conflant, P","Structural and conductivity properties of Bi(0.775) Ln(0.225) O1.5 oxide conductors (Ln = La, Pr, Nd, Sm, Eu, Gd, Tb, Dy) with rhombohedral Bi-Sr-O type","Journal of Solid State Chemistry","1999","142","","349","359","10.1006/jssc.1998.8043","","","","","","0.059","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004136","3.9975","0.0001","3.9975","0.0001","27.50899","0.001","90","","90","","120","","380.7","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Bismuth praseodymium oxide (0.78/0.23/1.5)","","- Bi0.775 O1.5 Pr0.225 -","- Bi0.775 O1.5 Pr0.225 -","- Bi6.975 O13.5 Pr2.025 -","9","0.25","","Drache, M; Obbade, S; Wignacourt, J P; Conflant, P","Structural and conductivity properties of Bi(0.775) Ln(0.225) O1.5 oxide conductors (Ln = La, Pr, Nd, Sm, Eu, Gd, Tb, Dy) with rhombohedral Bi-Sr-O type","Journal of Solid State Chemistry","1999","142","","349","359","10.1006/jssc.1998.8043","","","","","","0.069","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004137","3.9915","0.0001","3.9915","0.0001","27.463","0.001","90","","90","","120","","378.9","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Bismuth neodymium oxide (0.78/0.23/1.5)","","- Bi0.775 Nd0.225 O1.5 -","- Bi0.775 Nd0.225 O1.5 -","- Bi6.975 Nd2.025 O13.5 -","9","0.25","","Drache, M; Obbade, S; Wignacourt, J P; Conflant, P","Structural and conductivity properties of Bi(0.775) Ln(0.225) O1.5 oxide conductors (Ln = La, Pr, Nd, Sm, Eu, Gd, Tb, Dy) with rhombohedral Bi-Sr-O type","Journal of Solid State Chemistry","1999","142","","349","359","10.1006/jssc.1998.8043","","","","","","0.069","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004138","3.9783","0.0002","3.9783","0.0002","27.39099","0.002","90","","90","","120","","375.4","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Bismuth samarium oxide (0.78/0.23/1.5)","","- Bi0.775 O1.5 Sm0.225 -","- Bi0.775 O1.5 Sm0.225 -","- Bi6.975 O13.5 Sm2.025 -","9","0.25","","Drache, M; Obbade, S; Wignacourt, J P; Conflant, P","Structural and conductivity properties of Bi(0.775) Ln(0.225) O1.5 oxide conductors (Ln = La, Pr, Nd, Sm, Eu, Gd, Tb, Dy) with rhombohedral Bi-Sr-O type","Journal of Solid State Chemistry","1999","142","","349","359","10.1006/jssc.1998.8043","","","","","","0.084","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004139","3.9736","0.0002","3.9736","0.0002","27.353","0.002","90","","90","","120","","374","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Bismuth europium oxide (0.78/0.23/1.5)","","- Bi0.775 Eu0.225 O1.5 -","- Bi0.775 Eu0.225 O1.5 -","- Bi6.975 Eu2.025 O13.5 -","9","0.25","","Drache, M; Obbade, S; Wignacourt, J P; Conflant, P","Structural and conductivity properties of Bi(0.775) Ln(0.225) O1.5 oxide conductors (Ln = La, Pr, Nd, Sm, Eu, Gd, Tb, Dy) with rhombohedral Bi-Sr-O type","Journal of Solid State Chemistry","1999","142","","349","359","10.1006/jssc.1998.8043","","","","","","0.06","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004140","3.9724","0.0003","3.9724","0.0003","27.33899","0.001","90","","90","","120","","373.6","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Bismuth gadolinium oxide (0.78/0.23/1.5)","","- Bi0.775 Gd0.225 O1.5 -","- Bi0.775 Gd0.225 O1.5 -","- Bi6.975 Gd2.025 O13.5 -","9","0.25","","Drache, M; Obbade, S; Wignacourt, J P; Conflant, P","Structural and conductivity properties of Bi(0.775) Ln(0.225) O1.5 oxide conductors (Ln = La, Pr, Nd, Sm, Eu, Gd, Tb, Dy) with rhombohedral Bi-Sr-O type","Journal of Solid State Chemistry","1999","142","","349","359","10.1006/jssc.1998.8043","","","","","","0.064","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004141","3.9653","0.0002","3.9653","0.0002","27.31699","0.002","90","","90","","120","","372","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Bismuth terbium oxide (0.78/0.23/1.5)","","- Bi0.775 O1.5 Tb0.225 -","- Bi0.775 O1.5 Tb0.225 -","- Bi6.975 O13.5 Tb2.025 -","9","0.25","","Drache, M; Obbade, S; Wignacourt, J P; Conflant, P","Structural and conductivity properties of Bi(0.775) Ln(0.225) O1.5 oxide conductors (Ln = La, Pr, Nd, Sm, Eu, Gd, Tb, Dy) with rhombohedral Bi-Sr-O type","Journal of Solid State Chemistry","1999","142","","349","359","10.1006/jssc.1998.8043","","","","","","0.06","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004142","3.9649","0.0002","3.9649","0.0002","27.29599","0.002","90","","90","","120","","371.6","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Bismuth dysprosium oxide (0.78/0.23/1.5)","","- Bi0.775 Dy0.225 O1.5 -","- Bi0.775 Dy0.225 O1.5 -","- Bi6.975 Dy2.025 O13.5 -","9","0.25","","Drache, M; Obbade, S; Wignacourt, J P; Conflant, P","Structural and conductivity properties of Bi(0.775) Ln(0.225) O1.5 oxide conductors (Ln = La, Pr, Nd, Sm, Eu, Gd, Tb, Dy) with rhombohedral Bi-Sr-O type","Journal of Solid State Chemistry","1999","142","","349","359","10.1006/jssc.1998.8043","","","","","","0.071","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004143","6.215","0.001","7.44","0.002","10.498","0.002","100.19","0.01","103.73","0.01","90.05","0.01","463.6","","","","","","","","","","","","","4","P -1","-P 1","2","","Tetralead bismuth tetraoxide phosphate(V)","","- Bi O8 P Pb4 -","- Bi O8 P Pb4 -","- Bi2 O16 P2 Pb8 -","2","1","","Giraud, S; Wignacourt, J-P; Drache, M; Nowogrocki, G; Steinfink, H","The stereochemical effect of 6s2 lone-pair electrons: the crystal structure of a new lead bismuth oxyphosphate Pb4 Bi O4 P O4","Journal of Solid State Chemistry","1999","142","","80","88","10.1006/jssc.1998.7988","","","","","","0.0485","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004144","8.424","0.002","11.378","0.003","13.16","0.005","90","","92.06","0.03","90","","1260.5","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Caesium tetrahydroxopentaoxoborate trihydrate","","- B4 Cs2 H10 O12 -","- B4 Cs2 H10 O12 -","- B16 Cs8 H40 O48 -","4","1","","Touboul, M; Penin, N; Nowogrocki, G","Crystal structure and thermal behavior of Cs2 (B4 O5 (O H)4)3 H2 O","Journal of Solid State Chemistry","1999","143","","260","265","10.1006/jssc.1998.8104","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","186542","2020-10-21","18:00:00",""
"1004145","10.985","0.003","5.635","0.001","6.452","0.006","90","","105.3","0.4","90","","385.2","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Distrontium diruthenium(VI) ruthenium(IV) oxide","","- O10 Ru3 Sr2 -","- O10 Ru3 Sr2 -","- O20 Ru6 Sr4 -","2","0.25","","Renard, C; Daviero-Minaud, S; Abraham, F","High-pressure synthesis and crystal structure of a new strontium ruthenium oxide: Sr2 Ru3 O10","Journal of Solid State Chemistry","1999","143","","266","272","10.1006/jssc.1998.8105","","","","","","0.032","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004146","5.566","0.002","5.566","0.002","18.18599","0.005","90","","90","","120","","487.9","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Strontium ruthenium oxide (4/3.05/12)","","- O12 Ru3.05 Sr4 -","- O12 Ru3.05 Sr4 -","- O24 Ru6.1 Sr8 -","2","0.166667","","Renard, C; Daviero-Minaud, S; Huve, M; Abraham, F","Sr4 Ru3.05 O12: a new member of the hexagonal perovskite family","Journal of Solid State Chemistry","1999","144","","125","135","10.1006/jssc.1999.8132","","","","","","0.032","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004147","15.478","0.01","3.644","0.005","10.123","0.006","90","","109.29","0.01","90","","538.9","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Lead vanadium oxide (0.3/2/5) - $-beta","","- O5 Pb0.3 V2 -","- O5 Pb0.300667 V2 -","- O30 Pb1.804 V12 -","6","0.75","","Mentre, O; Huve, M; Abraham, F","Bidimensional cationic ordering and thermal dependence in $-beta- Pb(x) V2 O5 bronzes","Journal of Solid State Chemistry","1999","145","","186","196","10.1006/jssc.1999.8241","","","","","","0.047","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004148","15.478","0.01","7.288","0.005","10.123","0.006","90","","109.29","0.01","90","","1077.8","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Lead vanadium oxide (0.3/2/5) - $-beta","","- O5 Pb0.304 V2 -","- O5 Pb0.304 V2 -","- O60 Pb3.648 V24 -","12","3","","Mentre, O; Huve, M; Abraham, F","Bidimensional cationic ordering and thermal dependence in $-beta- Pb(x) V2 O5 bronzes","Journal of Solid State Chemistry","1999","145","","186","196","10.1006/jssc.1999.8241","","","","","","0.047","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1004149","11.904","0.002","6.8321","0.0006","12.095","0.002","90","","106.989","0.005","90","","941","2","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Caesium dioxouranium tris(vanadate)","","- Cs O11 U V3 -","- Cs O11 U V3 -","- Cs4 O44 U4 V12 -","4","1","","Duribreux, I.; Dion, C.; Abraham, F.; Saadi, M.","CsUV~3~O~11~, a new uranyl vanadate with a layered structure","Journal of Solid State Chemistry","1999","146","1","258","265","10.1006/jssc.1999.8349","","","","","","","0.046","","","0.045","","","","","","","","","","","has coordinates","208739","2020-10-21","18:00:00",""
"1005053","11.6291","0.0008","13.4159","0.001","12.0862","0.0009","90","","90","","90","","1885.6","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Nonacalcium octachloride bis(dicarbidoborate)","","- C4 B2 Ca9 Cl8 -","- C4 B2 Ca9 Cl8 -","- C16 B8 Ca36 Cl32 -","4","0.25","","Reckeweg, O; DiSalvo, F J; Meyer, H-J","An expected calcium carbido borate chloride:Ca9 Cl8 (B C2)2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1408","1410","10.1002/(SICI)1521-3749(199909)625:9<1408::AID-ZAAC1408>3.0.CO;2-O","","","","","","0.0707","","","","","","","","","","","","","","","has coordinates","208902","2020-10-21","18:00:00",""
"1009000","4.994","0.0001","4.994","0.0001","11.3871","0.0004","90","","90","","120","","245.9","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","Gallium arsenate(V)","","- As Ga O4 -","- As Ga O4 -","- As3 Ga3 O12 -","3","0.5","","Philippot, E; Armand, P; Yot, P; Cambon, O; Goiffon, A; McIntyre, G J; Bordet, P","Neutron and x-ray structure refinements between 15 and 1083 K of piezoelectric gallium arsenate, Ga As O4: temperature and pressure behavior compared with other $-alpha-quartz materials","Journal of Solid State Chemistry","1999","146","","114","123","10.1006/jssc.1999.8316","","","","","","0.025","","","","","","","","","","","","","","","has coordinates","202022","2020-10-21","18:00:00",""
"1009001","4.9942","0.0001","4.9942","0.0001","11.3816","0.0013","90","","90","","120","","245.8","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","Gallium arsenate(V)","","- As Ga O4 -","- As Ga O4 -","- As3 Ga3 O12 -","3","0.5","","Philippot, E; Armand, P; Yot, P; Cambon, O; Goiffon, A; McIntyre, G J; Bordet, P","Neutron and x-ray structure refinements between 15 and 1083 K of piezoelectric gallium arsenate, Ga As O4: temperature and pressure behavior compared with other $-alpha-quartz materials","Journal of Solid State Chemistry","1999","146","","114","123","10.1006/jssc.1999.8316","","","","","","0.019","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009002","4.997","0.001","4.997","0.001","11.379","0.003","90","","90","","120","","246.1","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","Gallium arsenate(V)","","- As Ga O4 -","- As Ga O4 -","- As3 Ga3 O12 -","3","0.5","","Philippot, E; Armand, P; Yot, P; Cambon, O; Goiffon, A; McIntyre, G J; Bordet, P","Neutron and x-ray structure refinements between 15 and 1083 K of piezoelectric gallium arsenate, Ga As O4: temperature and pressure behavior compared with other $-alpha-quartz materials","Journal of Solid State Chemistry","1999","146","","114","123","10.1006/jssc.1999.8316","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009003","5.007","0.001","5.007","0.001","11.391","0.003","90","","90","","120","","247.3","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","Gallium arsenate(V)","","- As Ga O4 -","- As Ga O4 -","- As3 Ga3 O12 -","3","0.5","","Philippot, E; Armand, P; Yot, P; Cambon, O; Goiffon, A; McIntyre, G J; Bordet, P","Neutron and x-ray structure refinements between 15 and 1083 K of piezoelectric gallium arsenate, Ga As O4: temperature and pressure behavior compared with other $-alpha-quartz materials","Journal of Solid State Chemistry","1999","146","","114","123","10.1006/jssc.1999.8316","","","","","","0.033","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009004","5.011","0.001","5.011","0.001","11.388","0.003","90","","90","","120","","247.6","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","Gallium arsenate(V)","","- As Ga O4 -","- As Ga O4 -","- As3 Ga3 O12 -","3","0.5","","Philippot, E; Armand, P; Yot, P; Cambon, O; Goiffon, A; McIntyre, G J; Bordet, P","Neutron and x-ray structure refinements between 15 and 1083 K of piezoelectric gallium arsenate, Ga As O4: temperature and pressure behavior compared with other $-alpha-quartz materials","Journal of Solid State Chemistry","1999","146","","114","123","10.1006/jssc.1999.8316","","","","","","0.042","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009005","5.017","0.001","5.017","0.001","11.401","0.003","90","","90","","120","","248.5","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","Gallium arsenate(V)","","- As Ga O4 -","- As Ga O4 -","- As3 Ga3 O12 -","3","0.5","","Philippot, E; Armand, P; Yot, P; Cambon, O; Goiffon, A; McIntyre, G J; Bordet, P","Neutron and x-ray structure refinements between 15 and 1083 K of piezoelectric gallium arsenate, Ga As O4: temperature and pressure behavior compared with other $-alpha-quartz materials","Journal of Solid State Chemistry","1999","146","","114","123","10.1006/jssc.1999.8316","","","","","","0.045","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009006","5.025","0.001","5.025","0.001","11.408","0.003","90","","90","","120","","249.5","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","Gallium arsenate(V)","","- As Ga O4 -","- As Ga O4 -","- As3 Ga3 O12 -","3","0.5","","Philippot, E; Armand, P; Yot, P; Cambon, O; Goiffon, A; McIntyre, G J; Bordet, P","Neutron and x-ray structure refinements between 15 and 1083 K of piezoelectric gallium arsenate, Ga As O4: temperature and pressure behavior compared with other $-alpha-quartz materials","Journal of Solid State Chemistry","1999","146","","114","123","10.1006/jssc.1999.8316","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009007","5.033","0.001","5.033","0.001","11.411","0.003","90","","90","","120","","250.3","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","Gallium arsenate(V)","","- As Ga O4 -","- As Ga O4 -","- As3 Ga3 O12 -","3","0.5","","Philippot, E; Armand, P; Yot, P; Cambon, O; Goiffon, A; McIntyre, G J; Bordet, P","Neutron and x-ray structure refinements between 15 and 1083 K of piezoelectric gallium arsenate, Ga As O4: temperature and pressure behavior compared with other $-alpha-quartz materials","Journal of Solid State Chemistry","1999","146","","114","123","10.1006/jssc.1999.8316","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009008","5.04","0.001","5.04","0.001","11.408","0.003","90","","90","","120","","251","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","Gallium arsenate(V)","","- As Ga O4 -","- As Ga O4 -","- As3 Ga3 O12 -","3","0.5","","Philippot, E; Armand, P; Yot, P; Cambon, O; Goiffon, A; McIntyre, G J; Bordet, P","Neutron and x-ray structure refinements between 15 and 1083 K of piezoelectric gallium arsenate, Ga As O4: temperature and pressure behavior compared with other $-alpha-quartz materials","Journal of Solid State Chemistry","1999","146","","114","123","10.1006/jssc.1999.8316","","","","","","0.043","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009009","5.051","0.001","5.051","0.001","11.421","0.003","90","","90","","120","","252.3","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","Gallium arsenate(V)","","- As Ga O4 -","- As Ga O4 -","- As3 Ga3 O12 -","3","0.5","","Philippot, E; Armand, P; Yot, P; Cambon, O; Goiffon, A; McIntyre, G J; Bordet, P","Neutron and x-ray structure refinements between 15 and 1083 K of piezoelectric gallium arsenate, Ga As O4: temperature and pressure behavior compared with other $-alpha-quartz materials","Journal of Solid State Chemistry","1999","146","","114","123","10.1006/jssc.1999.8316","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009010","5.059","0.001","5.059","0.001","11.424","0.003","90","","90","","120","","253.2","","","","","","","","","","","","","3","P 31 2 1","P 31 2""","152","","Gallium arsenate(V)","","- As Ga O4 -","- As Ga O4 -","- As3 Ga3 O12 -","3","0.5","","Philippot, E; Armand, P; Yot, P; Cambon, O; Goiffon, A; McIntyre, G J; Bordet, P","Neutron and x-ray structure refinements between 15 and 1083 K of piezoelectric gallium arsenate, Ga As O4: temperature and pressure behavior compared with other $-alpha-quartz materials","Journal of Solid State Chemistry","1999","146","","114","123","10.1006/jssc.1999.8316","","","","","","0.044","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009011","4.1549","0.0001","4.1549","0.0001","21.82729","0.0006","90","","90","","90","","376.8","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Strontium potassium dibismuthate (1.6/1.4/1)","","- Bi2 K1.4 O7 Sr1.6 -","- Bi2 K1.4 O7 Sr1.6 -","- Bi4 K2.8 O14 Sr3.2 -","2","0.0625","","Pshirkov, J S; Kazakov, S M; Bougerol-Chaillout, C; Bordet, P; Capponi, J J; Putilin, S N; Antipov, E V","A new layered bismuthate (Sr,K)3 Bi2 O7: synthesis and crystal structure","Journal of Solid State Chemistry","1999","144","","405","408","10.1006/jssc.1999.8181","","","","","","0.033","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009025","3.999","0.001","3.999","0.001","4.12","0.001","90","","90","","90","","65.9","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Lead hafnium titanium oxide (1/0.4/0.6/3)","","- Hf0.4 O3 Pb Ti0.6 -","- Hf0.42 O3 Pb Ti0.58 -","- Hf0.42 O3 Pb Ti0.58 -","1","0.125","","Muller, C; Baudour, J-L; Madigou, V; Bouree, F; Kiat, J-M; Favotto, C; Roubin, M","Temperature-dependent neutron powder diffraction evidence for splitting of the cationic sites in the ferroelectric Pb Hf0.4 Ti0.6 O3","Acta Crystallographica B (39,1983-)","1999","55","","8","16","","","","","","","0.087","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1009026","4.012","0.001","4.012","0.001","4.1","0.001","90","","90","","90","","66","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Lead hafnium titanium oxide (1/0.4/0.6/3)","","- Hf0.4 O3 Pb Ti0.6 -","- Hf0.42 O3 Pb Ti0.58 -","- Hf0.42 O3 Pb Ti0.58 -","1","0.125","","Muller, C; Baudour, J-L; Madigou, V; Bouree, F; Kiat, J-M; Favotto, C; Roubin, M","Temperature-dependent neutron powder diffraction evidence for splitting of the cationic sites in the ferroelectric Pb Hf0.4 Ti0.6 O3","Acta Crystallographica B (39,1983-)","1999","55","","8","16","","","","","","","0.073","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1009027","4.046","0.001","4.046","0.001","4.046","0.001","90","","90","","90","","66.2","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Lead hafnium titanium oxide (1/0.4/0.6/3)","","- Hf0.4 O3 Pb Ti0.6 -","- Hf0.42 O3 Pb Ti0.582 -","- Hf0.42 O3 Pb Ti0.582 -","1","0.0208333","","Muller, C; Baudour, J-L; Madigou, V; Bouree, F; Kiat, J-M; Favotto, C; Roubin, M","Temperature-dependent neutron powder diffraction evidence for splitting of the cationic sites in the ferroelectric Pb Hf0.4 Ti0.6 O3","Acta Crystallographica B (39,1983-)","1999","55","","8","16","","","","","","","0.046","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1009028","12.319","0.005","6.374","0.002","11.048","0.004","90","","90","","90","","867.5","","","","","","","","","","","","","4","P c 21 n","P -2n -2ac","33","","Lithiumozonide - ammonia(1/5)","","- H15 Li N5 O3 -","- H15 Li N5 O3 -","- H60 Li4 N20 O12 -","4","1","","Klein, W M; Jansen, M","Darstellung und Kristallstruktur von LithiumozonidAmmoniakat (1/5) (Li O3) 5(N H3)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1999","54","","1345","1349","","","","","","","0.0986","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009075","3.819","0.001","3.819","0.001","22.96399","0.005","90","","90","","90","","334.9","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Disamarium dititanium pentaoxide disulfide","","- O5 S2 Sm2 Ti2 -","- O5 S2 Sm2 Ti2 -","- O10 S4 Sm4 Ti4 -","2","0.0625","","Boyer, C; Deudon, C; Meerschaut, A","Synthesis and structure determination of the new Sm2 Ti2 O5 S2 compound","C. R. Acad. Sci. Paris, T. 1, Serie II","1999","2","","93","99","","","","","","","0.018","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1100173","9.3531","0.0011","10.5002","0.0013","15.9","0.002","90","","90","","90","","1561.53","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H22 N2 O4 -","- C15 H22 N2 O4 -","- C60 H88 N8 O16 -","4","1","","Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus","Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone","European Journal of Organic Chemistry","1999","1999","11","2977","2990","10.1002/(sici)1099-0690(199911)1999:11<2977::aid-ejoc2977>3.0.co;2-3","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100503","8.766","0.001","9.673","0.001","12.647","0.001","81.71","0.01","82.07","0.01","78.91","0.01","1034.63","","","","","","","","","","","","","4","P 1","P 1","1","","","","- C27 H25 N O2 -","- C27 H25 N O2 -","- C54 H50 N2 O4 -","2","2","","Kossenjans, Michael; Soeberdt, Michael; Wallbaum, Sabine; Harms, Klaus; Martens, Jürgen; Aurich, Hans Günter","Utilization of industrial waste materials. Part 14. Synthesis of β-amino alcohols and thiols with a 2-azabicyclo[3.3.0]octane backbone and their application in enantioselective catalysis","Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999)","1999","","16","2353","2365","10.1039/a902362c","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100504","13.9028","0.0009","15.9059","0.0009","17.6689","0.0014","90","","90","","90","","3907.24","","","","","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C36 H61 B2 Li3 O Si2 -","- C69 H100 B2 Li5 O4 Si4 -","- C276 H400 B8 Li20 O16 Si16 -","4","0.5","","Scheschkewitz, David; Menzel, Matthias; Hofmann, Matthias; Schleyer, Paul Ragué; Geiseler, Gertraud; Massa, Werner; Harms, Klaus; Berndt, Armin","A Five-Membered Ring with Three Negative Charges and Solvent-Free Lithium Counterions","Angewandte Chemie, International Edition","1999","38","19","2936","2939","10.1002/(sici)1521-3773(19991004)38:19<2936::aid-anie2936>3.0.co;2-9","","","","","","","","","","","","","","","","","","","","","has coordinates","177014","2020-10-21","18:00:00",""
"1100505","14.858","0.001","16.2","0.001","18.192","0.001","90","","90","","90","","4378.81","","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C40 H71 B2 Li3 O2 Si2 -","- C49 H95 B2 Li3 O2 Si2 -","- C196 H380 B8 Li12 O8 Si8 -","4","1","","Scheschkewitz, David; Menzel, Matthias; Hofmann, Matthias; Schleyer, Paul Ragué; Geiseler, Gertraud; Massa, Werner; Harms, Klaus; Berndt, Armin","A Five-Membered Ring with Three Negative Charges and Solvent-Free Lithium Counterions","Angewandte Chemie, International Edition","1999","38","19","2936","2939","10.1002/(sici)1521-3773(19991004)38:19<2936::aid-anie2936>3.0.co;2-9","","","","","","","","","","","","","","","","","","","","","has coordinates","177014","2020-10-21","18:00:00",""
"1100506","8.919","","15.543","0.001","21.796","0.001","90","","90","","90","","3021.54","","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C33 H36 N O6 P -","- C36 H46 N O6 P -","- C144 H184 N4 O24 P4 -","4","1","","Breit, Bernhard; Dauber, Mario; Harms, Klaus","Substrate-Directed Diastereoselective Hydroformylation: Key Step for the Assembly of Polypropionate Subunits","Chemistry - A European Journal","1999","5","10","2819","2827","10.1002/(sici)1521-3765(19991001)5:10<2819::aid-chem2819>3.0.co;2-z","","","","","","","","","","","","","","","","","","","","","has coordinates","177551","2020-10-21","18:00:00",""
"1100507","21.359","0.003","15.343","0.003","16.195","0.002","90","","102.01","0.01","90","","5191.11","","","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C44 H72 Gd N4 Na O2 Si4 -","- C88 H144 Gd N8 Na O4 Si8 -","- C352 H576 Gd4 N32 Na4 O16 Si32 -","4","0.5","","Karl, Marc; Harms, Klaus; Dehnicke, Kurt","Synthese und Kristallstrukturen der Natrium-Amido-Metallate [(THF)~2~Na(Ph~2~N)~2~Ln{N(SiMe~3~)~2~}~2~] mit Ln = Gd und Yb","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","11","1774","1776","10.1002/(sici)1521-3749(199911)625:11<1774::aid-zaac1774>3.0.co;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","177981","2020-10-21","18:00:00",""
"1100508","21.105","0.002","15.303","0.003","16.128","0.004","90","","102.2","0.01","90","","5091.22","","","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C44 H72 N4 Na O2 Si4 Yb -","- C88 H144 N8 Na O4 Si8 Yb -","- C352 H576 N32 Na4 O16 Si32 Yb4 -","4","0.5","","Karl, Marc; Harms, Klaus; Dehnicke, Kurt","Synthese und Kristallstrukturen der Natrium-Amido-Metallate [(THF)~2~Na(Ph~2~N)~2~Ln{N(SiMe~3~)~2~}~2~] mit Ln = Gd und Yb","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","11","1774","1776","10.1002/(sici)1521-3749(199911)625:11<1774::aid-zaac1774>3.0.co;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","177981","2020-10-21","18:00:00",""
"1100509","18.003","0.001","14.474","0.001","28.384","0.001","90","","90","","90","","7396.17","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C32 H74 B2 P2 -","- C33 H78 B2 P2 -","- C264 H624 B16 P16 -","8","1","","Graf, Claus-Dieter; Malan, Christophe; Harms, Klaus; Knochel, Paul","New Homochiral Ligands Bearing Nonstereogenic Chirotopic Centers. Lithiated N,N'-Dialkylureas as Chiral Bases and Sterically Crowded Phosphines for Asymmetric Catalysis","Journal of Organic Chemistry","1999","64","15","5581","5588","10.1021/jo990412u","","","","","","","","","","","","","","","","","","","","","has coordinates","177997","2020-10-21","18:00:00",""
"1100510","11.0247","0.0013","11.045","0.002","18.4469","0.002","90","","90.809","0.018","90","","2246.01","","","","","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C25 H62 Br4 Cl2 Mn4 N4 P4 -","- C25 H62 Br4 Cl2 Mn4 N4 P4 -","- C50 H124 Br8 Cl4 Mn8 N8 P8 -","2","1","","Riese, Ulrike; Faza, Naim; Massa, Werner; Harms, Klaus; Breyhan, Thees; Knochel, Paul; Ensling, Jürgen; Ksenofontov, Vadim; Gütlich, Philipp; Dehnicke, Kurt","Phosphoraneiminato Complexes of Manganese and Cobalt with Heterocubane Structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","9","1494","1499","10.1002/(sici)1521-3749(199909)625:9<1494::aid-zaac1494>3.0.co;2-u","","","","","","","","","","","","","","","","","","","","","has coordinates","176947","2020-10-21","18:00:00",""
"1100511","38.3836","0.0017","10.3026","0.0008","24.7228","0.0013","90","","94.385","0.005","90","","9748.03","","","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C20 H58 Br5 Cl4 Mn4 N12 P3 -","- C20 H56 Br5 Cl5 Mn4 N12 P3 -","- C160 H448 Br40 Cl40 Mn32 N96 P24 -","8","1","","Riese, Ulrike; Faza, Naim; Massa, Werner; Harms, Klaus; Breyhan, Thees; Knochel, Paul; Ensling, Jürgen; Ksenofontov, Vadim; Gütlich, Philipp; Dehnicke, Kurt","Phosphoraneiminato Complexes of Manganese and Cobalt with Heterocubane Structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","9","1494","1499","10.1002/(sici)1521-3749(199909)625:9<1494::aid-zaac1494>3.0.co;2-u","","","","","","","","","","","","","","","","","","","","","has coordinates","176947","2020-10-21","18:00:00",""
"1100512","12.1825","0.0007","16.2092","0.0015","24.0639","0.0014","90","","91.455","0.007","90","","4750.33","","","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H58 Br5 Cl4 Co4 N12 P3 -","- C21 H62 Br5 Cl8 Co4 N12 P3 -","- C84 H248 Br20 Cl32 Co16 N48 P12 -","4","1","","Riese, Ulrike; Faza, Naim; Massa, Werner; Harms, Klaus; Breyhan, Thees; Knochel, Paul; Ensling, Jürgen; Ksenofontov, Vadim; Gütlich, Philipp; Dehnicke, Kurt","Phosphoraneiminato Complexes of Manganese and Cobalt with Heterocubane Structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","9","1494","1499","10.1002/(sici)1521-3749(199909)625:9<1494::aid-zaac1494>3.0.co;2-u","","","","","","","","","","","","","","","","","","","","","has coordinates","176947","2020-10-21","18:00:00",""
"1100513","17.096","0.002","17.096","0.002","9.824","0.001","90","","90","","90","","2871.29","","","","","","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C10 H22 N O4 P Zn -","- C10 H22 N O5 P Zn2 -","- C80 H176 N8 O40 P8 Zn16 -","8","1","","Ackermann, H.; Geiseler, G.; Harms, K.; Leo, R.; Massa, W.; Weller, F.; Dehnicke, K.","Triethylphosphanimin-Komplexe der Acetate von Kupfer(II) und Zink. Kristallstrukturen von [Zn(O~2~C-CH~3~)~2~(HNPEt~3~)], [Cu~5~(O~2~C-CH~3~)~10~(HNPEt~3~)~2~] und [Cu(O~2~C-CH~3~)~2~(HNPEt~3~)~2~]","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","9","1500","1506","10.1002/(sici)1521-3749(199909)625:9<1500::aid-zaac1500>3.0.co;2-t","","","","","","","","","","","","","","","","","","","","","has coordinates","177954","2020-10-21","18:00:00",""
"1100514","17.6118","0.0013","40.745","0.002","17.3334","0.0015","90","","91.383","0.01","90","","12434.7","","","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H70 Cl8 Cu5 N2 O20 P2 -","- C38.5 H70 Cl8 Cu7 N3 O24.5 P2 -","- C308 H560 Cl64 Cu56 N24 O196 P16 -","8","2","","Ackermann, H.; Geiseler, G.; Harms, K.; Leo, R.; Massa, W.; Weller, F.; Dehnicke, K.","Triethylphosphanimin-Komplexe der Acetate von Kupfer(II) und Zink. Kristallstrukturen von [Zn(O~2~C-CH~3~)~2~(HNPEt~3~)], [Cu~5~(O~2~C-CH~3~)~10~(HNPEt~3~)~2~] und [Cu(O~2~C-CH~3~)~2~(HNPEt~3~)~2~]","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","9","1500","1506","10.1002/(sici)1521-3749(199909)625:9<1500::aid-zaac1500>3.0.co;2-t","","","","","","","","","","","","","","","","","","","","","has coordinates","177954","2020-10-21","18:00:00",""
"1100515","6.9549","0.0008","12.1785","0.001","13.8005","0.0007","90","","96.451","0.007","90","","1161.5","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H38 Cu N2 O4 P2 -","- C32 H76 Cu N4 O8 P4 -","- C64 H152 Cu2 N8 O16 P8 -","2","0.5","","Ackermann, H.; Geiseler, G.; Harms, K.; Leo, R.; Massa, W.; Weller, F.; Dehnicke, K.","Triethylphosphanimin-Komplexe der Acetate von Kupfer(II) und Zink. Kristallstrukturen von [Zn(O~2~C-CH~3~)~2~(HNPEt~3~)], [Cu~5~(O~2~C-CH~3~)~10~(HNPEt~3~)~2~] und [Cu(O~2~C-CH~3~)~2~(HNPEt~3~)~2~]","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","9","1500","1506","10.1002/(sici)1521-3749(199909)625:9<1500::aid-zaac1500>3.0.co;2-t","","","","","","","","","","","","","","","","","","","","","has coordinates","177954","2020-10-21","18:00:00",""
"1100516","6.376","0.001","18.155","0.002","19.422","0.001","90","","90","","90","","2248.22","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H32 N2 O2 -","- C25 H32 N2 O2 -","- C100 H128 N8 O8 -","4","1","","Aurich, Hans Günter; Soeberdt, Michael; Harms, Klaus","Formation of enantiopure β-amino alcohols with a 3-oxa-2,7-diazabicyclo[3.3.0]octane framework","Tetrahedron","1999","55","5","1249","1270","10.1016/s0040-4020(98)01117-x","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100517","7.515","0.001","13.748","0.001","18.678","0.001","90","","90","","90","","1929.74","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H26 N2 O2 -","- C22 H26 N2 O2 -","- C88 H104 N8 O8 -","4","1","","Aurich, Hans Günter; Soeberdt, Michael; Harms, Klaus","Formation of enantiopure β-amino alcohols with a 3-oxa-2,7-diazabicyclo[3.3.0]octane framework","Tetrahedron","1999","55","5","1249","1270","10.1016/s0040-4020(98)01117-x","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100518","19.522","0.002","5.321","0.001","21.728","0.001","90","","102.53","0.01","90","","2203.27","","","","","","","","","","","","","4","I 1 2 1","I 2y","5","","","","- C26 H28 N2 O2 -","- C26 H28 N2 O2 -","- C104 H112 N8 O8 -","4","1","","Aurich, Hans Günter; Soeberdt, Michael; Harms, Klaus","Formation of enantiopure β-amino alcohols with a 3-oxa-2,7-diazabicyclo[3.3.0]octane framework","Tetrahedron","1999","55","5","1249","1270","10.1016/s0040-4020(98)01117-x","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100519","29.414","0.002","12.0546","0.0007","29.524","0.003","90","","113.455","0.008","90","","9603.47","","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H77 N3 Na O3 Sc Si6 -","- C34.5 H86.5 N3 Na O3 Sc Si6 -","- C276 H692 N24 Na8 O24 Sc8 Si48 -","8","2","","Karl, Marc; Harms, Klaus; Seybert, Gerd; Massa, Werner; Fau, Stefan; Frenking, Gernot; Dehnicke, Kurt","Die Deprotonierung silylierter Amido-Komplexe von Seltenerdelementen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","12","2055","2063","10.1002/(sici)1521-3749(199912)625:12<2055::aid-zaac2055>3.0.co;2-y","","","","","","","","","","","","","","","","","","","","","has coordinates","177982","2020-10-21","18:00:00",""
"1100520","29.4389","0.0012","12.1954","0.0007","29.4429","0.0013","90","","113.372","0.004","90","","9703.24","","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H77 N3 Na O3 Si6 Yb -","- C30 H75.5 N3 Na O3 Si6 Yb -","- C240 H604 N24 Na8 O24 Si48 Yb8 -","8","2","","Karl, Marc; Harms, Klaus; Seybert, Gerd; Massa, Werner; Fau, Stefan; Frenking, Gernot; Dehnicke, Kurt","Die Deprotonierung silylierter Amido-Komplexe von Seltenerdelementen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","12","2055","2063","10.1002/(sici)1521-3749(199912)625:12<2055::aid-zaac2055>3.0.co;2-y","","","","","","","","","","","","","","","","","","","","","has coordinates","177982","2020-10-21","18:00:00",""
"1100521","11.7699","0.0009","12.0749","0.0011","16.1429","0.0015","73.634","0.01","82.091","0.01","74.391","0.01","2115.35","","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C60 H138 N8 Si12 Yb2 -","- C120 H252 N16 Si24 Yb4 -","- C120 H252 N16 Si24 Yb4 -","1","0.5","","Karl, Marc; Harms, Klaus; Seybert, Gerd; Massa, Werner; Fau, Stefan; Frenking, Gernot; Dehnicke, Kurt","Die Deprotonierung silylierter Amido-Komplexe von Seltenerdelementen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","12","2055","2063","10.1002/(sici)1521-3749(199912)625:12<2055::aid-zaac2055>3.0.co;2-y","","","","","","","","","","","","","","","","","","","","","has coordinates","177982","2020-10-21","18:00:00",""
"1100522","11.2665","0.0008","14.5925","0.0013","17.4113","0.0012","90","","96.461","0.008","90","","2844.35","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H42 N2 Na2 O2 Si2 -","- C24 H48 N2 Na2 O2 Si2 -","- C96 H192 N8 Na8 O8 Si8 -","4","1","","Karl, Marc; Harms, Klaus; Seybert, Gerd; Massa, Werner; Fau, Stefan; Frenking, Gernot; Dehnicke, Kurt","Die Deprotonierung silylierter Amido-Komplexe von Seltenerdelementen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","12","2055","2063","10.1002/(sici)1521-3749(199912)625:12<2055::aid-zaac2055>3.0.co;2-y","","","","","","","","","","","","","","","","","","","","","has coordinates","177982","2020-10-21","18:00:00",""
"1100525","6.555","0.002","7.984","0.002","9.859","0.003","90","","97.15","0.04","90","","511.96","","","","123","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H10 As2 Ti -","- C26 As8 Ti -","- C52 As16 Ti2 -","2","0.5","","Elschenbroich, Christoph; Kroker, Jörg; Nowotny, Mathias; Behrendt, Andreas; Metz, Bernhard; Harms, Klaus","η^6^-Coordination of Arsenine to Titanium, Vanadium, and Chromium","Organometallics","1999","18","8","1495","1503","10.1021/om9810091","","","","","","","","","","","","","","","","","","","","","has coordinates","183818","2020-10-21","18:00:00",""
"1100526","12.2612","0.0018","12.8839","0.0017","13.2646","0.0019","102.19","0.016","103.921","0.017","91.472","0.017","1981.56","","","","223","","","","","","","","","4","P -1","-P 1","2","","","","- C10 H10 As2 Ti -","- C10.5 H10.5 As2 Ti -","- C84 H84 As16 Ti8 -","8","4","","Elschenbroich, Christoph; Kroker, Jörg; Nowotny, Mathias; Behrendt, Andreas; Metz, Bernhard; Harms, Klaus","η^6^-Coordination of Arsenine to Titanium, Vanadium, and Chromium","Organometallics","1999","18","8","1495","1503","10.1021/om9810091","","","","","","","","","","","","","","","","","","","","","has coordinates","183818","2020-10-21","18:00:00",""
"1100531","5.9874","0.001","17.461","0.002","12.965","0.002","90","","95.339","0.016","90","","1349.56","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H19 N O2 -","- C16 H19 N O2 -","- C64 H76 N4 O8 -","4","1","","Bach, Thorsten; Pelkmann, Christa; Harms, Klaus","Facial diastereoselectivity in the [2+2]-photocycloaddition of chiral vinylglycine-derived N,N-diallyl amines","Tetrahedron Letters","1999","40","11","2103","2104","10.1016/s0040-4039(99)00158-6","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100532","20.878","0.0015","10.9095","0.0005","19.5635","0.0014","90","","115.904","0.007","90","","4008.25","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H60 Cl4 Fe4 N4 P4 -","- C50 H130 Cl8 Fe8 N8 P8 -","- C200 H520 Cl32 Fe32 N32 P32 -","4","0.5","","Riese, Ulrike; Harms, Klaus; Pebler, Jürgen; Dehnicke, Kurt","Phosphaniminato-Cluster von Eisen. Die Kristallstrukturen von [FeCl(NPEt~3~)]~4~, [Fe(C=C-SiMe~3~)(NPEt~3~)]~4~ und [Fe~3~Cl~4~{NP(NMe~2~)~3~}~3~]","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","5","746","754","10.1002/(sici)1521-3749(199905)625:5<746::aid-zaac746>3.0.co;2-h","","","","","","","","","","","","","","","","","","","","","has coordinates","177977","2020-10-21","18:00:00",""
"1100533","10.532","0.003","13.185","0.004","23.378","0.007","90","","96.33","0.02","90","","3226.58","","","","","","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","","","- C44 H96 Fe4 N4 P4 Si4 -","- C88 H192 Fe8 N8 P8 Si8 -","- C176 H384 Fe16 N16 P16 Si16 -","2","0.5","","Riese, Ulrike; Harms, Klaus; Pebler, Jürgen; Dehnicke, Kurt","Phosphaniminato-Cluster von Eisen. Die Kristallstrukturen von [FeCl(NPEt~3~)]~4~, [Fe(C=C-SiMe~3~)(NPEt~3~)]~4~ und [Fe~3~Cl~4~{NP(NMe~2~)~3~}~3~]","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","5","746","754","10.1002/(sici)1521-3749(199905)625:5<746::aid-zaac746>3.0.co;2-h","","","","","","","","","","","","","","","","","","","","","has coordinates","177977","2020-10-21","18:00:00",""
"1100534","10.1172","0.0013","12.057","0.003","17.312","0.002","91.389","0.008","100.733","0.014","105.794","0.019","1990.21","","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C21 H57 Cl4 Fe3 N12 P3 -","- C25 H63 Cl4 Fe3 N12 P3 -","- C50 H126 Cl8 Fe6 N24 P6 -","2","1","","Riese, Ulrike; Harms, Klaus; Pebler, Jürgen; Dehnicke, Kurt","Phosphaniminato-Cluster von Eisen. Die Kristallstrukturen von [FeCl(NPEt~3~)]~4~, [Fe(C=C-SiMe~3~)(NPEt~3~)]~4~ und [Fe~3~Cl~4~{NP(NMe~2~)~3~}~3~]","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","5","746","754","10.1002/(sici)1521-3749(199905)625:5<746::aid-zaac746>3.0.co;2-h","","","","","","","","","","","","","","","","","","","","","has coordinates","177977","2020-10-21","18:00:00",""
"1100538","10.902","0.001","12.062","0.001","12.428","0.001","91.84","0.01","106.6","0.01","99.84","0.01","1537.45","","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C58 H48 Cl10 F4 I2 P2 -","- C64 H48 Cl10 F8 I4 P2 -","- C64 H48 Cl10 F8 I4 P2 -","1","0.5","","Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Dehnicke, Kurt","Donor-Akzeptor-Komplexe von Halogenidionen mit 1.4-Diiodtetrafluorbenzol / Donor-Acceptor Complexes of Halide Ions with 1,4-Diiodotetrafluorobenzene","Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences","1999","54","1","77","86","10.1515/znb-1999-0116","","","","","","","","","","","","","","","","","","","","","has coordinates","177130","2020-10-21","18:00:00",""
"1100539","11.297","0.002","11.839","0.001","12.934","0.001","65.52","0.01","65.74","0.01","89.02","0.01","1410.66","","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C56 H44 Br2 Cl4 F4 I2 P2 -","- C62 H44 Br2 Cl4 F8 I4 P2 -","- C62 H44 Br2 Cl4 F8 I4 P2 -","1","0.5","","Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Dehnicke, Kurt","Donor-Akzeptor-Komplexe von Halogenidionen mit 1.4-Diiodtetrafluorbenzol / Donor-Acceptor Complexes of Halide Ions with 1,4-Diiodotetrafluorobenzene","Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences","1999","54","1","77","86","10.1515/znb-1999-0116","","","","","","","","","","","","","","","","","","","","","has coordinates","177130","2020-10-21","18:00:00",""
"1100540","7.148","0.001","24.057","0.003","9.308","0.001","90","","96.38","0.01","90","","1590.69","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H12 Cl F4 I2 N -","- C16 H12 Cl F8 I4 N -","- C64 H48 Cl4 F32 I16 N4 -","4","1","","Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Dehnicke, Kurt","Donor-Akzeptor-Komplexe von Halogenidionen mit 1.4-Diiodtetrafluorbenzol / Donor-Acceptor Complexes of Halide Ions with 1,4-Diiodotetrafluorobenzene","Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences","1999","54","1","77","86","10.1515/znb-1999-0116","","","","","","","","","","","","","","","","","","","","","has coordinates","177130","2020-10-21","18:00:00",""
"1100541","14.008","0.001","16.699","0.002","7.959","0.001","90","","102.81","0.01","90","","1815.43","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H15 Br F4 I2 N2 -","- C12 H15 Br F4 I2 N2 -","- C48 H60 Br4 F16 I8 N8 -","4","1","","Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Dehnicke, Kurt","Donor-Akzeptor-Komplexe von Halogenidionen mit 1.4-Diiodtetrafluorbenzol / Donor-Acceptor Complexes of Halide Ions with 1,4-Diiodotetrafluorobenzene","Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences","1999","54","1","77","86","10.1515/znb-1999-0116","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100542","21.06","0.004","15.668","0.003","24.458","0.004","90","","90","","90","","8070.36","","","","","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C70 H48 Br2 Cl8 F12 I6 P2 -","- C76 H48 Br2 Cl8 F16 I8 P2 -","- C304 H192 Br8 Cl32 F64 I32 P8 -","4","0.5","","Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Dehnicke, Kurt","Donor-Akzeptor-Komplexe von Halogenidionen mit 1.4-Diiodtetrafluorbenzol / Donor-Acceptor Complexes of Halide Ions with 1,4-Diiodotetrafluorobenzene","Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences","1999","54","1","77","86","10.1515/znb-1999-0116","","","","","","","","","","","","","","","","","","","","","has coordinates","177130","2020-10-21","18:00:00",""
"1100543","11.509","0.001","12.789","0.001","12.929","0.002","65.47","0.01","82.07","0.01","83.62","0.01","1711.62","","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C66 H40 F12 I8 P2 -","- C72 H40 F16 I10 P2 -","- C72 H40 F16 I10 P2 -","1","0.5","","Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Dehnicke, Kurt","Donor-Akzeptor-Komplexe von Halogenidionen mit 1.4-Diiodtetrafluorbenzol / Donor-Acceptor Complexes of Halide Ions with 1,4-Diiodotetrafluorobenzene","Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences","1999","54","1","77","86","10.1515/znb-1999-0116","","","","","","","","","","","","","","","","","","","","","has coordinates","177130","2020-10-21","18:00:00",""
"1100544","12.105","0.005","14.29","0.006","24.703","0.012","90","","90","","90","","4273.14","","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H24 F12 I8 N2 -","- C32 H24 F16 I10 N2 -","- C128 H96 F64 I40 N8 -","4","0.5","","Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Dehnicke, Kurt","Donor-Akzeptor-Komplexe von Halogenidionen mit 1.4-Diiodtetrafluorbenzol / Donor-Acceptor Complexes of Halide Ions with 1,4-Diiodotetrafluorobenzene","Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences","1999","54","1","77","86","10.1515/znb-1999-0116","","","","","","","","","","","","","","","","","","","","","has coordinates","177130","2020-10-21","18:00:00",""
"1100552","5.9843","0.0004","15.9963","0.0011","21.462","0.002","90","","90","","90","","2054.49","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H29 N O2 -","- C27 H29 N O2 -","- C108 H116 N4 O8 -","4","1","","Aurich, Hans Günter; Soeberdt, Michael; Harms, Klaus","Formation of Chiral N-Oxides from 2-Azabicyclo[3.3.0]octanes","European Journal of Organic Chemistry","1999","1999","5","1249","1252","10.1002/(sici)1099-0690(199905)1999:5<1249::aid-ejoc1249>3.0.co;2-p","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100553","8.882","0.003","8.045","0.0012","8.9151","0.0016","90","","116.865","0.018","90","","568.28","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H21 N O3 -","- C10 H21 N O3 -","- C20 H42 N2 O6 -","2","1","","Aurich, Hans Günter; Soeberdt, Michael; Harms, Klaus","Formation of Chiral N-Oxides from 2-Azabicyclo[3.3.0]octanes","European Journal of Organic Chemistry","1999","1999","5","1249","1252","10.1002/(sici)1099-0690(199905)1999:5<1249::aid-ejoc1249>3.0.co;2-p","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100554","9.577","0.001","17.991","0.004","10.827","0.001","90","","112.46","0.01","90","","1723.99","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 N O3 P Re -","- C18 H15 N O3 P Re -","- C72 H60 N4 O12 P4 Re4 -","4","1","","Schlecht, Sabine; Deubel, Dirk V.; Frenking, Gernot; Geiseler, Gertraud; Harms, Klaus; Magull, Jörg; Dehnicke, Kurt","Phosphaniminato-Komplexe von Rhenium(VII). Synthesen und Kristallstrukturen von [ReO~3~(NPR~3~)] (R = Ph, Et) sowie von [ReO(OSiMe~3~)~3~(Me~3~SiNPEt~3~)]","Zeitschrift für Anorganische und Allgemeine Chemie","1999","625","6","887","891","10.1002/(sici)1521-3749(199906)625:6<887::aid-zaac887>3.0.co;2-s","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100555","8.3","0.001","11.749","0.001","11.465","0.001","90","","95.68","0.01","90","","1112.54","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C6 H15 N O3 P Re -","- C6 H15 N O3 P Re -","- C24 H60 N4 O12 P4 Re4 -","4","1","","Schlecht, Sabine; Deubel, Dirk V.; Frenking, Gernot; Geiseler, Gertraud; Harms, Klaus; Magull, Jörg; Dehnicke, Kurt","Phosphaniminato-Komplexe von Rhenium(VII). Synthesen und Kristallstrukturen von [ReO~3~(NPR~3~)] (R = Ph, Et) sowie von [ReO(OSiMe~3~)~3~(Me~3~SiNPEt~3~)]","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","6","887","891","10.1002/(sici)1521-3749(199906)625:6<887::aid-zaac887>3.0.co;2-s","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100556","11.7748","0.0009","11.9929","0.0009","13.0829","0.001","105.841","0.005","99.654","0.006","110.541","0.005","1591.55","","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C18 H51 N O4 P Re Si4 -","- C18 H51 N O4 P Re Si4 -","- C36 H102 N2 O8 P2 Re2 Si8 -","2","1","","Schlecht, Sabine; Deubel, Dirk V.; Frenking, Gernot; Geiseler, Gertraud; Harms, Klaus; Magull, Jörg; Dehnicke, Kurt","Phosphaniminato-Komplexe von Rhenium(VII). Synthesen und Kristallstrukturen von [ReO~3~(NPR~3~)] (R = Ph, Et) sowie von [ReO(OSiMe~3~)~3~(Me~3~SiNPEt~3~)]","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","6","887","891","10.1002/(sici)1521-3749(199906)625:6<887::aid-zaac887>3.0.co;2-s","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100557","21.0503","0.0018","11.958","0.001","7.282","0.001","90","","92.55","0.01","90","","1831.21","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H62 Bi2 F4 N4 P4 -","- C48 H124 Bi4 F8 N8 P8 -","- C96 H248 Bi8 F16 N16 P16 -","2","0.5","","Chitsaz, Soheila; Harms, Klaus; Neumüller, Bernhard; Dehnicke, Kurt","Phosphaniminato-Komplexe von Bismut(III). Die Kristallstrukturen von [BiF~2~(NPEt~3~)(HNPEt~3~)]~2~ und [Bi~2~I(NPPh~3~)~4~]I~3~","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","6","939","944","10.1002/(sici)1521-3749(199906)625:6<939::aid-zaac939>3.0.co;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","177979","2020-10-21","18:00:00",""
"1100558","15.426","0.002","24.091","0.004","21.735","0.005","90","","105.82","0.02","90","","7771.38","","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C74.5 H65 Bi2 Cl5 I4 N4 P4 -","- C87 H82 Bi2 Cl10 I4 N4 P4 -","- C348 H328 Bi8 Cl40 I16 N16 P16 -","4","1","","Chitsaz, Soheila; Harms, Klaus; Neumüller, Bernhard; Dehnicke, Kurt","Phosphaniminato-Komplexe von Bismut(III). Die Kristallstrukturen von [BiF~2~(NPEt~3~)(HNPEt~3~)]~2~ und [Bi~2~I(NPPh~3~)~4~]I~3~","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","6","939","944","10.1002/(sici)1521-3749(199906)625:6<939::aid-zaac939>3.0.co;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","177979","2020-10-21","18:00:00",""
"1100559","14.2265","0.001","22.3013","0.0009","17.9123","0.0017","90","","109.639","0.007","90","","5352.44","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C31 H32 O3 P2 -","- C31 H32 O3 P2 -","- C248 H256 O24 P16 -","8","1","","Demay, Stéphane; Harms, Klaus; Knochel, Paul","Stereoselective preparation of phosphine oxides via a 2,3-sigmatropic shift of allylic diphenylphosphinites","Tetrahedron Letters","1999","40","27","4981","4984","10.1016/s0040-4039(99)00952-1","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100560","10.832","0.001","11.622","0.001","11.833","0.001","90","","96.88","0.01","90","","1478.92","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C36 H36 O2 P2 -","- C36 H36 O2 P2 -","- C72 H72 O4 P4 -","2","1","","Demay, Stéphane; Harms, Klaus; Knochel, Paul","Stereoselective preparation of phosphine oxides via a 2,3-sigmatropic shift of allylic diphenylphosphinites","Tetrahedron Letters","1999","40","27","4981","4984","10.1016/s0040-4039(99)00952-1","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100561","10.187","0.002","12.329","0.002","12.873","0.002","81.94","0.01","66.61","0.01","71.62","0.01","1408.02","","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H25 Cl3 I P -","- C30 H25 Cl3 I P -","- C60 H50 Cl6 I2 P2 -","2","1","","Grebe, Jutta; Geiseier, Gertraud; Harms, Klaus; Dehnicke, Kurt","Synthese und Kristallstruktur von PPh~4~[PhICl~3~] / Synthesis and Crystal Structure of PPh~4~[PhICl~3~]","Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences","1999","54","1","140","143","10.1515/znb-1999-0126","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100564","14.9985","0.001","16.5396","0.0007","11.5064","0.0007","90","","92.466","0.006","90","","2851.74","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 Cl4 P2 Pt -","- C27 H28 Cl4 P2 Pt -","- C108 H112 Cl16 P8 Pt4 -","4","1","","Elschenbroich, Christoph; Voß, Steffen; Harms, Klaus","Metal Complexes of Heteroarenes, X [1]. η^1^-Coordination of Phosphinine: Synthesis and Structure of cis-Dichloro-bis(2,6-dimethyl-4-phenyl-phosphinine)platinum","Zeitschrift für Naturforschung, B: A Journal of Chemical Sciences","1999","54","2","209","213","10.1515/znb-1999-0209","","","","","","","","","","","","","","","","","","","","","has coordinates","177132","2020-10-21","18:00:00",""
"1100566","9.332","0.002","14.066","0.001","23.767","0.002","94.19","0.01","101.15","0.01","96.89","0.01","3023.88","","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C60 H45 F4 I7 N3 P3 -","- C66 H45 F8 I9 N3 P3 -","- C132 H90 F16 I18 N6 P6 -","2","1","","Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Neumüller, Bernhard; Dehnicke, Kurt","Domino Effect in the Buildup of N-I-N-I Chains of the N-Iodine(triphenylphosphane)imine","Angewandte Chemie, International Edition","1999","38","1-2","222","225","10.1002/(sici)1521-3773(19990115)38:1/2<222::aid-anie222>3.0.co;2-5","","","","","","","","","","","","","","","","","","","","","has coordinates","177005","2020-10-21","18:00:00",""
"1100567","9.856","0.001","13.461","0.001","16.698","0.001","95.99","0.01","94.87","0.01","97.53","0.01","2173.31","","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C37 H32 Cl2 I6 N2 P2 -","- C37 H33 Cl2 I6 N2 P2 -","- C74 H66 Cl4 I12 N4 P4 -","2","1","","Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Neumüller, Bernhard; Dehnicke, Kurt","Domino Effect in the Buildup of N-I-N-I Chains of the N-Iodine(triphenylphosphane)imine","Angewandte Chemie, International Edition","1999","38","1-2","222","225","10.1002/(sici)1521-3773(19990115)38:1/2<222::aid-anie222>3.0.co;2-5","","","","","","","","","","","","","","","","","","","","","has coordinates","177005","2020-10-21","18:00:00",""
"1100568","16.16","0.001","24.931","0.002","17.921","0.001","90","","96.54","0.01","90","","7173.12","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C72 H60 I8 N4 P4 -","- C72 H60 I8 N4 P4 -","- C288 H240 I32 N16 P16 -","4","0.5","","Grebe, Jutta; Geiseler, Gertraud; Harms, Klaus; Neumüller, Bernhard; Dehnicke, Kurt","Domino Effect in the Buildup of N-I-N-I Chains of the N-Iodine(triphenylphosphane)imine","Angewandte Chemie, International Edition","1999","38","1-2","222","225","10.1002/(sici)1521-3773(19990115)38:1/2<222::aid-anie222>3.0.co;2-5","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100569","9.055","0.002","13.424","0.002","15.699","0.003","75.51","0.02","78.26","0.02","85.15","0.02","1807.79","","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C40 H48 O3 Si2 -","- C40 H48 O3 Si2 -","- C80 H96 O6 Si4 -","2","1","","Berninger, Jörn; Krauss, Rolf; Weinig, Hans-Georg; Koert, Ulrich; Ziemer, Burkhard; Harms, Klaus","2,3,6,7-Tetrasubstituted Perhydroanthracenes: Stereoselective Synthesis and Biconformationality Studies","European Journal of Organic Chemistry","1999","1999","4","875","884","10.1002/(sici)1099-0690(199904)1999:4<875::aid-ejoc875>3.0.co;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100570","10.197","0.002","35.713","0.004","13.51","0.003","90","","98.48","0.01","90","","4866.09","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C55 H66 O5 Si2 -","- C55 H66 O5 Si2 -","- C220 H264 O20 Si8 -","4","1","","Berninger, Jörn; Krauss, Rolf; Weinig, Hans-Georg; Koert, Ulrich; Ziemer, Burkhard; Harms, Klaus","2,3,6,7-Tetrasubstituted Perhydroanthracenes: Stereoselective Synthesis and Biconformationality Studies","European Journal of Organic Chemistry","1999","1999","4","875","884","10.1002/(sici)1099-0690(199904)1999:4<875::aid-ejoc875>3.0.co;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100571","10.892","0.003","14.457","0.004","29.015","0.008","100.29","0.03","96.06","0.03","90.11","0.03","4469.25","","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C22 H39 O6.5 -","- C22 H39 O6.5 -","- C176 H312 O52 -","8","4","","Berninger, Jörn; Krauss, Rolf; Weinig, Hans-Georg; Koert, Ulrich; Ziemer, Burkhard; Harms, Klaus","2,3,6,7-Tetrasubstituted Perhydroanthracenes: Stereoselective Synthesis and Biconformationality Studies","European Journal of Organic Chemistry","1999","1999","4","875","884","10.1002/(sici)1099-0690(199904)1999:4<875::aid-ejoc875>3.0.co;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100577","22.753","0.002","22.2736","0.0014","23.844","0.002","90","","94.925","0.015","90","","12039.3","","","","","","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C37 H95 N3 Na O9 Si7 Sm -","- C37 H95 N3 Na O9 Si7 Sm -","- C296 H760 N24 Na8 O72 Si56 Sm8 -","8","1","","Karl, M.; Seybert, G.; Massa, W.; Harms, K.; Agarwal, S.; Maleika, R.; Stelter, W.; Greiner, A.; Neumüller, W.; Heitz, B.; Dehnicke, K.","Amidometallate von Seltenerdelementen. Synthese und Kristallstrukturen von [Na(12-Krone-4)~2~][M{N(SiMe~3~)~2~}~3~(OSiMe~3~)] (M = Sm, Yb), [Na(THF)~3~Sm{N(SiMe~3~)~2~}~3~(C≡C-Ph)], [Na(THF)~6~][Lu~2~(μ-NH~2~)(μ-NSiMe~3~){N(SiMe~3~)~2~}~4~] sowie von [NaN(SiMe~3~)~2~(THF)]~2~. Anwendungen der Seltenerdkomplexe als Polymerisationskatalysatoren","Zeitschrift für anorganische und allgemeine Chemie","1999","625","8","1301","1309","10.1002/(sici)1521-3749(199908)625:8<1301::aid-zaac1301>3.0.co;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100578","22.416","0.0016","22.2972","0.0015","23.7339","0.0013","90","","95.441","0.008","90","","11809.1","","","","","","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C37 H95 N3 Na O9 Si7 Yb -","- C37 H95 N3 Na O9 Si7 Yb -","- C296 H760 N24 Na8 O72 Si56 Yb8 -","8","1","","Karl, M.; Seybert, G.; Massa, W.; Harms, K.; Agarwal, S.; Maleika, R.; Stelter, W.; Greiner, A.; Neumüller, W.; Heitz, B.; Dehnicke, K.","Amidometallate von Seltenerdelementen. Synthese und Kristallstrukturen von [Na(12-Krone-4)~2~][M{N(SiMe~3~)~2~}~3~(OSiMe~3~)] (M = Sm, Yb), [Na(THF)~3~Sm{N(SiMe~3~)~2~}~3~(C≡C-Ph)], [Na(THF)~6~][Lu~2~(μ-NH~2~)(μ-NSiMe~3~){N(SiMe~3~)~2~}~4~] sowie von [NaN(SiMe~3~)~2~(THF)]~2~. Anwendungen der Seltenerdkomplexe als Polymerisationskatalysatoren","Zeitschrift für anorganische und allgemeine Chemie","1999","625","8","1301","1309","10.1002/(sici)1521-3749(199908)625:8<1301::aid-zaac1301>3.0.co;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100579","13.4447","0.001","23.2529","0.0014","17.3216","0.0014","90","","93.549","0.009","90","","5404.84","","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C38 H83 N3 Na O3 Si6 Sm -","- C38 H83 N3 Na O3 Si6 Sm -","- C152 H332 N12 Na4 O12 Si24 Sm4 -","4","1","","Karl, M.; Seybert, G.; Massa, W.; Harms, K.; Agarwal, S.; Maleika, R.; Stelter, W.; Greiner, A.; Neumüller, W.; Heitz, B.; Dehnicke, K.","Amidometallate von Seltenerdelementen. Synthese und Kristallstrukturen von [Na(12-Krone-4)~2~][M{N(SiMe~3~)~2~}~3~(OSiMe~3~)] (M = Sm, Yb), [Na(THF)~3~Sm{N(SiMe~3~)~2~}~3~(C≡C-Ph)], [Na(THF)~6~][Lu~2~(μ-NH~2~)(μ-NSiMe~3~){N(SiMe~3~)~2~}~4~] sowie von [NaN(SiMe~3~)~2~(THF)]~2~. Anwendungen der Seltenerdkomplexe als Polymerisationskatalysatoren","Zeitschrift für anorganische und allgemeine Chemie","1999","625","8","1301","1309","10.1002/(sici)1521-3749(199908)625:8<1301::aid-zaac1301>3.0.co;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","178218","2020-10-21","18:00:00",""
"1100580","15.423","0.002","19.946","0.004","26.039","0.006","90","","90","","90","","8010.3","","","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C51 H131 Lu2 N6 Na O6 Si9 -","- C51 H131 Lu2 N6 Na O6 Si9 -","- C204 H524 Lu8 N24 Na4 O24 Si36 -","4","1","","Karl, M.; Seybert, G.; Massa, W.; Harms, K.; Agarwal, S.; Maleika, R.; Stelter, W.; Greiner, A.; Neumüller, W.; Heitz, B.; Dehnicke, K.","Amidometallate von Seltenerdelementen. Synthese und Kristallstrukturen von [Na(12-Krone-4)~2~][M{N(SiMe~3~)~2~}~3~(OSiMe~3~)] (M = Sm, Yb), [Na(THF)~3~Sm{N(SiMe~3~)~2~}~3~(C≡C-Ph)], [Na(THF)~6~][Lu~2~(μ-NH~2~)(μ-NSiMe~3~){N(SiMe~3~)~2~}~4~] sowie von [NaN(SiMe~3~)~2~(THF)]~2~. Anwendungen der Seltenerdkomplexe als Polymerisationskatalysatoren","Zeitschrift für anorganische und allgemeine Chemie","1999","625","8","1301","1309","10.1002/(sici)1521-3749(199908)625:8<1301::aid-zaac1301>3.0.co;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","178218","2020-10-21","18:00:00",""
"1100581","9.03","0.001","10.465","0.001","10.558","0.001","110.03","0.01","112.91","0.01","96.8","0.01","826.09","","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H52 N2 Na2 O2 Si4 -","- C52 H140 N4 Na4 O4 Si8 -","- C52 H140 N4 Na4 O4 Si8 -","1","0.5","","Karl, M.; Seybert, G.; Massa, W.; Harms, K.; Agarwal, S.; Maleika, R.; Stelter, W.; Greiner, A.; Neumüller, W.; Heitz, B.; Dehnicke, K.","Amidometallate von Seltenerdelementen. Synthese und Kristallstrukturen von [Na(12-Krone-4)~2~][M{N(SiMe~3~)~2~}~3~(OSiMe~3~)] (M = Sm, Yb), [Na(THF)~3~Sm{N(SiMe~3~)~2~}~3~(C≡C-Ph)], [Na(THF)~6~][Lu~2~(μ-NH~2~)(μ-NSiMe~3~){N(SiMe~3~)~2~}~4~] sowie von [NaN(SiMe~3~)~2~(THF)]~2~. Anwendungen der Seltenerdkomplexe als Polymerisationskatalysatoren","Zeitschrift für anorganische und allgemeine Chemie","1999","625","8","1301","1309","10.1002/(sici)1521-3749(199908)625:8<1301::aid-zaac1301>3.0.co;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","178218","2020-10-21","18:00:00",""
"1100584","8.145","0.001","11.17","0.001","13.241","0.001","105.19","0.01","106.46","0.01","101.38","0.01","1065.85","0.18","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H30 N2 O5 -","- C24 H30 N2 O5 -","- C48 H60 N4 O10 -","2","1","","Bach, Thorsten; Bergmann, Hermann; Harms, Klaus","High Facial Diastereoselectivity in the Photocycloaddition of a Chiral Aromatic Aldehyde and an Enamide Induced by Intermolecular Hydrogen Bonding","Journal of the American Chemical Society","1999","121","","10650","10651","10.1021/ja992209m","","","1.54178","CuKα","","0.0745","0.0483","","","0.1135","0.127","","","","","","1.047","","","","has coordinates","277831","2022-09-14","14:31:32",""
"1100585","10.5303","0.0004","11.7446","0.0008","14.8819","0.0006","90","","101.617","0.004","90","","1802.8","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H25 N O2 -","- C24 H34 N O2 -","- C96 H136 N4 O8 -","4","1","","Bach, Thorsten; Schröder, Jürgen; Harms, Klaus","Diastereoselective photocycloaddition of an axial chiral enamide","Tetrahedron Letters","1999","40","51","9003","9004","10.1016/s0040-4039(99)01933-4","","","","","","","","","","","","","","","","","","","","","has coordinates","176945","2020-10-21","18:00:00",""
"1100588","10.667","0.002","29.67","0.004","15.9184","0.0019","90","","90.768","0.011","90","","5037.56","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H38 S Sn -","- C26 H38 S Sn -","- C208 H304 S8 Sn8 -","8","2","","Hoffmann, Reinhard W.; Koberstein, Ralf; Harms, Klaus","Chiral organometallic reagents. Part XXIII. On the stereochemistry of the carbolithiation reaction of vinyl sulfides","Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999)","1999","","2","183","192","10.1039/a808116f","","","","","","","","","","","","","","","","","","","","","has coordinates","177446","2020-10-21","18:00:00",""
"1100589","39.963","0.004","6.056","0.001","18.185","0.002","90","","112.21","0.01","90","","4074.52","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C24 H32 S -","- C24 H32 S -","- C192 H256 S8 -","8","1","","Hoffmann, Reinhard W.; Koberstein, Ralf; Harms, Klaus","Chiral organometallic reagents. Part XXIII. On the stereochemistry of the carbolithiation reaction of vinyl sulfides","Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999)","1999","","2","183","192","10.1039/a808116f","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100590","10.621","0.001","10.918","0.001","11.842","0.001","77.56","0.01","67.2","0.01","81.25","0.01","1232.58","","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C30 H36 O S -","- C30 H36 O S -","- C60 H72 O2 S2 -","2","1","","Hoffmann, Reinhard W.; Koberstein, Ralf; Harms, Klaus","Chiral organometallic reagents. Part XXIII. On the stereochemistry of the carbolithiation reaction of vinyl sulfides","Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999)","1999","","2","183","192","10.1039/a808116f","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100591","13.613","0.001","16.073","0.001","22.718","0.001","90","","90","","90","","4970.74","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C30 H36 O S -","- C30 H36 O S -","- C240 H288 O8 S8 -","8","1","","Hoffmann, Reinhard W.; Koberstein, Ralf; Harms, Klaus","Chiral organometallic reagents. Part XXIII. On the stereochemistry of the carbolithiation reaction of vinyl sulfides","Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999)","1999","","2","183","192","10.1039/a808116f","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100592","9.7666","0.0009","11.4985","0.0011","11.5003","0.0011","91.259","0.011","110.611","0.011","94.302","0.011","1203.81","","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C30 H33 B V -","- C30 H36 B V -","- C60 H72 B2 V2 -","2","1","","Elschenbroich, Christoph; Wolf, Matthias; Burghaus, Olaf; Harms, Klaus; Pebler, Jürgen","The Mono-, Di-, and Tri([5]trovacenyl)boranes: A Study of Intermetallic Communication Across an sp^2^-Hybridized Boron Atom","European Journal of Inorganic Chemistry","1999","1999","12","2173","2185","10.1002/(sici)1099-0682(199912)1999:12<2173::aid-ejic2173>3.0.co;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","177587","2020-10-21","18:00:00",""
"1100593","10.1842","0.0019","8.9716","0.0013","14.35","0.002","90","","96.139","0.009","90","","1303.62","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C33 H33 B V2 -","- C33 H33 B V2 -","- C66 H66 B2 V4 -","2","1","","Elschenbroich, Christoph; Wolf, Matthias; Burghaus, Olaf; Harms, Klaus; Pebler, Jürgen","The Mono-, Di-, and Tri([5]trovacenyl)boranes: A Study of Intermetallic Communication Across an sp^2^-Hybridized Boron Atom","European Journal of Inorganic Chemistry","1999","1999","12","2173","2185","10.1002/(sici)1099-0682(199912)1999:12<2173::aid-ejic2173>3.0.co;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","177587","2020-10-21","18:00:00",""
"1100594","7.796","0.002","12.429","0.003","14.599","0.006","98.94","0.03","94.67","0.03","93.15","0.02","1389.48","","","","","","","","","","","","","4","P 1","P 1","1","","","","- C36 H33 B V3 -","- C36 H33 B V3 -","- C72 H66 B2 V6 -","2","2","","Elschenbroich, Christoph; Wolf, Matthias; Burghaus, Olaf; Harms, Klaus; Pebler, Jürgen","The Mono-, Di-, and Tri([5]trovacenyl)boranes: A Study of Intermetallic Communication Across an sp^2^-Hybridized Boron Atom","European Journal of Inorganic Chemistry","1999","1999","12","2173","2185","10.1002/(sici)1099-0682(199912)1999:12<2173::aid-ejic2173>3.0.co;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","177587","2020-10-21","18:00:00",""
"1100595","10.447","0.002","8.089","0.0012","10.911","0.002","90","","102.25","0.03","90","","901.05","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H22 V2 -","- C48 H44 V4 -","- C96 H88 V8 -","2","0.5","","Elschenbroich, Christoph; Schiemann, Olav; Burghaus, Olaf; Harms, Klaus; Pebler, Jürgen","[5-5]Bitrovacene, (μ-η^5^:η^5^-Fulvalenediyl)bis[(η^7^-cycloheptatrienyl)vanadium]: Synthesis, Structure, and Intermetallic Communication","Organometallics","1999","18","17","3273","3277","10.1021/om9902232","","","","","","","","","","","","","","","","","","","","","has coordinates","176888","2020-10-21","18:00:00",""
"1100596","10.768","0.003","7.851","0.002","16.189","0.006","90","","97.53","0.03","90","","1356.81","","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C18 H16 V -","- C18 H16 V -","- C72 H64 V4 -","4","2","","Elschenbroich, Christoph; Schiemann, Olav; Burghaus, Olaf; Harms, Klaus; Pebler, Jürgen","[5-5]Bitrovacene, (μ-η^5^:η^5^-Fulvalenediyl)bis[(η^7^-cycloheptatrienyl)vanadium]: Synthesis, Structure, and Intermetallic Communication","Organometallics","1999","18","17","3273","3277","10.1021/om9902232","","","","","","","","","","","","","","","","","","","","","has coordinates","176888","2020-10-21","18:00:00",""
"1100635","27.276","0.0019","19.7754","0.001","28.4888","0.0017","90","","90","","90","","15366.7","","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C90 H84 N3 P3 Yb2 -","- C90 H84 N3 P3 Yb2 -","- C720 H672 N24 P24 Yb16 -","8","1","","Anfang, S.; Gröb, T.; Harms, K.; Seybert, G.; Massa, W.; Greiner, A.; Dehnicke, K.","Phosphaniminato-Komplexe von Seltenerdelementen. Die Kristallstrukturen von [Yb~2~Cp~3~(NPPh~3~)~3~], [YCp(NPPh~3~)(μ-OSiMe~2~NPPh~3~)]~2~ und [M(NPPh~3~)~2~(μ-OSiMe~2~NPPh~3~)]~2~ mit M = Y und Sm","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","11","1853","1859","10.1002/(sici)1521-3749(199911)625:11<1853::aid-zaac1853>3.0.co;2-4","","","","","","","","","","","","","","","","","","","","","has coordinates","177956","2020-10-21","18:00:00",""
"1100636","14.6903","0.0011","12.3408","0.0009","27.615","0.002","90","","93.196","0.01","90","","4998.54","","","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C114 H114 N4 O2 P4 Si2 Y2 -","- C200 H196 N8 O4 P8 Si4 Y4 -","- C400 H392 N16 O8 P16 Si8 Y8 -","2","0.5","","Anfang, S.; Gröb, T.; Harms, K.; Seybert, G.; Massa, W.; Greiner, A.; Dehnicke, K.","Phosphaniminato-Komplexe von Seltenerdelementen. Die Kristallstrukturen von [Yb~2~Cp~3~(NPPh~3~)~3~], [YCp(NPPh~3~)(μ-OSiMe~2~NPPh~3~)]~2~ und [M(NPPh~3~)~2~(μ-OSiMe~2~NPPh~3~)]~2~ mit M = Y und Sm","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","11","1853","1859","10.1002/(sici)1521-3749(199911)625:11<1853::aid-zaac1853>3.0.co;2-4","","","","","","","","","","","","","","","","","","","","","has coordinates","177956","2020-10-21","18:00:00",""
"1100637","18.0406","0.0015","14.0182","0.0008","22.2165","0.0016","90","","98.716","0.009","90","","5553.6","","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C126 H118 N6 O2 P6 Si2 Y2 -","- C238 H220 N12 O4 P12 Si4 Y4 -","- C476 H440 N24 O8 P24 Si8 Y8 -","2","0.5","","Anfang, S.; Gröb, T.; Harms, K.; Seybert, G.; Massa, W.; Greiner, A.; Dehnicke, K.","Phosphaniminato-Komplexe von Seltenerdelementen. Die Kristallstrukturen von [Yb~2~Cp~3~(NPPh~3~)~3~], [YCp(NPPh~3~)(μ-OSiMe~2~NPPh~3~)]~2~ und [M(NPPh~3~)~2~(μ-OSiMe~2~NPPh~3~)]~2~ mit M = Y und Sm","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","11","1853","1859","10.1002/(sici)1521-3749(199911)625:11<1853::aid-zaac1853>3.0.co;2-4","","","","","","","","","","","","","","","","","","","","","has coordinates","177956","2020-10-21","18:00:00",""
"1100638","13.6337","0.0011","13.6488","0.0009","16.5061","0.0012","112.457","0.008","91.948","0.009","114.974","0.008","2502.3","","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C112 H102 N6 O2 P6 Si2 Sm2 -","- C224 H204 N12 O4 P12 Si4 Sm4 -","- C224 H204 N12 O4 P12 Si4 Sm4 -","1","0.5","","Anfang, S.; Gröb, T.; Harms, K.; Seybert, G.; Massa, W.; Greiner, A.; Dehnicke, K.","Phosphaniminato-Komplexe von Seltenerdelementen. Die Kristallstrukturen von [Yb~2~Cp~3~(NPPh~3~)~3~], [YCp(NPPh~3~)(μ-OSiMe~2~NPPh~3~)]~2~ und [M(NPPh~3~)~2~(μ-OSiMe~2~NPPh~3~)]~2~ mit M = Y und Sm","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","11","1853","1859","10.1002/(sici)1521-3749(199911)625:11<1853::aid-zaac1853>3.0.co;2-4","","","","","","","","","","","","","","","","","","","","","has coordinates","177956","2020-10-21","18:00:00",""
"1100639","10.4739","0.0008","10.0858","0.0008","14.5229","0.0014","90","","93.919","0.007","90","","1530.58","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 Cl N P -","- C18 H15 Cl N P -","- C72 H60 Cl4 N4 P4 -","4","1","","Grebe, Jutta; Schlecht, Sabine; Weller, Frank; Harms, Klaus; Geiseler, Gertraud; Dehnicke, Kurt","N-Chlortriphenylphosphanimin und seine Anwendung als Edukt zur Synthese asymmetrischer PNP-Kationen. Kristallstrukturen von Ph~3~PNCl und [Ph~3~PNPEt~3~]Cl","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","4","633","636","10.1002/(sici)1521-3749(199904)625:4<633::aid-zaac633>3.0.co;2-2","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100640","10.035","0.001","8.896","0.001","25.643","0.001","90","","91.94","0.01","90","","2287.87","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H30 Cl N P2 -","- C24 H30 Cl N P2 -","- C96 H120 Cl4 N4 P8 -","4","1","","Grebe, Jutta; Schlecht, Sabine; Weller, Frank; Harms, Klaus; Geiseler, Gertraud; Dehnicke, Kurt","N-Chlortriphenylphosphanimin und seine Anwendung als Edukt zur Synthese asymmetrischer PNP-Kationen. Kristallstrukturen von Ph~3~PNCl und [Ph~3~PNPEt~3~]Cl","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","4","633","636","10.1002/(sici)1521-3749(199904)625:4<633::aid-zaac633>3.0.co;2-2","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:41",""
"1100645","8.0799","0.0013","12.969","0.0015","14.451","0.0018","90","","90","","90","","1514.29","","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C15 H21 N O4 S -","- C15 H21 N O4 S -","- C60 H84 N4 O16 S4 -","4","1","","Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus","Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone","European Journal of Organic Chemistry","1999","1999","11","2977","2990","10.1002/(sici)1099-0690(199911)1999:11<2977::aid-ejoc2977>3.0.co;2-3","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:42",""
"1100646","8.455","0.001","11.6555","0.001","14.3828","0.001","90","","90","","90","","1417.39","","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 N O4 S -","- C14 H19 N O4 S -","- C56 H76 N4 O16 S4 -","4","1","","Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus","Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone","European Journal of Organic Chemistry","1999","1999","11","2977","2990","10.1002/(sici)1099-0690(199911)1999:11<2977::aid-ejoc2977>3.0.co;2-3","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:42",""
"1100647","7.623","0.001","9.913","0.001","9.624","0.001","90","","95.9","0.01","90","","723.4","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H21 N O5 -","- C12 H21 N O5 -","- C24 H42 N2 O10 -","2","1","","Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus","Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone","European Journal of Organic Chemistry","1999","1999","11","2977","2990","10.1002/(sici)1099-0690(199911)1999:11<2977::aid-ejoc2977>3.0.co;2-3","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:42",""
"1100648","8.6269","0.0007","9.251","0.002","9.789","0.001","90","","106.459","0.008","90","","749.22","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H21 N O5 -","- C12 H21 N O5 -","- C24 H42 N2 O10 -","2","1","","Schrey, Anna; Osterkamp, Frank; Straudi, Alrun; Rickert, Corry; Wagner, Holger; Koert, Ulrich; Herrschaft, Bernhard; Harms, Klaus","Synthesis of Enantiomerically Pure Amino Acids Containing 2,5-Disubstituted THF Rings in the Molecular Backbone","European Journal of Organic Chemistry","1999","1999","11","2977","2990","10.1002/(sici)1099-0690(199911)1999:11<2977::aid-ejoc2977>3.0.co;2-3","","","","","","","","","","","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:42",""
"1101092","7.2653","0.0005","7.9452","0.0006","12.5441","0.001","84.702","0.006","75.186","0.006","78.932","0.005","686.3","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H13 Cd Cl2 N5 O4 -","- C8 H13 Cd Cl2 N5 O4 -","- C16 H26 Cd2 Cl4 N10 O8 -","2","1","","Ángel García Raso; Juan J. Fiol; Ferran Bádenas; Rosa Cons; Ángel Terrón; Miguel Quirós","Synthesis and structural studies of metal-acyclovir (ACV) complexes: [Ni(or Co)(ACV)~2~(H~2~O)~4~]Cl~2~.2ACV, [Zn(ACV)Cl~2~(H~2~O)], [Cd(ACV)Cl~2~].H~2~O and [{Hg(ACV)Cl~2~}~x~]. Recognition of acyclovir by Ni-ACV","Journal of the Chemical Society, Dalton Transactions","1999","","","167","173","","","","","","","","0.022","","","0.058","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1101093","9.7368","0.0008","12.3461","0.0011","17.1837","0.0014","78.372","0.006","74.585","0.006","71.113","0.005","1869","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C34 H42 Co N12 O8 -","- C34 H42 Co N12 O8 -","- C68 H84 Co2 N24 O16 -","2","1","","Francisco Hueso-Ureña; Antonio L. Peñas-Chamorro; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas","A cobalt(II) complex with the N,N,O-tridentate ligand 6-amino-5-formyl-1,3-dimethyluracilato-benzoyl-hydrazone","Journal of Chemical Crystallography","1999","29","","283","286","10.1023/A:1009565600126","","","","","","","0.0446","","","0.114","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1101095","6.9193","0.0007","11.8361","0.0008","15.259","0.002","90","","97.482","0.01","90","","1239","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H11 Cu N7 O5 -","- C8 H11 Cu N7 O5 -","- C32 H44 Cu4 N28 O20 -","4","1","","Francisco Hueso-Ureña; Antonio L. Peñas-Chamorro; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas","Synthesis, spectral and XRD studies on three O-nitrito-complexes with new N,N,O-tridentate Schiff bases derived from 6-amino-5-formyl-1,3-dimethyluracil and semicarbazide, acetylhydrazine and benzoylhydrazine","Polyhedron","1999","18","","351","360","10.1016/S0277-5387(98)00303-9","","","","","","","0.0347","","","0.0971","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1101096","5.291","0.0005","12.0171","0.0009","21.792","0.002","90","","93.981","0.009","90","","1382.2","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H14 Cu N6 O6 -","- C9 H14 Cu N6 O6 -","- C36 H56 Cu4 N24 O24 -","4","1","","Francisco Hueso-Ureña; Antonio L. Peñas-Chamorro; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas","Synthesis, spectral and XRD studies on three O-nitrito-complexes with new N,N,O-tridentate Schiff bases derived from 6-amino-5-formyl-1,3-dimethyluracil and semicarbazide, acetylhydrazine and benzoylhydrazine","Polyhedron","1999","18","","351","360","10.1016/S0277-5387(98)00303-9","","","","","","","0.0808","","","0.1241","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:42",""
"1101097","7.783","0.001","8.0754","0.0009","10.252","0.002","99.326","0.012","103.785","0.013","118.47","0.009","520.67","0.13","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H20 Cl2 Cu N8 O6 -","- C16 H20 Cl2 Cu N8 O6 -","- C16 H20 Cl2 Cu N8 O6 -","1","0.5","","Francisco Hueso-Ureña; Sonia B. Jiménez-Pulido; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas","Synthesis and structural studies on new M^II^X~2~L~2~ dihalocomplexes of 1,3-dimethyllumazine and 1,3,6,7-tetramethyllumazine. Crystal structure of the monodimensionally hydrogen-bonded dichloro-bis(1,3-dimethylpteridine-2,4(1H,3H)-dione-O^4^,N^5^) copper(II) dihydrate","Polyhedron","1999","18","","85","91","10.1016/S0277-5387(98)00270-8","","","","","","","0.0692","","","0.1578","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1101102","7.7878","0.0007","8.6616","0.0006","10.9133","0.001","97.841","0.007","106.91","0.007","94.22","0.006","692.74","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H13 Cl2 N5 O4 Zn -","- C8 H13 Cl2 N5 O4 Zn -","- C16 H26 Cl4 N10 O8 Zn2 -","2","1","","Ángel García Raso; Juan J. Fiol; Ferran Bádenas; Rosa Cons; Ángel Terrón; Miguel Quirós","Synthesis and structural studies of metal-acyclovir (ACV) complexes: [Ni(or Co)(ACV)~2~(H~2~O)~4~]Cl~2~.2ACV, [Zn(ACV)Cl~2~(H~2~O)], [Cd(ACV)Cl~2~].H~2~O and [{Hg(ACV)Cl~2~}~x~]. Recognition of acyclovir by Ni-ACV","Journal of the Chemical Society, Dalton Transactions","1999","","","167","173","","","","","","","","0.0327","","","0.0873","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1101103","12.6672","0.0008","15.134","0.0012","12.8273","0.0011","90","","111.077","0.005","90","","2294.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H52 Cl2 N20 Ni O16 -","- C32 H52 Cl2 N20 Ni O16 -","- C64 H104 Cl4 N40 Ni2 O32 -","2","0.5","","Ángel García Raso; Juan J. Fiol; Ferran Bádenas; Rosa Cons; Ángel Terrón; Miguel Quirós","Synthesis and structural studies of metal-acyclovir (ACV) complexes: [Ni(or Co)(ACV)~2~(H~2~O)~4~]Cl~2~.2ACV, [Zn(ACV)Cl~2~(H~2~O)], [Cd(ACV)Cl~2~].H~2~O and [{Hg(ACV)Cl~2~}~x~]. Recognition of acyclovir by Ni-ACV","Journal of the Chemical Society, Dalton Transactions","1999","","","167","173","","","","","","","","0.0383","","","0.0973","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:42",""
"1101105","7.152","0.001","8.83","0.001","13.783","0.001","82.024","0.001","86.155","0.001","70.9","0.001","814.3","0.2","293","","","","","","","","","","","5","P 1","P 1","1","","","","- C20 H42 N8 Ni O22 -","- C20 H42 N8 Ni O22 -","- C20 H42 N8 Ni O22 -","1","1","","Francisca Barrios; Juan M. Salas; M. Purificación Sánchez; Miguel Quirós; René Faure","X-ray crystal structure of tetraaquabis(xanthosinato) nickel(II) hexahydrate","Journal of Chemical Crystallography","1999","29","","1009","1013","10.1023/A:1009568616134","","","","","","","0.0309","","","0.0808","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:42",""
"1101106","7.3518","0.0008","21.308","0.002","11.0976","0.0012","90","","99.245","0.008","90","","1715.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H16 N6 O6 Zn -","- C14 H16 N6 O6 Zn -","- C56 H64 N24 O24 Zn4 -","4","1","","Francisco Hueso-Ureña; Antonio L. Peñas-Chamorro; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas","Synthesis, spectral and XRD studies on three O-nitrito-complexes with new N,N,O-tridentate Schiff bases derived from 6-amino-5-formyl-1,3-dimethyluracil and semicarbazide, acetylhydrazine and benzoylhydrazine","Polyhedron","1999","18","","351","360","10.1016/S0277-5387(98)00303-9","","","","","","","0.0621","","","0.1572","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:42",""
"1101107","8.749","0.001","14.213","0.001","21.2","0.002","90","","90","","90","","2636.2","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 Cl2 Cu N8 O15 -","- C16 H22 Cl2 Cu N8 O15 -","- C64 H88 Cl8 Cu4 N32 O60 -","4","1","","Francisco Hueso-Ureña; Sonia B. Jiménez-Pulido; Miguel N. Moreno-Carretero; Miguel Quirós; Juan M. Salas","Crystal structure of the Λ-[4M] enantiomer of cis-diaqua-bis(1,3-dimethylpteridine-2,4(1H,3H)-dione-N^5^,O^4^) copper(II) perchlorate monohydrate","Journal of Chemical Crystallography","1999","29","5","571","574","10.1023/A:1009548803103","","","","","","","0.0471","","","0.1263","","","","","","","","","","","has coordinates","301773","2025-08-18","12:42:42",""
"1507555","10.546","0.001","12.55","0.001","10.674","0.001","90","","112.15","0.01","90","","1308.5","0.2","299","","299","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C23 H33 N2 O7 P S -","- C23 H33 N2 O7 P S -","- C46 H66 N4 O14 P2 S2 -","2","1","","Amspacher, David R.; Blanchard, Carol Z.; Fronczek, Frank R.; Saraiva, Marcelo C.; Waldrop, Grover L.; Strongin, Robert M.","Synthesis of a Reaction Intermediate Analogue of Biotin-Dependent Carboxylases via a Selective Derivatization of Biotin","Organic Letters","1999","1","1","99","","10.1021/ol990026z","","","1.54184","Cu-Kα","","0.128","0.096","","0.104","0.104","","","","4.756","4.753","4.753","","","","","has coordinates","301775","2025-08-18","14:03:04",""
"1507556","7.4729","0.0004","12.4337","0.0007","14.4929","0.0009","79.296","0.003","80.363","0.003","75.546","0.003","1270.9","0.13","125","0.1","125","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C26 H42 N2 O3 -","- C26 H42 N2 O3 -","- C52 H84 N4 O6 -","2","1","","Allen, Annette D.; Cheng, Bernice; Fenwick, Michael H.; Huang, Wen-wei; Missiha, Sharif; Tahmassebi, Daryoush; Tidwell, Thomas T.","Radical Additions of TEMPO to Ketenes: Correlation of Free Radical and Nucleophilic Reactivity","Organic Letters","1999","1","5","693","","10.1021/ol990628i","","","0.71073","MoKα","","0.0734","0.0463","","","0.1231","0.1359","","","","","","1.01","","","","has coordinates","301775","2025-08-18","14:03:04",""
"1507557","17.6335","0.0011","11.7727","0.0008","8.5975","0.0005","90","","100.718","0.002","90","","1753.65","0.19","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","rel-(1S,2R,3S,6R)-6-Azido-2-bromo-4-cyclohexene-1,3-diol ?","","- C6 H8 Br N3 O2 -","- C6 H8 Br N3 O2 -","- C48 H64 Br8 N24 O16 -","8","2","","Murphy, Sean T.; Bencsik, Josef R.; Johnson, Carl R.","Enantioselective Synthesis of (−)-LL-C10037α from Benzoquinone","Organic Letters","1999","1","9","1483","","10.1021/ol991038n","","","0.71073","MoKα","","0.0988","0.0553","","0.1252","0.1155","","","","0.906","1.149","1.149","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1507558","17.4244","0.001","11.7782","0.0006","8.6105","0.0005","90","","92.531","0.001","90","","1765.39","0.17","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","rel-(1S,2S,3S,4R,5S,6S)-4-Azido-2-bromo-5,6-epoxycyclohexane-1,3-diol ?","","- C6 H8 Br N3 O3 -","- C6 H8 Br N3 O3 -","- C48 H64 Br8 N24 O24 -","8","2","","Murphy, Sean T.; Bencsik, Josef R.; Johnson, Carl R.","Enantioselective Synthesis of (−)-LL-C10037α from Benzoquinone","Organic Letters","1999","1","9","1483","","10.1021/ol991038n","","","0.71073","MoKα","","0.0562","0.0347","","0.0794","0.0731","","","","0.94","1.027","1.027","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1507559","8.36","0.001","8.462","0.001","8.558","0.001","103.18","0.01","105.09","0.01","93.46","0.01","564.51","0.12","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Guanidiniocarbonyl-1H-pyrrole acetate hydrate","","- C8 H14 N4 O4 -","- C8 H14 N4 O4 -","- C16 H28 N8 O8 -","2","1","","Schmuck, Carsten; Lex, Johann","Acetate Binding within a Supramolecular Network Formed by a Guanidiniocarbonyl Pyrrole Cation in the Solid State","Organic Letters","1999","1","11","1779","","10.1021/ol9910621","","","0.71073","MoKα","","0.0464","0.0366","","","0.096","0.1027","","","","","","1.031","","","","has coordinates","301775","2025-08-18","14:03:04",""
"1509103","3.838","","3.838","","19.564","","90","","90","","90","","288.182","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Lanthanum silver calcium copper oxide (1.65/0.35/1/2/6)","","- Ag0.35 Ca Cu2 La1.65 O6 -","- Ag0.35 Ca Cu2 La1.65 O6 -","- Ag0.7 Ca2 Cu4 La3.3 O12 -","2","0.0625","","Zhu, S.-F.; Zhao, B.-J.; Tao, F.; Zhou, X.-J.; Xu, J.-H.; Che, G.-C.","Phase relation and crystal structure of M-substituted La212 type compounds (M = Pr, Ag)","Journal of the Sichuan University (Natural Science Edition)","1999","36","","1057","1067","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509156","13.355","","13.355","","13.355","","90","","90","","90","","2381.95","","","","","","","","","","","","","3","P n -3 :2","-P 2ab 2bc 3","201","","Ag (W6 Br14)","","- Ag Br14 W6 -","- Ag Br14 W6 -","- Ag4 Br56 W24 -","4","0.166667","","Peters, K.; von Schnering, H.G.; Grin', Yu.; Borrmann, H.; Zheng Yueqing","The cluster compounds Ag (W6 Br14) and Ag2 (W6 Br14)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","2115","2115","10.1002/(SICI)1521-3749(199912)625:12<2115::AID-ZAAC2115>3.0.CO;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509221","11.0684","","12.3127","","5.9109","","90","","90","","90","","805.549","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Ag Ba (P O3)3","","- Ag Ba O9 P3 -","- Ag Ba O9 P3 -","- Ag4 Ba4 O36 P12 -","4","1","","Aouad, H.; Tanguy, B.; Maazaz, M.; Parent, C.; Gravereau, P.; Belharouak, I.; Mesnaoui, M.; le Flem, G.","Crystal structure and luminescence properties of silver in Ag M (P O3)3 (M = Mg, Zn, Ba) polyphosphates","Journal of Solid State Chemistry","1999","145","","97","103","10.1006/jssc.1999.8227","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509226","4.4773","","14.856","","11.336","","90","","90","","90","","754.011","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Ba (Y Ag Te3)","","- Ag Ba Te3 Y -","- Ag Ba Te3 Y -","- Ag4 Ba4 Te12 Y4 -","4","0.25","","Ibers, J.A.; Yang, Y.-T.","Synthesis and characterisation of a series of quaternary chalcogenides Ba Ln M Q3 (Ln = rare earth, M = coinage metal, Q = Se or Te)","Journal of Solid State Chemistry","1999","147","","366","371","10.1006/jssc.1999.8359","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509237","5.641","","5.641","","16.118","","90","","90","","120","","444.175","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Ag (Bi O3)","","- Ag Bi O3 -","- Ag Bi O3 -","- Ag6 Bi6 O18 -","6","0.333333","","Kumada, N.; Sleight, A.W.; Takahashi, N.; Kinomura, N.","Synthesis of new ilmenite-type oxides, Ag M O3 (M = Sb, Si) by ion-exchange reaction","Special Publication - Royal Society of Chemistry","1999","239","","212","217","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509432","4.067","","4.067","","9.063","","90","","90","","90","","149.906","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","(La O) Ag S","","- Ag La O S -","- Ag La O S -","- Ag2 La2 O2 S2 -","2","0.125","","Wilmer, D.; Jorgensen, J.D.; Wuensch, B.J.","Rietveld neutron powder profile analysis and electrical conductivity of the fast silver-ion conductor (La O) Ag S","Materials Research Society Symposia Proceedings","1999","548","","455","460","10.1557/PROC-548-455","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509458","13.888","","10.7302","","9.97301","","90","","90","","90","","1486.19","","","","","","","","","","","","","4","P c c a","-P 2a 2ac","54","","Ag Mg (P O3)3","","- Ag Mg O9 P3 -","- Ag Mg O9 P3 -","- Ag8 Mg8 O72 P24 -","8","1","","Maazaz, M.; Belharouak, I.; Tanguy, B.; Aouad, H.; Gravereau, P.; le Flem, G.; Mesnaoui, M.; Parent, C.","Crystal structure and luminescence properties of silver in Ag M (P O3)3 (M= Mg, Zn, Ba) polyphosphates","Journal of Solid State Chemistry","1999","145","","97","103","10.1006/jssc.1999.8227","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509477","3.9286","","3.9259","","3.9302","","90","","90.49","","90","","60.614","","","","","","","","","","","","","4","P 1 2/m 1","-P 2y","10","","Ag (Nb0.5 Ta0.5) O3","","- Ag Nb0.5 O3 Ta0.5 -","- Ag Nb0.5 O3 Ta0.5 -","- Ag Nb0.5 O3 Ta0.5 -","1","0.25","","Suvorov, D.; Valant, M.","New high-permittivity Ag Nb1-x Tax O3 microwave ceramics: Part I: crystal structures and phase-decomposition relations","Journal of the American Ceramic Society","1999","82","","81","87","10.1111/j.1151-2916.1999.tb01726.x","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509498","10.437","","9.897","","5.532","","90","","99.69","","90","","563.275","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Ag (V O3)","","- Ag O3 V -","- Ag O3 V -","- Ag8 O24 V8 -","8","1","","Akashi, H.; Kittaka, S.; Matsuno, K.","Crystal structure of alpha-Ag V O3 and phase relation of Ag V O3","Journal of Solid State Chemistry","1999","142","","360","367","10.1006/jssc.1998.8044","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509550","4.792","","4.792","","10.873","","90","","90","","120","","216.229","","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","Yb Ag Sn","","- Ag Sn Yb -","- Ag Sn Yb -","- Ag3 Sn3 Yb3 -","3","0.25","","Kuennen, B.; Poettgen, R.; Kotzyba, G.; Kussmann, D.; Felser, C.; Mosel, B.D.; Arpe, P.E.; Muellmann, R.","Structure and Properties of YbZnSn, YbAgSn, and Yb2Pt2Pb","Journal of Solid State Chemistry","1999","145","","668","677","10.1006/jssc.1998.8280","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509625","18.955","","18.955","","4.406","","90","","90","","120","","1370.95","","","","","","","","","","","","","3","P 63","P 6c","173","","K2 Ag12 Se7.11","","- Ag12 K2 Se7.11 -","- Ag12 K2 Se7.11107 -","- Ag36 K6 Se21.3332 -","3","0.5","","Emirdag, M.; Pennington, W.T.; Kolis, J.W.; Schimek, G.L.","Synthesis of two new metallic alkali metal silver selenides, K2 Ag12 Se7.11 and Rb Ag5 Se3, from supercritical ethylenediamine","Journal of Solid State Chemistry","1999","144","","287","296","10.1006/jssc.1999.8130","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509733","8.613","","14.927","","19.639","","90","","90","","90","","2524.91","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Ba4 Ag2 Si6","","- Ag2 Ba4 Si6 -","- Ag2 Ba4 Si6 -","- Ag16 Ba32 Si48 -","8","0.25","","Cardoso Gil, R.H.; Peters, K.; Grin', Yu.; Schultheiss, M.; Carrillo-Cabrera, W.; von Schnering, H.G.","New examples for the unexpected stability of the 10pi electron Hueckel arene (Si6)10-","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","285","293","10.1002/(SICI)1521-3749(199902)625:2<285::AID-ZAAC285>3.0.CO;2-V","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509762","5.975","","6.311","","9.563","","90","","90","","90","","360.604","","","","","","","","","","","","","3","P n n a","-P 2a 2bc","52","","Ag2 (Bi O3)","","- Ag2 Bi O3 -","- Ag2 Bi O3 -","- Ag8 Bi4 O12 -","4","0.5","","Deibele, S.; Jansen, M.","Bismuth in Ag2 Bi O3: Tetravalent or internally disproportionated ?","Journal of Solid State Chemistry","1999","147","","117","121","10.1006/jssc.1999.8186","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509768","9.3844","","15.383","","9.5215","","90","","117.336","","90","","1221.03","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Ag2 (W6 Br14)","","- Ag2 Br14 W6 -","- Ag2 Br14 W6 -","- Ag4 Br28 W12 -","2","0.5","","Peters, K.; Zheng Yueqing; Grin', Yu.; Borrmann, H.; von Schnering, H.G.","The cluster compounds Ag (W6 Br14) and Ag2 (W6 Br14)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","2115","2115","10.1002/(SICI)1521-3749(199912)625:12<2115::AID-ZAAC2115>3.0.CO;2-#","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509769","8.315","","14.391","","8.646","","90","","90","","90","","1034.59","","","","","","","","","","","","","3","F m m m","-F 2 2","69","","Ca4 Ag2 Si6","","- Ag2 Ca4 Si6 -","- Ag2 Ca4 Si6 -","- Ag8 Ca16 Si24 -","4","0.125","","Cardoso Gil, R.H.; von Schnering, H.G.; Peters, K.; Grin', Yu.; Carrillo-Cabrera, W.; Schultheiss, M.","New examples for the unexpected stability of the 10pi electron Hueckel arene (Si6)10-","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","285","293","10.1002/(SICI)1521-3749(199902)625:2<285::AID-ZAAC285>3.0.CO;2-V","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509785","5.8857","","5.8857","","10.6868","","90","","90","","90","","370.206","","","","","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","","","- Ag2 Cu2 O3 -","- Ag2 Cu2 O3 -","- Ag8 Cu8 O12 -","4","0.125","","Tejada-Rosales, E.M.; Gomez-Romero, P.; Palacin, M.R.","Ag2 Cu2 O3 : the first silver copper oxide","Angew. Chem. Int. ed.","1999","38","","524","525","10.1002/(SICI)1521-3773(19990215)38:4<524::AID-ANIE524>3.0.CO;2-F","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1509797","8.42","","14.585","","17.864","","90","","90","","90","","2193.8","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Eu4 Ag2 Si6","","- Ag2 Eu4 Si6 -","- Ag2 Eu4 Si6 -","- Ag16 Eu32 Si48 -","8","0.25","","Peters, K.; Cardoso Gil, R.H.; von Schnering, H.G.; Schultheiss, M.; Carrillo-Cabrera, W.; Grin', Yu.","New examples for the unexpected stability of the 10pi electron Hueckel arene (Si6)10-","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","285","293","10.1002/(SICI)1521-3749(199902)625:2<285::AID-ZAAC285>3.0.CO;2-V","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509808","12.692","","7.492","","12.644","","90","","109.5","","90","","1133.34","","","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","Ag2 In2 Ge Se6","","- Ag2 Ge In2 Se6 -","- Ag2 Ge In2 Se6 -","- Ag8 Ge4 In8 Se24 -","4","1","","Glowyak, T.; Sysa, L.V.; Krykhovets, O.V.; Olekseyuk, I.D.","Crystal structure of Ag2 In2 Ge Se6","Journal of Alloys Compd.","1999","287","","181","184","10.1016/S0925-8388(99)00016-X","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509850","5.991","","5.991","","10.918","","90","","90","","90","","391.87","","","","","","","","","","","","","4","P 4/n b m :2","-P 4a 2b","125","","Rb Cu1.2 Ag3.8 Se3","","- Ag3.8 Cu1.2 Rb Se3 -","- Ag3.8 Cu1.2 Rb Se3 -","- Ag7.6 Cu2.4 Rb2 Se6 -","2","0.125","","Wang, R.-J.; Li, J.; Dilks, K.J.; Chen, Z.","Rb Cu1.2 Ag3.8 Se3 and Cs2 Cu2 Sb2 Se5 : novel quaternary intermetallics synthesized from superheated organic media","Journal of Solid State Chemistry","1999","147","","132","139","10.1006/jssc.1999.8187","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509927","6.0814","","6.0814","","11.112","","90","","90","","90","","410.96","","","","","","","","","","","","","3","P 4/n b m :2","-P 4a 2b","125","","Rb Ag5 Se3","","- Ag5 Rb Se3 -","- Ag5 Rb Se3 -","- Ag10 Rb2 Se6 -","2","0.125","","Kolis, J.W.; Schimek, G.L.; Pennington, W.T.; Emirdag, M.","Synthesis of two new metallic alkali metal silver selenides, K2 Ag12 Se7.11 and Rb Ag5 Se3, from supercritical ethylenediamine","Journal of Solid State Chemistry","1999","144","","287","296","10.1006/jssc.1999.8130","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509978","7.672","","17.66599","","8.937","","90","","107.89","","90","","1152.7","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Ba Ag8 S5","","- Ag8 Ba S5 -","- Ag8 Ba S5 -","- Ag32 Ba4 S20 -","4","1","","Chong Zheng; Dabrowski, B.; Check, C.E.; Zhang Jianhua","Synthesis and structure of a new ternary silver-rich sulfide Ba Ag8 S5","Journal of Solid State Chemistry","1999","144","","409","415","10.1006/jssc.1999.8188","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509980","15.643","","4.407","","10.869","","90","","90","","90","","749.295","","","","","","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","Ba2 (Ag8 S5 (S2))","","- Ag8 Ba2 S7 -","- Ag8 Ba2 S7 -","- Ag16 Ba4 S14 -","2","0.25","","Li, H.; Hwu, S.-J.","Electrochemical synthesis of Ba2 Ag8 S7, a quasi-onedimensional barium silver(I) sulfide containing mixed S2-/(S2)2- ligands","Angew. Chem. Int. ed.","1999","38","","3067","3069","10.1002/(SICI)1521-3773(19991018)38:20<3067::AID-ANIE3067>3.0.CO;2-B","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510060","4.5635","","10.748","","7.5969","","90","","90","","90","","372.617","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Ca Au In2","","- Au Ca In2 -","- Au Ca In2 -","- Au4 Ca4 In8 -","4","0.25","","Kuennen, B.; Landrum, G.A.; Poettgen, R.; Kotzyba, G.; Dronskowski, R.; Hoffmann, R.D.","Synthesis, structure, chemical bonding and properties of CaTIn2 (T = Pd, Pt, Au) - the case for monovalent calcium","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","789","798","10.1002/(SICI)1521-3749(199905)625:5<789::AID-ZAAC789>3.0.CO;2-Q","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510099","3.4823","","3.4823","","21.463","","90","","90","","120","","225.4","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Au (Cr S2)","","- Au Cr S2 -","- Au Cr S2 -","- Au3 Cr3 S6 -","3","0.166667","","Sakashita, S.I.; Fukuoka, H.; Yamanaka, S.","Preparation and structural study of a new ternary gold chromium sulfide, Au Cr S2","Journal of Solid State Chemistry","1999","148","","487","491","10.1006/jssc.1999.8484","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510135","11.3062","","11.3062","","6.3134","","90","","90","","90","","807.043","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Th2 F7 (Au F4)","","- Au F11 Th2 -","- Au F11 Th2 -","- Au4 F44 Th8 -","4","0.125","","Schmidt, R.; Mueller, B.G.","Th2 F7 (Au F4) - das erste ""fluorobasische"" Tetrafluoroaurat(III) im System Th F4 / Au F3","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","602","604","10.1002/(SICI)1521-3749(199904)625:4<602::AID-ZAAC602>3.0.CO;2-I","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510304","5.8484","","5.8484","","5.5643","","90","","90","","90","","190.32","","","","","","","","","","","","","4","P 42/m m c","-P 4c 2","131","","Ca3.19 Au0.54 Pd4 O8","","- Au0.54 Ca3.19 O8 Pd4 -","- Au0.54 Ca3.2 O8 Pd4 -","- Au0.54 Ca3.2 O8 Pd4 -","1","0.0625","","Scott, B.A.; Walker, D.; Wang, Y.-H.","Composition and structure of a new palladate Ca4-1.5x Aux Pd4 O8 (x=0.54) synthesized at high pressure","Journal of Alloys Compd.","1999","292","","77","83","10.1016/S0925-8388(99)00482-X","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510480","15.016","","15.016","","4.579","","90","","90","","120","","894.149","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","Sr2 Au2.85 In4.15","","- Au2.85 In4.15 Sr2 -","- Au2.8455 In4.1545 Sr2 -","- Au11.382 In16.618 Sr8 -","4","0.333333","","Rosenhahn, C.; Kotzyba, G.; Poettgen, R.; Mosel, B.D.; Kuennen, B.; Hoffmann, R.D.","Structure and Properties of Sr2Au3In4 and Eu2Au3In4","Journal of Solid State Chemistry","1999","145","","283","290","10.1006/jssc.1999.8265","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510482","14.636","","4.4323","","12.723","","90","","90","","90","","825.356","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ca2 Au3 In4","","- Au3 Ca2 In4 -","- Au3 Ca2 In4 -","- Au12 Ca8 In16 -","4","0.5","","Hoffmann, R.D.; Poettgen, R.","Sr Pt In, Sr2 Pt3 In4, and Ca2 Au3 In4 - alkaline earth compounds with complex three-dimensional [Pt In], [Pt3 In4], and [Au3 In4] polyanions","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","994","1000","10.1002/(SICI)1521-3749(199906)625:6<994::AID-ZAAC994>3.0.CO;2-W","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510487","4.6527","","53.483","","7.405","","90","","90","","90","","1842.66","","","","","","","","","","","","","3","P m n 21","P 2ac -2","31","","Ce2 Au3 In5","","- Au3 Ce2 In5 -","- Au3 Ce2 In5 -","- Au24 Ce16 In40 -","8","2","","Hoffmann, R.D.; Poettgen, R.; Adam, M.; Galadzhun, Ya.V.","Complex Three-Dimensional (Au3In5) Polyanions in Ln2Au3In5 (Ln = Ce, Pr, Nd, Sm)","Journal of Solid State Chemistry","1999","148","","425","432","10.1006/jssc.1999.8471","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510494","14.897","","14.897","","4.549","","90","","90","","120","","874.267","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","Eu2 Au3 In4","","- Au3 Eu2 In4 -","- Au3 Eu2 In4 -","- Au12 Eu8 In16 -","4","0.333333","","Mosel, B.D.; Kuennen, B.; Hoffmann, R.D.; Rosenhahn, C.; Kotzyba, G.; Poettgen, R.","Structure and Properties of Sr2Au3In4 and Eu2Au3In4","Journal of Solid State Chemistry","1999","145","","283","290","10.1006/jssc.1999.8265","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510498","5.2721","","10.7076","","5.7348","","90","","90.633","","90","","323.719","","","","","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","Au (Au F4)2","","- Au3 F8 -","- Au3 F8 -","- Au6 F16 -","2","0.5","","Mueller, B.G.; Schmidt, R.","Einkristalluntersuchungen an Au (Au F4)2 und Ce F4, zwei unerwarteten Nebenprodukten","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","605","608","10.1002/(SICI)1521-3749(199904)625:4<605::AID-ZAAC605>3.0.CO;2-6","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1510592","4.212","","14.036","","10.657","","90","","90","","90","","630.038","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Ba (Gd Au Se3)","","- Au Ba Gd Se3 -","- Au Ba Gd Se3 -","- Au4 Ba4 Gd4 Se12 -","4","0.25","","Yang, Y.-T.; Ibers, J.A.","Synthesis and characterisation of a series of quaternary chalcogenides Ba Ln M Q3 (Ln = rare earth, M = coinage metal, Q = Se or Te)","Journal of Solid State Chemistry","1999","147","","366","371","10.1006/jssc.1999.8359","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510607","8.687","","6.42","","12.29","","90","","95.568","","90","","682.186","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","K Au Cl3.69 Br0.31","","- Au Br0.31 Cl3.69 K -","- Au Br0.31 Cl3.69 K -","- Au4 Br1.24 Cl14.76 K4 -","4","1","","Omrani, H.; Mercier, R.; Vangelisti, R.","Etude radiocristallographique des solutions solides K Au Cl3.69 Br0.31, K Au Cl1.94 Br2.06, K Au Cl1.82 Br2.18 .2(H2 O)","Annales de Chimie (Paris)","1999","24","","217","225","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510613","8.789","","6.578","","12.562","","90","","96.147","","90","","722.084","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","K Au Cl1.94 Br2.06","","- Au Br2.06 Cl1.94 K -","- Au Br2.06 Cl1.94 K -","- Au4 Br8.24 Cl7.76 K4 -","4","1","","Vangelisti, R.; Mercier, R.; Omrani, H.","Etude radiocristallographique des solutions solides K Au Cl3.69 Br0.31, K Au Cl1.94 Br2.06, K Au Cl1.82 Br2.18 . 2(H2 O)","Annales de Chimie (Paris)","1999","24","","217","225","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510800","7.719","","5.341","","11.873","","90","","92.71","","90","","488.943","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Sr2 (B2 O5)","","- B2 O5 Sr2 -","- B2 O5 Sr2 -","- B8 O20 Sr8 -","4","1","","Chen, J.-T.; Lin, Q.-S.; Huang, J.-S.; Cheng, W.-D.","Crystal and electronic structures and linear optics of strontium pyroborate","Journal of Solid State Chemistry","1999","144","","30","34","10.1006/jssc.1998.8100","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510850","5.746","","5.746","","3.036","","90","","90","","90","","100.238","","","","","","","","","","","","","2","P 4/m b m","-P 4 2ab","127","","V3 B2","","- B2 V3 -","- B2 V3 -","- B4 V6 -","2","0.125","","Wiesinger, G.; Hauback, B.C.; Yartys', V.A.; Harris, I.R.; Guegan, P.W.; Riabov, A.B.","Hydrogenation behaviour, neutron diffraction studies and microstructural characterisation of boron oxide-doped Zr V alloys","Journal of Alloys Compd.","1999","293","","93","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510861","18.69449","","5.7009","","4.1506","","90","","90","","90","","442.352","","","","","","","","","","","","","2","C m m m","-C 2 2","65","","Na3 B20","","- B20 Na3 -","- B20 Na3 -","- B40 Na6 -","2","0.125","","Hofmann, K.; Albert, B.","Synthesis, characterization, and crystal structure of Na3 B20, determined and refined from x-ray and neutron powder data","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","709","713","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510878","9.411","","9.411","","17.481","","90","","90","","120","","1340.81","","","","","","","","","","","","","4","P 63 c m","P 6c -2","185","","Ba3 Yb (B O3)3","","- B3 Ba3 O9 Yb -","- B3 Ba3 O9 Yb -","- B18 Ba18 O54 Yb6 -","6","0.5","","Khamaganova, T.N.; Bazarova, Zh.G.; Kuperman, N.M.","The double borates Ba3 Ln (B O3)3, Ln = La-Lu, Y","Journal of Solid State Chemistry","1999","145","","33","36","10.1006/jssc.1999.8163","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510915","8.489","","15.706","","12.117","","90","","132.27","","90","","1195.47","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Li Gd6 O5 (B O3)3","","- B3 Gd6 Li O14 -","- B3 Gd6 Li O14 -","- B12 Gd24 Li4 O56 -","4","1","","Jubera, V.; Fouassier, C.; Chaminade, J.P.; Gravereau, P.","A new family of lithium rare-earth oxyborates, Li Ln6 O5 (B O3)3 (Ln= Pr-Tm): crystal structure of the gadolinium phase Li Gd6 O5 (B O3)3","Journal of Solid State Chemistry","1999","146","","189","196","10.1006/jssc.1999.8331","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510926","6.6128","","6.8695","","7.7978","","106.06","","90.55","","115.63","","303.475","","","","","","","","","","","","","3","P -1","-P 1","2","","La3 (B N2)3","","- B3 La3 N6 -","- B3 La3 N6 -","- B6 La6 N12 -","2","1","","Reckeweg, O.; Meyer, H.J.","Lanthanide nitrido borates with six-membered B3 N6 rings: Ln3 B3 N6","Angew. Chem. Int. ed.","1999","38","","1607","1609","10.1002/(SICI)1521-3773(19990601)38:11<1607::AID-ANIE1607>3.0.CO;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510937","12.1195","","12.1195","","7.0153","","90","","90","","120","","892.373","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Pr3 (B3 N6)","","- B3 N6 Pr3 -","- B3 N6 Pr3 -","- B18 N36 Pr18 -","6","0.166667","","Schnick, W.; Orth, M.","Zur Kenntnis von Tripraseodymium-hexanitridotriborat Pr3 B3 N6: Neue Synthese und Verfeinerung der Kristallstruktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","551","554","10.1002/(SICI)1521-3749(199904)625:4<551::AID-ZAAC551>3.0.CO;2-6","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1510990","5.0722","","5.0722","","10.784","","90","","90","","120","","240.272","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Nd3 Co13 B2","","- B2 Co13 Nd3 -","- B2 Co13 Nd3 -","- B2 Co13 Nd3 -","1","0.0416667","","Liang, J.-K.; Chen, Y.; Chen, X.-L.; Liu, Q.L.; Huang, F.; Shen, B.-G.","Crystallographic and magnetic properties of intermetallic compound Nd3 Co13 B2","Applied Physics Letters","1999","74","","856","858","10.1063/1.123389","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511017","7.412","","7.412","","7.412","","90","","90","","90","","407.199","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Zr V1.9 B0.1","","- B0.1 V1.9 Zr -","- B0.1 V1.9 Zr -","- B0.8 V15.2 Zr8 -","8","0.0416667","","Harris, I.R.; Yartys', V.A.; Hauback, B.C.; Guegan, P.W.; Wiesinger, G.; Riabov, A.B.","Hydrogenation behaviour, neutron diffraction studies and microstructural characterisation of boron oxide-doped Zr V alloys","Journal of Alloys Compd.","1999","293","","93","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511024","6.5834","","6.7751","","7.7298","","106.054","","90.73","","115.524","","295.514","","","","","","","","","","","","","3","P -1","-P 1","2","","Ce (B N2)","","- B Ce N2 -","- B Ce N2 -","- B6 Ce6 N12 -","6","3","","Reckeweg, O.; Meyer, H.J.","Lanthanide nitrido borates with six-membered B3 N6 rings: Ln3 B3 N6","Angew. Chem. Int. ed.","1999","38","","1607","1609","10.1002/(SICI)1521-3773(19990601)38:11<1607::AID-ANIE1607>3.0.CO;2-0","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511041","13.262","","13.262","","13.262","","90","","90","","90","","2332.53","","","","","","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","Sr0.5 (Zr6 B Cl11.34 I2.66)","","- B Cl11.34 I2.66 Sr0.5 Zr6 -","- B Cl11.376 I2.624 Sr0.5 Zr6 -","- B4 Cl45.504 I10.496 Sr2 Zr24 -","4","0.166667","","Koeckerling, M.","New boron-centered mixed-halide zirconium cluster phases with a cubic structure: Na Zr6 Cl(12-2x) I(2+x) B(x<=6) and A(II)0.5 Zr6 (Cl, I)14 B (A(II)=Ca, Sr, Ba)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","24","30","10.1002/(SICI)1521-3749(199901)625:1<24::AID-ZAAC24>3.3.CO;2-3","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511081","7.5062","","7.914","","8.038","","118.048","","102.96","","104.498","","373.887","","","","","","","","","","","","","5","P -1","-P 1","2","","Cs (Zn B P2 O8)","","- B Cs O8 P2 Zn -","- B Cs O8 P2 Zn -","- B2 Cs2 O16 P4 Zn2 -","2","1","","Boy, I.; Kniep, R.; Engelmann, H.; Schaefer, G.","K (Zn B P2 O8) and A (Zn B P2 O8) (A= NH4+, Rb+, Cs+): Zincoborophosphates as a new class of compounds with tetrahedral framework structures","Angew. Chem. Int. ed.","1999","38","","3642","3644","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511113","6.468","","6.477","","6.22","","107.78","","108","","93.07","","232.816","","","","","","","","","","","","","3","P -1","-P 1","2","","Eu (B O3)","","- B Eu O3 -","- B Eu O3 -","- B4 Eu4 O12 -","4","2","","Antic-Fidancev, E.; le Blanc, M.; Corbel, G.; Lemaitre-Blaise, M.; Krupa, J.C.","Luminescence analysis and subsequent revision of crystal structure of triclinic L - (Eu B O3)","Journal of Alloys Compd.","1999","287","","71","78","10.1016/S0925-8388(99)00023-7","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511114","12.1607","","12.1607","","12.1607","","90","","90","","90","","1798.36","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Zr3 V3 B0.24 O0.36","","- B0.24 O0.36 V3 Zr3 -","- B0.24 O0.36 V3 Zr3 -","- B3.84 O5.76 V48 Zr48 -","16","0.0833333","","Yartys', V.A.; Guegan, P.W.; Harris, I.R.; Wiesinger, G.; Riabov, A.B.; Hauback, B.C.","Hydrogenation behaviour, neutron diffraction studies and microstructural characterisation of boron oxide-doped Zr V alloys","Journal of Alloys Compd.","1999","293","","93","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511186","10.284","","4.224","","13.246","","90","","90.87","","90","","575.335","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Sr2 (B N2) I","","- B I N2 Sr2 -","- B I N2 Sr2 -","- B4 I4 N8 Sr8 -","4","1","","Rohrer, F.E.; Nesper, R.","Sr2 B N2 I: a strontium iodide compound with isolated B N2(3-) units","Journal of Solid State Chemistry","1999","142","","187","191","10.1006/jssc.1998.8028","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511198","12.617","","12.773","","8.415","","90","","91.25","","90","","1355.81","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","K (Zn B P2 O8)","","- B K O8 P2 Zn -","- B K O8 P2 Zn -","- B8 K8 O64 P16 Zn8 -","8","1","","Kniep, R.; Boy, I.; Schaefer, G.; Engelmann, H.","K (Zn B P2 O8) and A (Zn B P2 O8) (A= NH4+, Rb+, Cs+): Zincoborophosphates as a new class of compounds with tetrahedral framework structures","Angew. Chem. Int. ed.","1999","38","","3642","3644","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511243","14.1159","","14.1159","","14.1159","","71.955","","71.955","","71.955","","2470.69","","","","","","","","","","","","","5","R -3 m :R","-P 3* 2","166","","(N H4) ((V O)2 B P2 O9) (H2 O)3","","- B N O13.5 P2 V2 -","- B N O13.5 P2 V2 -","- B6 N6 O81 P12 V12 -","6","0.5","","Do, J.; Jacobson, A.J.; Bontchev, R.P.","Templated synthesis of vanadium borophosphate cluster anions: (C4 H12 N2)6 ((V O)2 B P2 O10)4n * 6(H2 O), (N H4)18 ((V O)2 B P2 O10)18n * 12(H2 O) and (Na)15 ((V O)2 B P2 O10)5n * 12(H2 O)","Angew. Chem. Int. ed.","1999","38","","1937","1940","10.1002/(SICI)1521-3773(19990712)38:13/14<1937::AID-ANIE1937>3.0.CO;2-5","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1511267","14.9085","","14.9085","","6.9196","","90","","90","","120","","1331.92","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Y0.915 Ni4.123 B","","- B Ni4.123 Y0.915 -","- B Ni4.12278 Y0.914722 -","- B18 Ni74.21 Y16.465 -","18","0.75","","Behr, G.; Paufler, P.; Belger, A.; Zahn, G.; Graw, G.; Wehner, B.","The defect structure of Y0.915 Ni4.12 B related to the superstructure of Y Ni4 B","Journal of Alloys Compd.","1999","283","","26","33","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511292","7.439","","7.639","","7.861","","118.82","","101.73","","103.51","","353.418","","","","","","","","","","","","","5","P -1","-P 1","2","","Rb (Zn B P2 O8)","","- B O8 P2 Rb Zn -","- B O8 P2 Rb Zn -","- B2 O16 P4 Rb2 Zn2 -","2","1","","Boy, I.; Engelmann, H.; Kniep, R.; Schaefer, G.","K (Zn B P2 O8) and A (Zn B P2 O8) (A= NH4+, Rb+, Cs+): Zincoborophosphates as a new class of compounds with tetrahedral framework structures","Angew. Chem. Int. ed.","1999","38","","3642","3644","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511331","11.016","","16.75499","","3.564","","90","","90","","90","","657.818","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Ta4 B Te4 (Te2)2","","- B Ta4 Te8 -","- B Ta4 Te8 -","- B2 Ta8 Te16 -","2","0.25","","Kleinke, H.; Finckh, E.W.; Tremel, W.","Ta4 B Te8: Tantalum telluride cluster chains with encapsulated boron atoms","Angew. Chem. Int. ed.","1999","38","","2054","2057","10.1002/(SICI)1521-3773(19990712)38:13/14<2054::AID-ANIE2054>3.0.CO;2-Y","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511387","5.5244","","5.5244","","7.4416","","90","","90","","90","","227.11","","","","","","","","","","","","","5","P 4 b m","P 4 -2ab","100","","Nd Ba Cu O2.06 (B O3)0.94","","- B0.94 Ba Cu Nd O4.88 -","- B0.94 Ba Cu Nd O4.88 -","- B1.88 Ba2 Cu2 Nd2 O9.76 -","2","0.25","","Reading, J.; Weller, M.T.","Powder neutron diffraction structural analysis of the lanthanide barium copper oxyborates, Ln Ba Cu O2 B O3 (Ln = La, Pr and Nd)","Physica C (Amsterdam)","1999","328","","31","36","10.1016/S0921-4534(99)00521-3","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511405","5.537","","5.537","","7.4593","","90","","90","","90","","228.69","","","","","","","","","","","","","5","P 4 b m","P 4 -2ab","100","","Pr Ba Cu O2.047 (B O3)0.953","","- B0.953 Ba Cu O4.906 Pr -","- B0.953 Ba Cu O4.906 Pr -","- B1.906 Ba2 Cu2 O9.812 Pr2 -","2","0.25","","Weller, M.T.; Reading, J.","Powder neutron diffraction structural analysis of the lanthanide barium copper oxyborates, Ln Ba Cu O2 B O3 (Ln = La, Pr and Nd)","Physica C (Amsterdam)","1999","328","","31","36","10.1016/S0921-4534(99)00521-3","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511420","9.86","","10.74","","11.078","","99.94","","90.81","","115.97","","1033.48","","","","","","","","","","","","","4","P -1","-P 1","2","","Cs4 Hg2 (B12 (B Se3)6)","","- B18 Cs4 Hg2 Se18 -","- B18 Cs4 Hg2 Se18 -","- B18 Cs4 Hg2 Se18 -","1","0.5","","Krebs, B.","Drei neue Selenoborato-closo-dodekaborate: Synthesen und Kristallstrukturen von Rb8 (B12 (B Se3)6), Rb4 Hg (B12 (B Se3)6) und Cs4 Hg2 (B12 (B Se3)6)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1165","1171","10.1002/(SICI)1521-3749(199907)625:7<1165::AID-ZAAC1165>3.0.CO;2-F","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511424","9.5928","","10.458","","11.131","","99.25","","91.16","","116.3","","982.776","","","","","","","","","","","","","4","P -1","-P 1","2","","Rb4 Hg2 (B12 (B Se3)6)","","- B18 Hg2 Rb4 Se18 -","- B18 Hg2 Rb4 Se18 -","- B18 Hg2 Rb4 Se18 -","1","0.5","","Krebs, B.","Drei neue Selenoborato-closo-dodekaborate: Synthesen und Kristallstrukturen von Rb8 (B12 (B Se3)6), Rb4 Hg (B12 (B Se3)6) und Cs4 Hg2 (B12 (B Se3)6)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1165","1171","10.1002/(SICI)1521-3749(199907)625:7<1165::AID-ZAAC1165>3.0.CO;2-F","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511429","20.686","","20.686","","20.915","","90","","90","","120","","7750.71","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","(Zn (C2 H8 N2)2)6 ((V O)12 O6 B18 O39 (O H)3) (H2 O)13","","- B18 O72.994 V12 Zn6 -","- B18 O72.994 V12 Zn6 -","- B54 O218.982 V36 Zn18 -","3","0.166667","","Zhang, L.; Shi, Z.; Feng, S.-H.; Yang, G.; Chen, X.","Hydrothermal synthesis and X-ry single crystal structure of (Zn (en)2)6 ((V O)12 O6 B18 O39 (O H)3)*13 H2 O","Journal of Solid State Chemistry","1999","148","","450","454","10.1006/jssc.1999.8478","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511431","10.512","","10.45","","10.946","","104.53","","91.16","","109.11","","1092.91","","","","","","","","","","","","","3","P -1","-P 1","2","","Rb8 (B12 (B Se3)6)","","- B18 Rb8 Se18 -","- B18 Rb8 Se18 -","- B18 Rb8 Se18 -","1","0.5","","Krebs, B.","Drei neue Selenoborato-closo-dodekaborate: Synthesen und Kristallstrukturen von Rb8 (B12 (B Se3)6), Rb4 Hg (B12 (B Se3)6) und Cs4 Hg2 (B12 (B Se3)6)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1165","1171","10.1002/(SICI)1521-3749(199907)625:7<1165::AID-ZAAC1165>3.0.CO;2-F","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511433","18.211","","11.519","","13.31","","90","","95.63","","90","","2778.6","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Rb5 (B19 O31)","","- B19 O31 Rb5 -","- B19 O31 Rb5 -","- B76 O124 Rb20 -","4","0.5","","Bannova, I.I.; Filatov, S.K.; Bubnova, R.S.; Krzhizhanovskaya, M.G.","Crystal structure and thermal expansion of Rb5 B19 O31","Kristallografiya","1999","44","","220","225","","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511527","4.204","","20.92","","20.95","","91.74","","90.03","","93.12","","1838.92","","","","","","","","","","","","","4","P -1","-P 1","2","","Ba8 (B N2)5 F","","- B5 Ba8 F N10 -","- B5 Ba8 F N10 -","- B20 Ba32 F4 N40 -","4","2","","Rohrer, F.E.; Nesper, R.","Ba8 (B N2)5 F: A barium fluoride compound with isolated B N2(3-) units","Journal of Solid State Chemistry","1999","142","","192","198","10.1006/jssc.1998.8027","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511614","10.5911","","10.5911","","10.5911","","90","","90","","90","","1188.02","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","In2 Ni21 B6","","- B6 In2 Ni21 -","- B6 In2 Ni21 -","- B24 In8 Ni84 -","4","0.0208333","","Jansen, M.; Adelsberger, T.","Darstellung, Kristallstruktur und magnetische Eigenschaften von In2 Ni21 B6","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","438","442","10.1002/(SICI)1521-3749(199903)625:3<438::AID-ZAAC438>3.0.CO;2-T","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511618","5.975","","5.975","","4.189","","90","","90","","90","","149.55","","","","","","","","","","","","","2","P 4/m b m","-P 4 2ab","127","","Li2 B6","","- B6 Li2 -","- B6 Li2 -","- B12 Li4 -","2","0.125","","Woerle, M.; von Schnering, H.G.; Mair, G.; Nesper, R.","Dilithium hexaboride, Li2 B6","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1207","1211","10.1002/(SICI)1521-3749(199907)625:7<1207::AID-ZAAC1207>3.0.CO;2-9","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511662","7.731","","9.03","","14.194","","81.55","","82.18","","64.76","","883.577","","","","","","","","","","","","","3","P -1","-P 1","2","","Pr8 Cl7 B7","","- B7 Cl7 Pr8 -","- B7 Cl7 Pr8 -","- B14 Cl14 Pr16 -","2","1","","Vajenine, G.V.; Mattausch, H.J.; Kremer, R.K.; Oeckler, O.; Simon, A.","Pr8 Cl7 B7: preparation, structure, bonding, properties","Solid State Sciences","1999","1","","509","521","10.1016/S1293-2558(00)80103-X","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1511754","9.819","","9.819","","7.987","","90","","90","","120","","666.882","","","","","","","","","","","","","4","R 3 2 :H","R 3 2""","155","","La Sc3 (B O3)4","","- B4 La O12 Sc3 -","- B4 La O12 Sc3 -","- B12 La3 O36 Sc9 -","3","0.166667","","Lu, S.-F.; He, M.-Y.; Chen, W.-Z.; Lin, Z.-B.; Wang, G.-F.; Wu, Q.-J.","Structure of medium temperature phase beta-(La Sc3 (B O3)4) crystal","Materials Research Innovation","1999","2","","345","348","10.1007/s100190050112","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511755","7.74","","9.864","","12.066","","90","","105.48","","90","","887.789","","","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","La Sc3 (B O3)4","","- B4 La O12 Sc3 -","- B4 La O12 Sc3 -","- B16 La4 O48 Sc12 -","4","1","","Wang, G.-F.; Lu, S.-F.; Chen, W.-Z.; Wu, Q.-J.; He, M.-Y.; Lin, Z.-B.","Structure of low temperature phase gamma-(La Sc3 (B O3)4) crystal","Materials Research Innovation","1999","2","","341","344","10.1007/s100190050111","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1512117","3.8409","0.0001","3.8409","0.0001","3.8409","0.0001","90","","90","","90","","56.663","0.003","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Strontium Vanadium Oxide","","- O3 Sr V -","- O3 Sr V -","- O3 Sr V -","1","0.0208333","","Garcia-Jaca, J.; Mesa, J.L.; Insausti, M.; Larramendi, J.I.R.; Arriortua, M.I.; Rojo, T.","Synthesis, crystal structure, stoichiometry and magnetic properties of (Ca1-x Srx) V O3","Materials Research Bulletin","1999","34","2","289","301","10.1016/S0025-5408(99)00002-1","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1513995","8.2164","0.0004","8.2164","0.0004","8.2164","0.0004","90","","90","","90","","554.68","0.05","","","","","","","","","","","","3","F d -3 m :1","F 4d 2 3 -1d","227","","Lithium Manganese Oxide (1.41/1.59/4)","","- Li1.406 Mn1.592 O4 -","- Li1.406 Mn1.592 O4 -","- Li11.248 Mn12.736 O32 -","8","0.0416667","","Wolska, E.; Piszora, P.; Stempin, K.; Catlow, C. R. A.","X-ray powder diffraction study of cation distribution and the (Fd3-m)- P4132 symmetry reduction in (Li0.5 Fe2.5 O4)-(Li Mn2 O4) spinel solid solutions","Journal of Alloys and Compounds","1999","286","","203","207","10.1016/S0925-8388(98)01007-X","","","","","","0.052","","","","","","","","","","","","","","","has coordinates","176788","2020-10-21","18:00:00",""
"1513996","8.24376","0.00013","8.24376","0.00014","8.24376","0.00014","90","","90","","90","","560.242","0.016","","","","","","","","","","","","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","","Oikawa, K.; Kamiyama, T.; Izumi, F.; Nakazato, D.; Ikuta, H.; Wakihara, M.","Neutron and X-ray powder diffraction studies of Li Mn2-y Cry O4","Journal of Solid State Chemistry","1999","146","","322","328","10.1006/jssc.1999.8351","","","","","","0.025","","","","","","","","","","","","","","","has coordinates","176788","2020-10-21","18:00:00",""
"1513997","8.2211","0.0004","8.2211","0.0004","8.2211","0.0004","90","","90","","90","","555.64","0.05","","","","","","","","","","","","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","","Berg, H.; Thomas, J. O.","Neutron diffraction study of electrochemically delithiated Li Mn2 O4 spinel","Solid State Ionics","1999","123","","227","234","","","","","","","0.045","","","","","","","","","","","","","","","has coordinates","176788","2020-10-21","18:00:00",""
"1513999","8.144","0.002","8.144","0.002","8.144","0.002","90","","90","","90","","540.1","0.2","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (0.74/2/4)","","- Li0.74 Mn2 O4 -","- Li0.74 Mn2 O4 -","- Li5.92 Mn16 O32 -","8","0.0416667","","Berg, H.; Thomas, J. O.","Neutron diffraction study of electrochemically delithiated Li Mn2 O4 spinel","Solid State Ionics","1999","123","","227","234","","","","","","","0.015","","","","","","","","","","","","","","","has coordinates","176788","2020-10-21","18:00:00",""
"1514001","8.043","0.001","8.043","0.001","8.043","0.001","90","","90","","90","","520.3","0.11","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (0.28/2/4)","","- Li0.28 Mn2 O4 -","- Li0.28 Mn2 O4 -","- Li2.24 Mn16 O32 -","8","0.0416667","","Berg, H.; Thomas, J. O.","Neutron diffraction study of electrochemically delithiated Li Mn2 O4 spinel","Solid State Ionics","1999","123","","227","234","","","","","","","0.016","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1514003","5.51402","0.00008","8.39754","0.00015","6.35911","0.0001","90","","90","","90","","294.454","0.008","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Lithium Manganate(VII)","","- Li Mn O4 -","- Li Mn O4 -","- Li4 Mn4 O16 -","4","0.25","","Hoppe, R.; Fischer, D.; Schneider, J.","Zur Kenntnis von Oxyden A (M O4): Ueber Li Mn O4, K Mn O4, Rb Mn O4, Cs Mn O4 sowie Rb I O4 und Cs I O4. (-Was heisst eigentlich ""Die Kristallstruktur von...""?-)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1135","1142","10.1002/(SICI)1521-3749(199907)625:7<1135::AID-ZAAC1135>3.0.CO;2-L","","","","","","0.021","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1518608","8.6454","0.0002","16.0027","0.0004","15.5074","0.0004","90","","90.017","0.001","90","","2145.44","0.09","","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Na8 O26 S6 V2 -","- Na8 O26 S6 V2 -","- Na32 O104 S24 V8 -","4","1","","Nielsen, Kurt; Boghosian, Soghomon; Fehrmann, Rasmus; Berg, Rolf Willestofte","Crystal Structure and Spectroscopic Characterization of a Green V(IV) Compound, Na8(VO)2(SO4)6","Acta Chemica Scandinavica","1999","53","","15","23","","","x-ray","0.71069","MoKα","","","0.0479","","","0.081","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518688","12.889","0.007","6.852","0.003","6.784","0.003","90","","104.92","0.05","90","","578.9","0.5","","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","thymine","","","- C5 H6 N2 O2 -","- C5 N2 O2 -","- C20 N8 O8 -","4","1","","Gustavo Portalone; Luigi Bencivenni; Marcello Colapietro; Andrea Pieretti; Fabio Ramondo","The effect of hydrogen bonding on the structures of uracil and some methyl derivatives studied by experiment and theory","Acta Chemica Scandinavica","1999","53","","57","68","","","x-ray","0.71069","MoKα","","","0.0458","","","0.0637","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518706","9.88","0.001","9.877","0.001","13.064","0.001","90","","90","","90","","1274.8","0.2","","","5","","","","","","","","","6","I 2 2 2","I 2 2","23","","","","- Al10 Cl2 H16 K12 O48 Si10 -","- Al10 Cl1.836 H4.368 K11.748 O42.208 Si10 -","- Al10 Cl1.836 H4.368 K11.748 O42.208 Si10 -","1","0.125","","Norlund Christensen, A.; Fjellvag, H.","Neutron powder diffraction study of the dehydration of zeolite N","Acta Chemica Scandinavica","1999","53","","85","89","","powder diffraction","neutron","1.5938","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1518707","9.779","0.001","9.743","0.001","13.142","0.001","90","","90","","90","","1252.1","0.2","","","623","","","","","","","","","6","I 2 2 2","I 2 2","23","","","","- Al10 Cl2 H16 K12 O48 Si10 -","- Al10 Cl1.56 H1.44 K10.72 O40.72 Si10 -","- Al10 Cl1.56 H1.44 K10.72 O40.72 Si10 -","1","0.125","","Norlund Christensen, A.; Fjellvag, H.","Neutron powder diffraction study of the dehydration of zeolite N","Acta Chemica Scandinavica","1999","53","","85","89","","powder diffraction","neutron","1.5938","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1518708","12.882","0.004","21.1","0.006","22.706","0.006","90","","90","","90","","6172","3","","","293","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C56 H57 Cl3 La N15 O12 -","- C56 Cl3 La N15 O12 -","- C224 Cl12 La4 N60 O48 -","4","1","","Liu Jiacheng; Song Zhigang; Wang Liufang; Zhuang Jinzhong; Huang Xiaoying","Preparation and characterization of lanthanides(III) complexes with polybenzimidazole ligands. Crystal structure of bis[tris(N-methyl-1-benzimidazol-2-yl)-amine]lanthanum(III) perchlorate monoacetonitrile solvate","Acta Chemica Scandinavica","1999","53","","90","94","","","x-ray","0.71073","MoKα","","","0.06","","","0.065","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518709","12.143","0.006","11.815","0.007","11.505","0.005","90","","93.53","0.04","90","","1647.5","1.5","","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Ca H21 N7 S6 -","- Ca H21 N7 S6 -","- Ca4 H84 N28 S24 -","4","1","","Schimek, George L.; Drake, Greg W.; Kolis, Joseph W.","Crystal Structure of Calcium Heptaammine Hexasulfide, Ca(NH3)7S6","Acta Chemica Scandinavica","1999","53","","145","148","","","x-ray","0.71069","MoKα","","","0.0423","","","0.0412","","","","","","","","","","","has coordinates","301776","2025-08-18","14:47:53",""
"1518710","8.42","0.002","20.526","0.005","18.877","0.003","90","","91.1","0.2","90","","3261.9","1.2","","","105","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H53 Cr2 N6 O16 S3 -","- C18 Cr2 N6 O16 S3 -","- C72 Cr8 N24 O64 S12 -","4","1","","Kalsbeek, Nicoline; Larsen, Sine","Crystal Structure of Tri-mu-hydroxobis[(1,4,7-trimethyl-1,4,7-triazacyclononane)chromium(III)] Dithionate Tetrahydrate","Acta Chemica Scandinavica","1999","53","","149","154","","","x-ray","0.71073","MoKα","","","0.0313","","","0.0911","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518721","8.806","0.0018","10.675","0.002","14.2","0.003","90","","104.16","0.03","90","","1294.3","0.5","","","263","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H28 Br6 N2 Se0.75 Te0.25 -","- C18 Br6 N2 Se0.75 Te0.25 -","- C36 Br12 N4 Se1.5 Te0.5 -","2","0.5","","Vitalijus Janickis","Syntheses and Crystal Structures of Phenyltrimethylammonium Salts of a Mixed Hexabromoselenate/tellurate(IV), [C6H5(CH3)3N]2[Se0.75Te0.25Br6], and a Mixed catena-poly[(Di-mu-bromobis{tetrabromoselenate/tellurate(IV)})-mu-bromine], [C6H5(CH3)3N]2n[Se1.5Te 0.5Br10.Br2]n","Acta Chemica Scandinavica","1999","53","","188","193","","","x-ray","0.71073","MoKα","","","0.056","","","0.1398","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518722","8.6676","0.0017","8.8614","0.0018","11.473","0.002","94.13","0.03","102.19","0.03","90.47","0.03","858.9","0.3","","","112","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H28 Br12 N2 Se1.5 Te0.5 -","- C18 Br12 N2 Se1.5 Te0.5 -","- C18 Br12 N2 Se1.5 Te0.5 -","1","0.5","","Vitalijus Janickis","Syntheses and Crystal Structures of Phenyltrimethylammonium Salts of a Mixed Hexabromoselenate/tellurate(IV), [C6H5(CH3)3N]2[Se0.75Te0.25Br6], and a Mixed catena-poly[(Di-mu-bromobis{tetrabromoselenate/tellurate(IV)})-mu-bromine], [C6H5(CH3)3N]2n[Se1.5Te 0.5Br10.Br2]n","Acta Chemica Scandinavica","1999","53","","188","193","","","x-ray","0.71073","MoKα","","","0.0441","","","0.1212","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518746","9.998","0.002","15.476","0.003","12.957","0.003","90","","92.64","0.02","90","","2002.7","0.7","","","293","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C19 H33 N5 O2 -","- C19 N5 O2 -","- C76 N20 O8 -","4","1","","Hietapelto, Vesa; Huuskonen, Juhani; Laitinen, Risto S.; Leppa-aho, Jaakko; Pursiainen, Jouni","Preparation, Characterization and Complexation of 4,6-Dimethyl-1,3-bis{methyl[1-(2-hydroxyethyl)piperazyl]}benzene and 2,6-Di{methyl[1-(2-hydroxyethyl)piperazyl]}pyridine","Acta Chemica Scandinavica","1999","53","","194","201","","","x-ray","0.71073","MoKα","","","0.0591","","","0.1079","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518749","11.6494","0.0016","11.852","0.002","18.574","0.002","90","","102.551","0.011","90","","2503.2","0.6","","","122.4","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H39 B4 F16 Mo2 N13 -","- C43 B4 F16 Mo2 N12 -","- C86 B8 F32 Mo4 N24 -","2","0.5","","Dossing, Anders; Larsen, Sine; van Lelieveld, Alexander; Bruun, Rikke Mattsson","Preparation and Crystal Structure of Tetrakis(mu-1,8-naphthyridine)dimolybdenum(II) Tetrafluoroborate.","Acta Chemica Scandinavica","1999","53","","230","234","","","x-ray","1.54184","CuKα","","","0.0774","","","0.1927","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518750","12.127","0.001","12.627","0.001","12.298","0.002","90","","116.4","0.01","90","","1686.8","0.4","","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H20 P2 S4 Se -","","","4","1","","Canseco-Melchor, Graciela; Garcia-Montalvo, Veronica; Toscano, Ruben A.; Cea-Olivares, Raymundo","A New Class of Structure for Selenium(II) Dithiocomplexes. The Trigonal Molecular Structure of Bis(diethyldithiophosphinato)selenium(II), [Se(S2PEt2)2].","Acta Chemica Scandinavica","1999","53","","100","102","","","x-ray","0.71073","MoKα","","","0.0557","","","0.0611","","","","","","","","","","","","188511","2020-10-21","18:00:00",""
"1518751","8.572","0.005","18.811","0.003","9.73","0.003","90","","113.82","0.03","90","","1435.3","1","","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H21 N3 O -","","","4","1","","Rosling, Ari; Klika, Karel D.; Fulop, Ferenc; Sillanpaa, Reijo; Mattinen, Jorma","An NMR Conformational Study of Ring- and N-Inversion, and Prototropic Tautomerism in Stereoisomeric 2-[Arylamino(imino)]-4a,5,6,7,8,8a-hexahydro-(4H)-1,3,4-benzoxadiazines.","Acta Chemica Scandinavica","1999","53","","103","113","","","x-ray","0.71069","MoKα","","","0.051","","","0.043","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1518752","17.553","0.003","6.814","0.002","24.23","0.01","90","","96.55","0.02","90","","2879.1","1.5","","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C14 H19 N3 O -","","","8","1","","Rosling, Ari; Klika, Karel D.; Fulop, Ferenc; Sillanpaa, Reijo; Mattinen, Jorma","An NMR Conformational Study of Ring- and N-Inversion, and Prototropic Tautomerism in Stereoisomeric 2-[Arylamino(imino)]-4a,5,6,7,8,8a-hexahydro-(4H)-1,3,4-benzoxadiazines.","Acta Chemica Scandinavica","1999","53","","103","113","","","x-ray","0.71069","MoKα","","","0.043","","","0.04","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519005","9.47","0.002","7.93","0.001","9.865","0.001","90","","115.78","0.01","90","","667.1","0.19","","","293","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- Ba Ca H2 O8 P2 -","- Ba Ca H2 O8 P2 -","- Ba4 Ca4 H8 O32 P8 -","4","1","","Taher, L. B.; Chabchoub, S.; Smiri-Dogguy, L.","Investigation of mixed alkaline earth phosphates. Synthesis and crystal structure of CaBa(HPO4)2 : A new mixed alkaline earth hydrogenmonophosphate","Solid State Sciences","1999","1","","15","24","","","x-ray","0.71069","MoKα","","","0.0331","","","0.0858","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1519006","13.678","0.002","10.318","0.003","17.357","0.003","90","","90","","90","","2449.6","0.9","","","293","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C2 H9 Al3 N O13 P3 -","- C2 H8 Al3 N O13 P3 -","- C16 H64 Al24 N8 O104 P24 -","8","1","","Soulard, M.; Patarin, J.; Marler, B.","Synthesis and structure of Mu-10 : a novel microporous hydroxyaluminophosphate (CH3)2NH2.Al3P3O12OH closely related to AlPO4-EN3","Solid State Sciences","1999","1","","37","53","","","x-ray","0.71073","MoKα","","","0.0422","","","0.1241","","","","","","","0.98","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519007","37.824","0.008","9.813","0.002","16.679","0.003","90","","92.7","0.03","90","","6184","2","","","295","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Cu3 F K3 O16 P4 Zn2 -","- Cu3 F K3 O16 P4 Zn2 -","- Cu48 F16 K48 O256 P64 Zn32 -","16","2","","Massa, W.; Yakubovich, O. V.; Dem Yanetz, L. N.","New open framework in the structure of K3[Cu3FZn2(PO4)4]","Solid State Sciences","1999","1","","109","118","","","x-ray","0.71073","MoKα","","","0.0255","","","0.0572","","","","","","","0.806","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519008","12.021","0.001","17.918","0.003","6.874","0.0007","90","","90","","90","","1480.6","0.3","","","298","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C17 H16 Cu N2 O2 -","- C17 Cu N2 O2 -","- C68 Cu4 N8 O8 -","4","1","","Chen, B. H.; Yao, H. H.; Huang, W. T.; Chattopadhyay, P.; Lo, J. M.; Lu, T. H.","Syntheses and molecular structures of three Cu(II) complexes with tetradentate imine-phenols","Solid State Sciences","1999","1","","119","131","","","x-ray","0.7093","MoKα","","","0.043","","","0.069","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1519009","9.7329","0.0009","17.187","0.002","11.338","0.001","90","","112.99","0.01","90","","1746","0.3","","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 Cu N2 O2 -","- C19 Cu N2 O2 -","- C76 Cu4 N8 O8 -","4","1","","Chen, B. H.; Yao, H. H.; Huang, W. T.; Chattopadhyay, P.; Lo, J. M.; Lu, T. H.","Syntheses and molecular structures of three Cu(II) complexes with tetradentate imine-phenols","Solid State Sciences","1999","1","","119","131","","","x-ray","0.7093","MoKα","","","0.064","","","0.077","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1519010","18.888","0.002","10.3781","0.0007","19.93","0.001","90","","113.786","0.005","90","","3574.9","0.5","","","298","","","","","","","","","5","A 1 2/n 1","-A 2yab","15","","","","- C38 H40 Cu2 N4 O4 -","- C38 Cu2 N4 O4 -","- C152 Cu8 N16 O16 -","4","0.5","","Chen, B. H.; Yao, H. H.; Huang, W. T.; Chattopadhyay, P.; Lo, J. M.; Lu, T. H.","Syntheses and molecular structures of three Cu(II) complexes with tetradentate imine-phenols","Solid State Sciences","1999","1","","119","131","","","x-ray","0.7093","MoKα","","","0.047","","","0.069","","","","","","","","","","","has coordinates","209440","2020-10-21","18:00:00",""
"1519011","5.6085","0.0006","10.917","0.016","12.042","0.002","90","","90","","90","","737.3","1.1","","","294","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- H4 Mn O8 V2 -","- Mn O8 V2 -","- Mn4 O32 V8 -","4","0.5","","M. Ishaque Khan; T. Hope; S. Tabassum","Synthesis, reactivity, x-ray structure and thermal study of the mixed-metal oxide hydrate [Mn(H2O)2V2O6]","Solid State Sciences","1999","1","","163","178","","","x-ray","0.71073","MoKα","","","0.0241","","","0.0623","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519012","11.843","0.008","13.717","0.008","10.287","0.005","108.11","0.04","99.42","0.05","66.52","0.04","1455.3","1.6","","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H18 K6 Mo2 O24 -","- C12 K6 Mo2 O24 -","- C24 K12 Mo4 O48 -","2","1","","Zhou, X.-H.; Xing, Y.-H.; Xu, J.-Q.; Li, D.-M.; Wang, R.-Z.; Liu, S.-Q.; Zeng, Q.-X.; Huang, X.-Y.","Mobybdenum(VI)-oxygen complex containing citrage ligand: synthesis and characterization of K6[Mo205(cit)2].5H20","Solid State Sciences","1999","1","","189","198","","","x-ray","0.71069","MoKα","","","0.034","","","0.054","","","","","","","1.77","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519013","8.2005","0.0009","8.2005","0.0009","8.2005","0.0009","90","","90","","90","","551.47","0.1","","","298","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","","","- Cl8 F13 Na2 Nb7 -","- Cl6.36 F12.6 Na1.872 Nb6.998 -","- Cl6.36 F12.6 Na1.872 Nb6.998 -","1","0.0208333","","Cordier, S.; Simon, A.","The first chlorofluoride in niobium cluster chemistry structure of the double salt : NaxNb7F(21-y)Cly (X = 2; y = 8)","Solid State Sciences","1999","1","","199","209","","","x-ray","0.71073","MoKα","","","0.033","","","0.041","","","","","","","0.942","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519014","10.7292","0.0007","3.2597","0.0001","5.0579","0.0004","90","","105.713","0.006","90","","170.284","0.019","","","293","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- D4 F2 N2 Sn -","- D4 F2 N2 Sn -","- D8 F4 N4 Sn2 -","2","0.25","","Reusch, U.; Schweda, R.","The transformation of Sn(ND3)2F4 into Sn(ND2)2F2z. Synthesis and neutron crystal structure determination of Sn(ND2)2F2","Solid State Sciences","1999","1","","233","243","","powder diffraction","neutron","","white","","","","","","","","","0.053","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519015","8.056","0.0002","10.365","0.0002","8.45","0.0002","90","","102.893","0.002","90","","687.79","0.03","","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- O9 Se2 V2 -","- O9 Se2 V2 -","- O36 Se8 V8 -","4","1","","Millet, P.; Galy, J.; Johnsson, M.","Crystal growth and structure of V2VSe2IVO9 ; comparison with V2Te209","Solid State Sciences","1999","1","","279","286","","","x-ray","0.71069","MoKα","","","0.0347","","","0.0802","","","","","","","1.11","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519016","19.006","0.003","10.718","0.002","10.996","0.003","90","","98.99","0.02","90","","2212.4","0.8","","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H26 N2 O7 P2 -","- C16 H8 N2 O7 P2 -","- C64 H32 N8 O28 P8 -","4","1","","Hlel, F.; Smiri, L.","Synthesis and crystal structure of bis (2-phenylethylammonium) dihydrogendimphosphate, [C6H5(CH2)2NH3]2H2P2O7","Solid State Sciences","1999","1","","321","329","","","x-ray","0.71073","MoKα","","","0.056","","","0.191","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519017","14.2604","0.0001","11.5999","0.0002","18.3249","0.0003","90","","90.324","0.001","90","","3031.24","0.08","","","296","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C6 H25 Al6 F3 N4 O26 P6 -","- C6 Al6 F3 N4 O27 P6 -","- C24 Al24 F12 N16 O108 P24 -","4","0.5","","Simon, N.; Loiseau, T.; Ferey, G.","Synthesis and crystal structure of MIL-27, a new oxyfluorinated three-dimensional framework metallophosphate obtained with aluminium in four, five and sixfold coordination and templated with the tris(2-aminoethyl)amine","Solid State Sciences","1999","1","","339","349","","","x-ray","0.71073","MoKα","","","0.0543","","","0.1489","","","","","","","1.092","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519018","9.1227","0.0009","9.1227","0.0009","10.5811","0.0017","90","","90","","120","","762.62","0.16","","","295","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- Ca3 Mn1.08 Ni0.92 O6 -","- Ca3 Mn1.08 Ni0.92 O6 -","- Ca18 Mn6.48 Ni5.52 O36 -","6","0.166667","","Bazuev, G. V.; Zubkov, V. G.; Berger, I. F.; Arbuzova, T. I.","Crystal structure and magnetic properties of a one dimensional complex oxide Ca3NiMnO6","Solid State Sciences","1999","1","","365","372","","powder diffraction","neutron","1.5147","","","","","","","","","","0.0296","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519019","36.6951","0.0011","12.5877","0.0005","8.0725","0.0002","90","","101.099","0.002","90","","3659","0.2","","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H18 N4 O S -","- C20 N4 O S -","- C160 N32 O8 S8 -","8","1","","Liu, Fushen; Dalhus, Bjorn; Gundersen, Lise-Lotte; Rise, Frode","Addition and Cycloaddition to 2- and 8-Vinylpurines","Acta Chemica Scandinavica","1999","53","","269","279","","","x-ray","0.71069","MoKα","","","0.0526","","","0.1187","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519020","18.0201","0.0003","18.0201","0.0003","20.1616","0.0003","90","","90","","90","","6546.96","0.18","","","296","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C17 H23 N O S -","","","16","1","","Hegab, Mohamed I.; Abdel-Megeid, Farouk M. E.; Gad, Farouk A.; Shiba, Sayed A.; Sotofte, Inger; Moller, Jorgen; Senning, Alexander","New Reactions of Thione S-(tert-Alkylimides)","Acta Chemica Scandinavica","1999","53","","284","290","","","x-ray","0.71073","MoKα","","","0.0783","","","0.1929","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519021","5.361","0.003","7.029","0.003","8.743","0.004","69.4","0.02","89.02","0.03","88.78","0.04","308.3","0.3","","","293","","","","","","","","","4","P -1","-P 1","2","","","","- Ca Na2 O7 P2 -","- Ca Na2 O7 P2 -","- Ca2 Na4 O14 P4 -","2","1","","Bennazha, J.; Boukhari, A.; Holt, E. M.","Synthesis and crystal structure of Na2CaP2O7","Solid State Sciences","1999","1","","373","380","","","x-ray","0.71073","MoKα","","","0.0445","","","0.0554","","","","","","","1.14","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519022","10.281","0.001","11.083","0.001","9.307","0.002","103.83","0.01","108.56","0.01","68.11","0.01","924.1","0.2","","","296","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H54 N8 O24 P6 -","- C12 N8 O24 P6 -","- C12 N8 O24 P6 -","1","0.5","","Marouani, H.; Rzaigui, M.","Synthesis and crystal structure of((NH3CH2CH2)3N)2P6O18.6H2O","Solid State Sciences","1999","1","","395","408","","","x-ray","0.71073","MoKα","","","0.028","","","0.034","","","","","","","5.19","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519023","14.983","0.001","14.983","0.001","15.54","0.001","90","","90","","90","","3488.6","0.4","","","293","","","","","","","","","3","P 43","P 4cw","78","","","","- Ba5 F19 In3 -","- Ba5 F19 In3 -","- Ba40 F152 In24 -","8","2","","de Kozak, A.; Dupont, N.; Gredin, P.; Riou, D.","The crystal structure of Ba5In3F19 : a new structural type in fluoride crystal chemistry","Solid State Sciences","1999","1","","409","419","","","x-ray","0.71073","MoKα","","","0.05","","","0.128","","","","","","","1.041","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519024","8.5907","0.0005","11.3962","0.0008","44.49","0.003","90","","90","","90","","4355.6","0.5","","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- Ce2 Cu K Se6 -","- Ce2 Cu K Se6 -","- Ce32 Cu16 K16 Se96 -","16","0.5","","Klawitter, Y.; Nather, C.; Jeb, I.; Bensch, W.; Kanatzidis, M. G.","The superstructure of KCuCe2Se6 due to ordering of copper cations","Solid State Sciences","1999","1","","421","431","","","x-ray","0.71073","MoKα","","","0.0311","","","0.1081","","","","","","","1.21","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519025","7.247","0.0001","11.2851","0.0002","5.226","0.0001","90","","107.843","0.001","90","","406.841","0.012","","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Bi Co O5 P -","- Bi Co O5 P -","- Bi4 Co4 O20 P4 -","4","1","","Ketatni, M.; Abraham, F.; Mentre, O.","Channel structure in the new BiCoPO5. Comparison with BiNiPO5. Crystal structure, lone pair localisation and infrared characterisation","Solid State Sciences","1999","1","","449","460","","powder diffraction","x-ray","1.5418","CuKα","","0.0214","","","","","","","0.0383","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519026","24.3557","0.0007","10.0135","0.0001","18.6388","0.0006","90","","92.37","0.002","90","","4541.9","0.2","","","213","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- B Br16 H39 O18 Zr6 -","","","4","0.5","","Xie, X.; Hughbanks, T.","Isolation of a water-stable B-centered hexazirconium bromide cluster, trans-[(Zr6BBr12)Br4(H2O)3]3-","Solid State Sciences","1999","1","","463","471","","","x-ray","0.71073","MoKα","","","0.0395","","","0.0835","","","","","","","","","","","","176435","2020-10-21","18:00:00",""
"1519027","17.942","0.009","17.979","0.004","16.344","0.008","90","","90","","90","","5272","4","","","293","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C30 H68 Co N8 O6 Re6 S8 -","- C30 Co N8 O6 Re6 S8 -","- C120 Co4 N32 O24 Re24 S32 -","4","1","","Naumov, N. G.; Artemkina, S. B.; Virovets, A. V.; Fedorov, V. E.","Adjustment of dimensionality in covalent frameworks formed by Co2+ and rhenium cluster chalcocyanide [Re6S8(CN)6]4-","Solid State Sciences","1999","1","","473","482","","","x-ray","0.71073","MoKα","","","0.0331","","","0.07","","","","","","","0.789","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519028","20.036","0.002","20.036","0.002","20.036","0.002","90","","90","","90","","8043.3","1.4","","","295","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Br4 Cl13 H28 Hg O14 Ta6 -","- Br4 Cl13.2 Hg O9.3 Ta6 -","- Br32 Cl105.6 Hg8 O74.4 Ta48 -","8","0.0416667","","Brnicevic, N.; Vojnovic, M.; Antolic, S.; Kojic-Prodic, B.; Desnica-Frankovic, I. D.","Reaction of hexanuclear niobium and tantalum halide clusters with mercury(II) halides. II. Semiconducting compounds with [Ta6Cl12]3+ unit","Solid State Sciences","1999","1","","483","495","","","x-ray","0.71073","MoKα","","","0.048","","","0.051","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1519029","14.697","0.006","14.733","0.005","14.238","0.005","96.6","0.03","109.77","0.03","65.69","0.03","2642.9","1.9","","","207","","","","","","","","","6","P -1","-P 1","2","","","","- C62 H156 Cl4 Cr12 P10 S16 -","- C60 Cl4 Cr12 P10 S16 -","- C60 Cl4 Cr12 P10 S16 -","1","0.5","","Kamiguchi, S.; Imoto, H.; Saito, T.; Chihara, T.","Synthesis, structure, FAB mass spectrum, and magnetic property of a dodecanuclear cluster complex of chromium with hybrido ligands [Cr12S16(H)2(PEt3)10]","Solid State Sciences","1999","1","","497","508","","","x-ray","0.71073","MoKα","","","0.064","","","0.042","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519030","8.339","0.0017","13.259","0.003","56.023","0.011","90","","90","","90","","6194","2","","","293","","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- K12 Se35 Ta6 -","- K12 Se35 Ta6 -","- K48 Se140 Ta24 -","4","0.5","","Tougait, O.; Ibers, J. A.","New tantalum polychalcogenides with infinite anionic chains : K12Ta6Se35 and KTaTe3","Solid State Sciences","1999","1","","523","534","","","x-ray","0.71073","MoKα","","","0.039","","","0.076","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519031","7.7177","0.0015","13.826","0.003","30.981","0.006","90","","90.11","0.03","90","","3305.8","1.2","","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- K Ta Te3 -","- K Ta Te3 -","- K20 Ta20 Te60 -","20","5","","Tougait, O.; Ibers, J. A.","New tantalum polychalcogenides with infinite anionic chains : K12Ta6Se35 and KTaTe3","Solid State Sciences","1999","1","","523","534","","","x-ray","0.71073","MoKα","","","0.061","","","0.13","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519032","6.674","0.002","6.911","0.002","6.402","0.002","90","","103.87","0.01","90","","286.68","0.15","","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Be F4 Yb -","- Be F4 Yb -","- Be4 F16 Yb4 -","4","1","","Kohler, J.","Syntheses and structures of novel complex Yb(II) fluorides : YBeF4, YAlF5 and LiYbAlF6","Solid State Sciences","1999","1","","545","553","","","x-ray","0.71073","MoKα","","","0.0332","","","0.0812","","","","","","","1.226","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519033","13.803","0.003","13.803","0.003","7.013","0.003","90","","90","","90","","1336.1","0.7","","","293","","","","","","","","","3","I 4/m","-I 4","87","","","","- Al F5 Yb -","- Al2 F10.25 Yb2 -","- Al16 F82 Yb16 -","8","0.5","","Kohler, J.","Syntheses and structures of novel complex Yb(II) fluorides : YBeF4, YAlF5 and LiYbAlF6","Solid State Sciences","1999","1","","545","553","","","x-ray","0.71073","MoKα","","","0.0236","","","0.0478","","","","","","","0.949","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519034","5.042","0.002","5.042","0.002","9.868","0.001","90","","90","","120","","217.25","0.12","","","293","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","","","- Al F6 Li Yb -","- Al F6 Li Yb0.5 -","- Al2 F12 Li2 Yb -","2","0.166667","","Kohler, J.","Syntheses and structures of novel complex Yb(II) fluorides : YBeF4, YAlF5 and LiYbAlF6","Solid State Sciences","1999","1","","545","553","","","x-ray","0.71073","MoKα","","","0.022","","","0.0601","","","","","","","1.312","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519035","9.524","0.002","17.98","0.003","8.57","0.003","90","","90","","90","","1467.5","0.6","","","296","","","","","","","","","3","I m a 2","I 2 -2a","46","","","","- Ba Na2 Si4 -","- Ba Na2 Si4 -","- Ba8 Na16 Si32 -","8","1","","Huang, B.; Corbett, J. D.","Synthesis and structure of the Zintl compounds Na2BaTt4 (Tt = Si, Ge)","Solid State Sciences","1999","1","","555","565","","","x-ray","0.71073","MoKα","","","0.027","","","0.028","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519036","7.1057","0.0005","10.142","0.0006","6.5341","0.0005","90","","90","","90","","470.89","0.06","","","298","","","","","","","","","3","I m m m","-I 2 2","71","","","","- Mn Nb3 O6 -","- Mn Nb3 O6 -","- Mn4 Nb12 O24 -","4","0.25","","Hannerz, H.; Svensson, G.; Esmaeilzadeh, S.; Grins, J.","Structure and magnetic susceptibility of MnNb3O6","Solid State Sciences","1999","1","","567","575","","","x-ray","0.71069","MoKα","","","0.0148","","","0.0145","","","","","","","2.15","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519037","9.9304","0.0004","9.9304","0.0004","3.5243","0.0003","90","","90","","90","","347.54","0.04","","","","","","","","","","","","3","I 4/m","-I 4","87","","","","- Nb5 Ni4 P4 -","- Nb5 Ni4 P4 -","- Nb10 Ni8 P8 -","2","0.125","","Charki, F.; Deputier, S.; Benard-Rocherulle, P.; Guerin, R.; Bouayed, M.; Le Beuze, A.; Saillard, J. Y.","An example of the coexistence of octahedral with tetrahedral metal clusters : the ternary phosphide Ni4Nb5P4. Structural and theoretical analyses","Solid State Sciences","1999","1","","607","622","","powder diffraction","x-ray","1.54056","CuKα","","","","","","","","","0.056","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519038","9.2","0.002","9.289","0.003","12.84","0.002","82.71","0.02","84.07","0.02","82.83","0.02","1075.6","0.5","","","293","","","","","","","","","3","P -1","-P 1","2","","","","- Br10 Re6 S4 -","- Br19.62 Re12 S8.38 -","- Br19.62 Re12 S8.38 -","1","0.5","","Perricone, A.; Slougui, A.; Perrin, A.","Rhenium octahedral clusters: the systems Re-S-Br and M-Re-S-Br (M = Na, K, Rb, Cs)","Solid State Sciences","1999","1","","657","666","","","x-ray","0.71073","MoKα","","","0.042","","","0.046","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519039","9.047","0.002","9.228","0.003","13.574","0.005","96.25","0.02","99.24","0.02","116.55","0.01","979.4","0.6","","","293","","","","","","","","","3","P -1","-P 1","2","","","","- Br8 Re6 S5 -","- Br15.66 Re12 S10.34 -","- Br15.66 Re12 S10.34 -","1","0.5","","Perricone, A.; Slougui, A.; Perrin, A.","Rhenium octahedral clusters: the systems Re-S-Br and M-Re-S-Br (M = Na, K, Rb, Cs)","Solid State Sciences","1999","1","","657","666","","","x-ray","0.71073","MoKα","","","0.051","","","0.056","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519066","8.155","0.005","14.948","0.004","20.443","0.003","90","","90","","90","","2492","1.7","","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H30 Cl2 Cu N4 O9 -","- C26 H30 Cl2 Cu N4 O9 -","- C104 H120 Cl8 Cu4 N16 O36 -","4","1","","Bu, Xian-He; Shang, Zhi-Liang; Weng, Wei; Zhang, Ruo-Hua; Zhu, Hong-Ping; Liu, Quin-Tian","Synthesis and Crystal Structure of a New Tetracoordinated Copper(II) Complex of N,N'-Bis(quinolin-8-ylmethyl)-1,5-diazacyclooctane.","Acta Chemica Scandinavica","1999","53","","295","297","","","x-ray","0.71069","MoKα","","","0.071","","","0.0752","","","","","","","","","","","has coordinates","188516","2020-10-21","18:00:00",""
"1519067","10.988","0.003","10.615","0.003","17.472","0.002","90","","91.55","0.01","90","","2037.1","0.8","","","293","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- Cs6 H5 Mo10 O42 P V2 -","- Cs6 Mo9.93 O41 P V2.07 -","- Cs12 Mo19.86 O82 P2 V4.14 -","2","1","","Hashimoto, Masato; Selling, Anna; Hakansson, Mikael; Pettersson, Lage","Multicomponent Polyanions. 52. Crystal Structure of Hexacaesium Monohydrogen Decamolybdo(VI)divanado(IV)phosphate(7‒) Dihydrate.","Acta Chemica Scandinavica","1999","53","","305","313","","","x-ray","0.71069","MoKα","","","0.0487","","","0.1382","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1519068","10.982","0.002","10.614","0.003","17.487","0.003","90","","91.64","0.01","90","","2037.5","0.8","","","293","","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- Cs6 H5 Mo10 O42 P V2 -","- Cs6 Mo10.01 O39 P V1.99 -","- Cs12 Mo20.02 O78 P2 V3.98 -","2","1","","Hashimoto, Masato; Selling, Anna; Hakansson, Mikael; Pettersson, Lage","Multicomponent Polyanions. 52. Crystal Structure of Hexacaesium Monohydrogen Decamolybdo(VI)divanado(IV)phosphate(7‒) Dihydrate.","Acta Chemica Scandinavica","1999","53","","305","313","","","x-ray","0.71069","MoKα","","","0.0485","","","0.1362","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1519069","11.677","0.003","23.536","0.007","12.215","0.003","90","","112.13","0.02","90","","3109.7","1.5","","","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H28 Cl N2 O P2 Rh -","- C35 Cl N2 O P2 Rh -","- C140 Cl4 N8 O4 P8 Rh4 -","4","1","","Laitinen, Riitta H.; Soininen, Jaakko; Suomalainen, Pekka; Pakkanen, Tapani A.; Ahlgren, Markku; Pursiainen, Jouni","Reactions of 3-Pyridyldiphenylphosphine with Rh2(CO)4Cl2 and Co2(CO)8. Crystallographic and Catalytic Studies of Rh(CO)Cl(3-PyPPh2)2.","Acta Chemica Scandinavica","1999","53","","335","339","","","x-ray","0.71069","MoKα","","","0.0405","","","0.0898","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519070","9.037","0.002","11.498","0.002","12.404","0.002","110.09","0.03","109.62","0.03","93.05","0.03","1119.3","0.5","","","299","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H50 Mn N14 O8 -","- C42 Mn N14 O8 -","- C42 Mn N14 O8 -","1","0.5","","Shen, Hao-Yu; Liao, Dai-Zheng; Jiang, Zong-Hui; Yan, Shi-Ping; Wang, Geng-Lin; Yao, Xin-Kan; Wang, Hong-Gen","Crystal Structure of a New Quasi-Two-Dimensional Compound Containing 1,4-Bis(imidazol-1-ylmethyl)benzene (bix) and MnII ions.","Acta Chemica Scandinavica","1999","53","","387","390","","","x-ray","0.71069","MoKα","","","0.072","","","0.0725","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519071","10.1724","0.0006","10.1724","0.0006","9.606","0.0006","90","","90","","90","","994.01","0.1","","","298","","","","","","","","","7","I -4 2 m","I -4 2","121","","","","- C2 H12 Al0.32 Co1.68 N2 O9 P2 -","- C4 Al0.32 Co1.68 N2 O9 P2 -","- C16 Al1.28 Co6.72 N8 O36 P8 -","4","0.25","","Christensen, A. Norlund; Hazell, R. G.","Use of Hydrofluoric Acid as Mineralizer in Hydrothermal and Organothermal Synthesis of Me2±Substituted Aluminophosphates. I.","Acta Chemica Scandinavica","1999","53","","403","409","","","x-ray","0.71069","MoKα","","","0.057","","","0.079","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519072","7.0549","0.0014","11.026","0.002","17.214","0.003","96.59","0.03","90.34","0.03","91.61","0.03","1329.6","0.4","","","120","","","","","","","","","3","P -1","-P 1","2","","","","- C36 H18 N6 -","- C36 N6 -","- C72 N12 -","2","1","","Andresen, Thomas L.; Krebs, Frederik C.; Larsen, Mogens; Thorup, Niels","Crystal Structure of Three Compounds Related to Triphenylene and Tetracyanoquinodimethane","Acta Chemica Scandinavica","1999","53","","410","416","","","x-ray","0.71069","MoKα","","","0.0532","","","0.1262","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519073","12.282","0.002","12.994","0.003","13.702","0.003","70.72","0.03","83.73","0.03","66.06","0.03","1885.7","0.9","","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H26 Cl4 N4 O6 -","- C42 Cl4 N4 O -","- C84 Cl8 N8 O2 -","2","1","","Andresen, Thomas L.; Krebs, Frederik C.; Larsen, Mogens; Thorup, Niels","Crystal Structure of Three Compounds Related to Triphenylene and Tetracyanoquinodimethane","Acta Chemica Scandinavica","1999","53","","410","416","","","x-ray","0.71069","MoKα","","","0.0659","","","0.1761","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519074","13.692","0.003","7.7183","0.0015","16.391","0.003","90","","99.47","0.03","90","","1708.6","0.6","","","120","","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C18 H6 Cl4 N4 -","- C18 Cl4 N4 -","- C72 Cl16 N16 -","4","0.5","","Andresen, Thomas L.; Krebs, Frederik C.; Larsen, Mogens; Thorup, Niels","Crystal Structure of Three Compounds Related to Triphenylene and Tetracyanoquinodimethane","Acta Chemica Scandinavica","1999","53","","410","416","","","x-ray","0.71069","MoKα","","","0.0846","","","0.2285","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519075","15.081","0.003","7.89","0.002","12.427","0.002","90","","90","","90","","1478.7","0.5","","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 Br4 -","- C13 Br4 -","- C52 Br16 -","4","1","","Leiv K. Sydnes; Hans H. Ovrebo; Thoralf Engebretsen","Photochemical reduction of gem-dihalocyclopropanes. III. Debromination of some compounds containing two 1,1-dibromocyclopropane moieties","Acta Chemica Scandinavica","1999","53","","417","424","","","x-ray","0.71069","MoKα","","","0.0579","","","0.1255","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519076","6.451","0.001","12.681","0.003","17.809","0.004","90","","95.82","0.03","90","","1449.4","0.5","","","109","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 Br4 -","- C13 Br4 -","- C52 Br16 -","4","1","","Leiv K. Sydnes; Hans H. Ovrebo; Thoralf Engebretsen","Photochemical reduction of gem-dihalocyclopropanes. III. Debromination of some compounds containing two 1,1-dibromocyclopropane moieties","Acta Chemica Scandinavica","1999","53","","417","424","","","x-ray","0.71069","MoKα","","","0.0443","","","0.1247","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519077","7.102","0.001","13.113","0.002","10.502","0.001","90","","107.18","0.008","90","","934.4","0.2","","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H10 N2 O4 -","","","4","1","","Ole Simonsen; Marie-Louise Hurup Mogelmose; Agnete la Cour","Crystal structures of the reaction product from ethul acetoacetate and hydroxylamine, C8H8N2O3.H2O, Mg(H2O))6(2+)(C8H7N2O2(-))2.4H2O","Acta Chemica Scandinavica","1999","53","","432","435","","","x-ray","1.54178","CuKα","","","0.049","","","0.051","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519078","18.213","0.001","6.8125","0.0003","10.8623","0.0004","90","","101.512","0.004","90","","1320.64","0.11","","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C16 H34 Mg N4 O14 -","","","2","0.25","","Ole Simonsen; Marie-Louise Hurup Mogelmose; Agnete la Cour","Crystal structures of the reaction product from ethul acetoacetate and hydroxylamine, C8H8N2O3.H2O, Mg(H2O))6(2+)(C8H7N2O2(-))2.4H2O","Acta Chemica Scandinavica","1999","53","","432","435","","","x-ray","1.54178","CuKα","","","0.07","","","0.078","","","","","","","","","","","","176729","2020-10-21","18:00:00",""
"1519079","11.328","0.002","12.713","0.003","22.794","0.005","90","","101.42","0.02","90","","3217.6","1.2","","","296","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H24 Cl2 N4 Ni O4 -","","","8","1","","Sanzenbacher, Ralf; Sotofte, Inger; Springborg, Johan","Nickel(II) Complexes with [2(4).3(1)]Adamanzane, 1,4,7,10-Tetraazabicyclo[5.5.3]pentadecane","Acta Chemica Scandinavica","1999","53","","457","464","","","x-ray","0.71069","MoKα","","","0.0671","","","0.1865","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519080","17.064","0.003","16.537","0.003","15.372","0.003","90","","111.77","0.03","90","","4028.4","1.5","","","120","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H32 N4 Ni O10 S2 -","","","8","1","","Sanzenbacher, Ralf; Sotofte, Inger; Springborg, Johan","Nickel(II) Complexes with [2(4).3(1)]Adamanzane, 1,4,7,10-Tetraazabicyclo[5.5.3]pentadecane","Acta Chemica Scandinavica","1999","53","","457","464","","","x-ray","0.71069","MoKα","","","0.0275","","","0.0678","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519081","26.3649","0.0008","8.9488","0.0003","30.7694","0.001","90","","102.328","0.001","90","","7092.2","0.4","","","120","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C11 H24 F6 N5 Ni O2 P -","","","16","2","","Sanzenbacher, Ralf; Sotofte, Inger; Springborg, Johan","Nickel(II) Complexes with [2(4).3(1)]Adamanzane, 1,4,7,10-Tetraazabicyclo[5.5.3]pentadecane","Acta Chemica Scandinavica","1999","53","","457","464","","","x-ray","0.71069","MoKα","","","0.0689","","","0.1222","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519082","14.586","0.003","14.973","0.003","15.218","0.003","90","","90","","90","","3323.6","1.2","","","120","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C11 H24 Cl N5 Ni O7 -","","","8","1","","Sanzenbacher, Ralf; Sotofte, Inger; Springborg, Johan","Nickel(II) Complexes with [2(4).3(1)]Adamanzane, 1,4,7,10-Tetraazabicyclo[5.5.3]pentadecane","Acta Chemica Scandinavica","1999","53","","457","464","","","x-ray","0.71069","MoKα","","","0.0409","","","0.0916","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519083","12.969","0.005","8.3153","0.0009","16.004","0.002","90","","103.36","0.02","90","","1679.2","0.7","","","293","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C14 H12 Cu N2 Na2 O11 -","- C14 Cu N2 Na2 O11 -","- C56 Cu4 N8 Na8 O44 -","4","1","","Sileo, Elsa E.; Rigotti, Graciela; Piro, Oscar E.","Solid-State Coordination Chemistry of Pyridinedicarboxylic Acid Isomers. II. Crystal and Molecular Structure of Sodium Bis(pyridine-2,4-dicarboxylato)cuprate(II) trihydrate.","Acta Chemica Scandinavica","1999","53","","535","541","","","x-ray","0.71069","MoKα","","","0.074","","","0.222","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519084","7.9263","0.0001","10.2442","0.0002","10.3503","0.0002","90","","85.094","0.001","90","","837.35","0.03","","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H7 N O5 -","","","4","1","","Damsgaard, Anders; Hazell, Rita; Bols, Mikael","Synthesis of Hydroxypiperidinecarboxylic Acids from Pyridinedicarboxylates","Acta Chemica Scandinavica","1999","53","","521","527","","","x-ray","0.71069","MoKα","","","0.033","","","0.044","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519085","10.3942","0.0008","9.5586","0.0008","6.3382","0.0005","90","","90","","90","","629.73","0.09","","","293","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C7 H5 N O3 -","","","4","1","","Damsgaard, Anders; Hazell, Rita; Bols, Mikael","Synthesis of Hydroxypiperidinecarboxylic Acids from Pyridinedicarboxylates","Acta Chemica Scandinavica","1999","53","","521","527","","","x-ray","0.71069","MoKα","","","0.027","","","0.046","","","","","","","","","","","","176729","2020-10-21","18:00:00",""
"1519086","10.827","0.005","12.828","0.006","10.889","0.005","90","","118.567","0.009","90","","1328.2","1.1","","","120","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H13 N3 O7 -","","","4","2","","Damsgaard, Anders; Hazell, Rita; Bols, Mikael","Synthesis of Hydroxypiperidinecarboxylic Acids from Pyridinedicarboxylates","Acta Chemica Scandinavica","1999","53","","521","527","","","x-ray","0.71069","MoKα","","","0.077","","","0.09","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519087","25.3676","0.0008","10.1589","0.0009","12.018","0.002","90","","90","","90","","3097.1","0.6","","","120","","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C15 H13 N O5 -","","","8","1","","Damsgaard, Anders; Hazell, Rita; Bols, Mikael","Synthesis of Hydroxypiperidinecarboxylic Acids from Pyridinedicarboxylates","Acta Chemica Scandinavica","1999","53","","521","527","","","x-ray","0.71069","MoKα","","","0.066","","","0.076","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519088","6.1968","0.0003","14.8224","0.0008","12.6841","0.0007","90","","97.803","0.001","90","","1154.27","0.11","","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15.5 H14 N O3.5 -","","","4","1","","Damsgaard, Anders; Hazell, Rita; Bols, Mikael","Synthesis of Hydroxypiperidinecarboxylic Acids from Pyridinedicarboxylates","Acta Chemica Scandinavica","1999","53","","521","527","","","x-ray","0.71069","MoKα","","","0.04","","","0.047","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519089","9.963","0.003","10.485","0.002","11.749","0.002","111.35","0.02","96.18","0.02","95.43","0.02","1124.5","0.5","","","299","","","","","","","","","6","P -1","-P 1","2","","","","- C45 H40 Cu2 Fe N12 O5 -","- C45 Cu2 Fe N12 O5 -","- C45 Cu2 Fe N12 O5 -","1","0.5","","Kou, Hui-Zhong; Gao, En-Qing; Liao, Dai-Zheng; Cheng, Peng; Jiang, Zong-Hui; Yan, Shi-Ping; Wang, Geng-Lin; Yao, Xin-Kan; Wang, Hong-Gen; Tuchagues, J. -P.","A New Copper(II)‒Iron(II) Complex [Cu(acac)(bpy)(py)]2[Fe(CN)5(NO)] Based on Nitroprusside: Synthesis, Structure and Spectroscopic Studies","Acta Chemica Scandinavica","1999","53","","542","546","","","x-ray","0.71069","MoKα","","","0.045","","","0.05","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519090","7.1219","0.0001","8.6926","0.0002","12.8483","0.0003","106.26","0.001","91.328","0.001","113.379","0.001","692.72","0.03","","","298","","","","","","","","","7","P -1","-P 1","2","","","","- C6 H12 F3 N Na2 O8 U -","- C6 H12 F3 N Na2 O8 U -","- C12 H24 F6 N2 Na4 O16 U2 -","2","1","","Aas, Wenche; Johansson, Maria H.","Structure of the Sodium Salt of the Ternary Uranyl‒Picolinate‒Fluoride Complex [UO2(picolinate)F3] Na2(H2O)4.","Acta Chemica Scandinavica","1999","53","","581","583","10.3891/acta.chem.scand.53-0581","","x-ray","0.71069","MoKα","","","0.0414","","","0.103","","","","","","","","","","","has coordinates","189246","2020-10-21","18:00:00",""
"1519160","4.001","0.001","23.852","0.005","19.574","0.004","90","","94.61","0.03","90","","1861.9","0.7","","","295","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C24 H12 N6 -","","","4","1","","Janczak, Jan; Kubiak, Ryszard","Tris(2-cyanophenyl)-1,3,5-triazine: a By-product of Metallophthalocyanine Synthesis","Acta Chemica Scandinavica","1999","53","","602","610","","","x-ray","0.71069","MoKα","","","0.0687","","","0.0924","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519161","11.276","0.002","12.833","0.003","12.915","0.003","99.7","0.03","112.31","0.03","115.53","0.03","1431.4","1","","","295","","","","","","","","","3","P 1","P 1","1","","","","- C24 H12 N6 -","","","3","3","","Janczak, Jan; Kubiak, Ryszard","Tris(2-cyanophenyl)-1,3,5-triazine: a By-product of Metallophthalocyanine Synthesis","Acta Chemica Scandinavica","1999","53","","602","610","","","x-ray","0.71069","MoKα","","","0.0563","","","0.1043","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519162","10.7448","0.0003","13.4992","0.0003","14.8755","0.0004","104.165","0.001","104.284","0.001","105.723","0.001","1897.1","0.09","","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C38 H26 Cu F6 N6 O7 S2 -","- C38 Cu F6 N6 O7 S2 -","- C76 Cu2 F12 N12 O14 S4 -","2","1","","Sletten, Jorunn; Julve, Miguel","Crystal and Molecular Structure of Tris(1,10-phenanthroline)copper(II) Trifluoromethylsulfonate Monohydrate","Acta Chemica Scandinavica","1999","53","","631","633","","","x-ray","0.71069","MoKα","","","0.0497","","","0.1494","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519205","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","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H21 N3 O3 S -","- C14 H21 N3 O3 S -","- C56 H84 N12 O12 S4 -","4","2","","Rossi, S.; Kilburn, J. D.; Hursthouse, Michael B.; Douheret, D.; Coles, Simon J.","t-Butyl-2-(2-(ethoxycarbothioylamino)-3-pyridyloxy)acetate","Crystal Structure Report Archive","1999","","","106","","","","","0.71073","MoKα","","0.0681","0.0522","","","0.1532","0.1652","","","","","","1.192","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519206","15.521","0.003","6.827","0.001","13.574","0.003","90","","100.06","0.03","90","","1416.2","0.5","150","2","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","","Rossi, S.; Kilburn, J. D.; Hursthouse, Michael B.; Douheret, D.; Coles, Simon J.","t-Butyl-2-(3-thioxopyrido(2,1-c)(1,2,4)thiadiazol-8-yloxy)acetate","Crystal Structure Report Archive","1999","","","107","","","","","0.71073","MoKα","","0.0679","0.0393","","","0.1033","0.1218","","","","","","0.807","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519207","7.824","0.002","12.991","0.003","7.62","0.002","90","","104.97","0.03","90","","748.2","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H8 N2 O2 S -","- C6 H8 N2 O2 S -","- C24 H32 N8 O8 S4 -","4","1","","Coles, Simon J.; Hursthouse, Michael B.; Ward, Suzanna C.; Threlfall, Terry L.","4-Amino-benzenesulfonamide","Crystal Structure Report Archive","1999","","","169","","","","","0.71073","mokα","","0.0465","0.0359","","","0.0876","0.0926","","","","","","1.055","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519208","14.6","0.003","5.572","0.001","18.483","0.004","90","","90","","90","","1503.6","0.5","150","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C6 H8 N2 O2 S -","- C6 H8 N2 O2 S -","- C48 H64 N16 O16 S8 -","8","1","","Coles, Simon J.; Hursthouse, Michael B.; Ward, Suzanna C.; Threlfall, Terry L.","4-Amino-benzenesulfonamide","Crystal Structure Report Archive","1999","","","170","","","","","0.71073","MoKα","","0.0426","0.0339","","","0.0892","0.0949","","","","","","1.014","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519209","8.422","0.002","11.734","0.002","14.333","0.003","104.74","0.03","103.07","0.03","99.03","0.03","1299.3","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","Acetoamidobenzenesulfonaminopyrazine","Acetoamidobenzenesulfonaminopyrazine","","- C12 H12 N4 O3 S -","- C12 H11 N4 O3 S -","- C48 H44 N16 O12 S4 -","4","2","","Threlfall, Terry L.; Coles, Simon J.; Ward, Suzanna C; Hursthouse, Michael B.","N-[4-(1,4-Dihydro-pyrazin-2-ylsulfamoyl)-phenyl]-acetamide","Crystal Structure Report Archive","1999","","","171","","","","","0.71073","MoKα","","0.0551","0.0422","","","0.1075","0.1162","","","","","","1.036","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519210","9.643","0.002","11.069","0.002","11.162","0.002","93.35","0.03","102.12","0.03","98.2","0.03","1148.1","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","benzenesulfonamido-5-chloropyridine","Benzenesulfonamido-5-chloropyridine","","- C11 H9 Cl N2 O2 S -","- C11 H9 Cl N2 O2 S -","- C44 H36 Cl4 N8 O8 S4 -","4","2","","Threlfall, Terry L; Coles, Simon J.; Ward, Suzanna C.; Hursthouse, Michael B.","N-(5-Chloro-pyridin-2-yl)-benzenesulfonamide","Crystal Structure Report Archive","1999","","","172","","","","","0.71073","MoKα","","0.0501","0.0366","","","0.0867","0.0933","","","","","","1.054","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519211","8.248","0.0007","10.7247","0.0009","19.0148","0.0018","80.429","0.005","88.947","0.005","71.679","0.005","1573.5","0.2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H19 F3 O3 -","- C16 H19 F3 O3 -","- C64 H76 F12 O12 -","4","2","","Metwally, R. N.; Salem, E. E. -D. M.; El-Sagheer, A. H.; Mellor, J. M.; Coles, Simon J.","(2SR,2'RS)-1,1,1-Trifluoro-2-(2-ethoxy-3,4-dihydro-2H-pyran-5-yl)-3-phenyl-2- propanol","Crystal Structure Report Archive","1999","","","76","","","","","0.71073","MoKα","","0.1592","0.0566","","","0.0892","0.1165","","","","","","0.927","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519212","21.241","0.004","16.179","0.003","10.732","0.002","90","","92.64","0.03","90","","3684.2","1.2","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C19 H18 F6 O4 -","- C19 H18 F6 O4 -","- C152 H144 F48 O32 -","8","1","","Metwally, R. N.; Salem, E. E. -D. M.; El-Sagheer, A. H.; Mellor, J. M.; Coles, Simon J.","2-Benzyl-4',6'-bis(trifluoromethyl)-6'-hydroxy-2',3',7',7a'-tetrahydro-6'H- spiro-(furan-3,7'-(furo(3,2-c)pyran))","Crystal Structure Report Archive","1999","","","77","","","","","0.71073","MoKα","","0.122","0.0499","","","0.1236","0.1579","","","","","","0.86","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519213","12.9524","0.0006","17.6853","0.0008","9.365","0.0004","90","","110.787","0.003","90","","2005.57","0.16","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H21 Fe N3 O3 -","- C23 H21 Fe N3 O3 -","- C92 H84 Fe4 N12 O12 -","4","1","","Tucker, James H. R.; Gelbrich, Thomas; Hursthouse, Michael B.","C23H21FeN3O3","Crystal Structure Report Archive","1999","","","809","","","","","0.71073","MoKα","","0.0995","0.0474","","","0.0941","0.1071","","","","","","0.932","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519214","11.5712","0.0002","17.2776","0.0004","17.8033","0.0003","68.439","0.001","84.588","0.001","76.966","0.001","3224.69","0.11","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C60 H69 La N6 O24 -","- C60 H69 La N6 O24 -","- C120 H138 La2 N12 O48 -","2","1","","Bruce, Duncan W.; Gelbrich, Thomas; Hursthouse, Michael B.","C60H69LaN6O24","Crystal Structure Report Archive","1999","","","810","","","","","0.71073","MoKα","","0.0928","0.0588","","","0.1347","0.1471","","","","","","1.004","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519215","6.05","0.001","7.855","0.002","12.195","0.002","92.78","0.03","103.54","0.03","111.46","0.03","518.6","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","Benzenesulfonamidopyrazine","Benzenesulfonamidopyrazine","","- C10 H9 N3 O2 S -","- C10 H9 N3 O2 S -","- C20 H18 N6 O4 S2 -","2","1","","Threlfall, Terry L; Coles, Simon J.; Ward, Suzanna C.; Hursthouse, Michael B.","N-(1,4-Dihydro-pyrazin-2-yl)-benzenesulfonamide","Crystal Structure Report Archive","1999","","","165","","","","","0.71073","MoKα","","0.0648","0.0433","","","0.0956","0.106","","","","","","1.073","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519216","14.784","0.001","5.67","0.003","18.492","0.004","90","","90","","90","","1550.1","0.9","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C6 H8 N2 O2 S -","- C6 H8 N2 O2 S -","- C48 H64 N16 O16 S8 -","8","1","","Threlfall, Terry L.; Coles, Simon J.; Ward, Suzanna C.; Hursthouse, Michael B.","4-Amino-benzenesulfonamide","Crystal Structure Report Archive","1999","","","166","","","","","0.71073","MoKα","","0.0594","0.0402","","0.118","0.1075","","","","1.064","1.147","1.147","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519217","8.451","0.002","11.797","0.002","14.488","0.003","104.81","0.03","103.71","0.03","98.48","0.03","1322.9","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H12 N4 O3 S -","- C12 H12 N4 O3 S -","- C48 H48 N16 O12 S4 -","4","2","","Threlfall, Terry L.; Coles, Simon J.; Ward, Suzanna C.; Hursthouse, Michael B.","N-[4-(1,4-Dihydro-pyrazin-2-ylsulfamoyl)-phenyl]-acetamide","Crystal Structure Report Archive","1999","","","167","","","","","0.71073","MoKα","","0.0862","0.0471","","","0.1081","0.1255","","","","","","0.97","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519218","8.453","0.002","11.809","0.002","14.541","0.003","104.79","0.03","104.05","0.03","98.4","0.03","1327.5","0.6","320","2","320","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H12 N4 O3 S -","- C12 H12 N4 O3 S -","- C48 H48 N16 O12 S4 -","4","2","","Threlfall, Terry L; Coles, Simon J.; Ward, Suzanna C.; Hursthouse, Michael B.","N-[4-(1,4-Dihhydro-pyrazin-2-ylsulfamoyl]-acetamide","Crystal Structure Report Archive","1999","","","168","","","","","0.71073","MoKα","","0.0954","0.0482","","","0.1049","0.1245","","","","","","0.963","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519219","9.748","0.002","10.889","0.002","12.473","0.002","80.32","0.03","79.02","0.03","74.54","0.03","1243","0.5","150","2","150","2","","","","","","","","6","P -1","-P 1","2","tosylamido-5-chloropyridine","tosylamido-5-chloropyridine","","- C12 H11 Cl N2 O2 S -","- C12 H11 Cl N2 O2 S -","- C48 H44 Cl4 N8 O8 S4 -","4","2","","Threlfall, Terry L.; Coles, Simon J.; Ward, Suzanna C.; Hursthouse, Michael B.","N-(5-Chloro-pyridin-2-yl)-4-methyl-benzenesulfonamide","Crystal Structure Report Archive","1999","","","176","","","","","0.71073","MoKα","","0.0488","0.0368","","","0.0913","0.098","","","","","","1.048","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519220","7.732","0.0004","9.8233","0.0004","56.321","0.002","90","","92.402","0.001","90","","4274","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 N O10 Re -","- C44 H50 N O10 Re -","- C176 H200 N4 O40 Re4 -","4","1","","Bruce, Duncan W.; Light, Mark E.; Hursthouse, Michael B.","C44H50NO10Re","Crystal Structure Report Archive","1999","","","740","","","","","0.71073","MoKα","","0.098","0.0386","","","0.0575","0.0691","","","","","","0.931","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519221","5.3172","0.0014","8.805","0.003","20.641","0.007","90","","91.695","0.017","90","","965.9","0.5","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H12 N O2 -","- C10 H12 N O2 -","- C40 H48 N4 O8 -","4","1","","Jones, Ray; Light, Mark E.; Hursthouse, Michael B.","C10H12NO2","Crystal Structure Report Archive","1999","","","742","","","","","0.71073","MoKα","","0.21","0.0653","","","0.1411","0.2012","","","","","","0.907","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519222","14.0554","0.0004","14.0554","0.0004","9.5929","0.0001","90","","90","","90","","1895.12","0.08","150","2","150","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C12 H28 Cl2 Co N2 O4 -","- C12 H30 Cl2 Co N2 O4 -","- C48 H120 Cl8 Co4 N8 O16 -","4","0.5","","Kelly, Dave G.; Gelbrich, Thomas; Hursthouse, Michael B.","C12H28Cl2CoN2O4","Crystal Structure Report Archive","1999","","","808","","","","","0.71073","MoKα","","0.0352","0.0239","","","0.0577","0.061","","","","","","1.043","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519223","11.352","0.002","12.894","0.003","17.223","0.003","68.61","0.03","83.13","0.03","80.13","0.03","2308.1","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H52 F6 N2 O11 -","- C48 H52 F6 N2 O10.6 -","- C96 H104 F12 N4 O21.2 -","2","1","","Hursthouse, Michael B.; Coles, Simon J.; Desvergne, J. -P.; Bouas-Laurent, H.; Tucker, J. H. R.; McSkimming, G.; Light, Mark E.","4,13-bis(2-(9-Anthryloxy)ethyl)-4,13-diazonia-[18]crown-6 bis(trifluoroacetate) monohydrate","Crystal Structure Report Archive","1999","","","92","","","","","0.71073","MoKα","","0.0884","0.0595","","","0.1684","0.1843","","","","","","1.246","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519224","10.102","0.002","20.609","0.004","18.706","0.004","90","","103.59","0.03","90","","3785.4","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H37 Bi O6 -","- C46 H37 Bi O6 -","- C184 H148 Bi4 O24 -","4","1","","Hursthouse, Michael B.; Gelbrich, Thomas; Costello, J. F.; Coles, Simon J.; Barucki, H.","bis(2-Hydroxy-2,2-diphenylacetato)-triphenyl-bismuth","Crystal Structure Report Archive","1999","","","95","","","","","0.71073","MoKα","","0.0319","0.0267","","","0.0794","0.0878","","","","","","0.751","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519225","11.345","0.002","8.087","0.002","12.444","0.002","90","","95.23","0.02","90","","1136.9","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H30 O7 -","- C25 H30 O7 -","- C50 H60 O14 -","2","1","","Ward, Robert S.; Coles, Simon J.; Hursthouse, Michael B.","C25H30O7","Crystal Structure Report Archive","1999","","","1045","","","","","0.71073","MoKα","","0.0535","0.0364","","","0.0972","0.1165","","","","","","0.846","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519226","11.754","0.002","13.88","0.003","7.205","0.001","90","","107.18","0.03","90","","1123","0.4","150","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Benzenesulfonamido-5-methylpyridine","Benzenrsulfonamido-5-methylpyridine","","- C12 H12 N2 O2 S -","- C12 H12 N2 O2 S -","- C48 H48 N8 O8 S4 -","4","1","","Coles, Simon J.; Hursthouse, Michael B.; Ward, Suzanna C.; Threlfall, Terry L.","N-(5-Methyl-pyridin-2-yl)-benzenesulfonamide","Crystal Structure Report Archive","1999","","","163","","","","","0.71073","MoKα","","0.0527","0.0396","","","0.1011","0.108","","","","","","1.075","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519227","7.879","0.002","9.393","0.002","10.085","0.002","90.01","0.03","108.24","0.03","103.77","0.03","686.2","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","p-acetoamidobenzenesulfonamido-5-chloropyridine","p-acetoamidobenzenesulfonamido-5-chloropyridine","","- C13 H12 Cl N3 O3 S -","- C13 H12 Cl N3 O3 S -","- C26 H24 Cl2 N6 O6 S2 -","2","1","","Threlfall, Terry L.; Coles, Simon J.; Ward, Suzanna C.; Hursthouse, Michael B.","p-acetoamidobenzenesulfonamide-5-chloropyridine","Crystal Structure Report Archive","1999","","","164","","","","","0.71073","MoKα","","0.034","0.0313","","","0.0782","0.0806","","","","","","1.111","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519228","14.784","0.001","5.67","0.003","18.492","0.004","90","","90","","90","","1550.1","0.9","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C6 H8 N2 O2 S -","- C6 H8 N2 O2 S -","- C48 H64 N16 O16 S8 -","8","1","","Coles, Simon J.; Hursthouse, Michael B.; Ward, Suzanna C.; Threlfall, Terry L.","4-Amino-benzenesulfonamide","Crystal Structure Report Archive","1999","","","173","","","","","0.71073","MoKα","","0.0594","0.0402","","0.118","0.1075","","","","1.064","1.147","1.147","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519229","9.933","0.002","11.528","0.002","12.703","0.003","115.74","0.03","100.11","0.03","95.54","0.03","1265.2","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","p-aminobenzenesulfonamido-5-bromopyridine","p-aminobenzenesulfonamido-5-bromopyridine","","- C11 H10 Br N3 O2 S -","- C11 H10 Br N3 O2 S -","- C44 H40 Br4 N12 O8 S4 -","4","2","","Threlfall, Terry L.; Coles, Simon J.; Hursthouse, Michael B.; Ward, Suzanna C.","p-aminobenzenesulfonamide-5-bromopyridine","Crystal Structure Report Archive","1999","","","174","","","","","0.71073","MoKα","","0.0665","0.0416","","","0.0935","0.105","","","","","","1.033","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519230","12.476","0.002","14.045","0.003","15.134","0.003","90","","109.33","0.03","90","","2502.4","1","150","2","150","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","p-aminobenzenesulfonamido-5-chloropyridine","p-aminobenzenesulfonamido-5-chloropyridine","","- C11 H10 Cl N3 O2 S -","- C11 H10 Cl N3 O2 S -","- C88 H80 Cl8 N24 O16 S8 -","8","2","","Threlfall, Terry L.; Coles, Simon J.; Ward, Suzanna C.; Hursthouse, Michael B.","p-aminobenzenesulfonamide-5-chloropyridine","Crystal Structure Report Archive","1999","","","175","","","","","0.71073","MoKα","","0.082","0.0598","","","0.164","0.177","","","","","","1.11","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519231","13.1462","0.0003","14.358","0.0002","19.1176","0.0004","89.332","0.001","81.509","0.001","84.008","0.001","3549.43","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H27 Co3 O9 P2 -","- C36 H27 Co3 O9 P2 -","- C144 H108 Co12 O36 P8 -","4","2","","Morley, Christopher P.; Light, Mark E.; Hursthouse, Michael B.","C72H54Co6O18P4","Crystal Structure Report Archive","1999","","","729","","","","","0.71073","MoKα","","0.0734","0.0409","","","0.093","0.1058","","","","","","0.979","","","","has coordinates","188564","2020-10-21","18:00:00",""
"1519232","9.2535","0.0003","13.1779","0.0004","9.6444","0.0002","90","","113.149","0.001","90","","1081.37","0.05","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H30 O7 -","- C25 H30 O7 -","- C50 H60 O14 -","2","1","","Ward, Robert S.; Light, Mark E.; Hursthouse, Michael B.","C25H30O7","Crystal Structure Report Archive","1999","","","741","","","","","0.71073","MoKα","","0.0445","0.0369","","","0.0817","0.0855","","","","","","1.039","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519233","13.189","0.003","9.3","0.002","16.258","0.003","90","","102.79","0.03","90","","1944.7","0.7","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H26 N2 O3 -","- C23 H26 N2 O3 -","- C92 H104 N8 O12 -","4","1","","Heron, Mark; Gelbrich, Thomas; Hursthouse, Michael B.","C23H26N2O3","Crystal Structure Report Archive","1999","","","805","","","","","0.71073","MoKα","","0.0913","0.0491","","","0.1124","0.1324","","","","","","0.961","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519234","3.8247","0.0002","7.8279","0.0004","17.0839","0.001","99.951","0.003","95.698","0.003","94.805","0.004","498.63","0.05","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H4 N2 S2 -","- C12 H4 N2 S2 -","- C24 H8 N4 S4 -","2","1","","Murphy, Patrick J.; Gelbrich, Thomas; Hursthouse, Michael B.","C12H4N2S2","Crystal Structure Report Archive","1999","","","806","","","","","0.71073","MoKα","","0.0609","0.0399","","","0.0911","0.0979","","","","","","1.054","","","","has coordinates","301776","2025-08-18","14:47:54",""
"1519235","10.082","0.002","20.406","0.004","18.756","0.004","90","","103.87","0.03","90","","3746.2","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C46 H37 O6 Sb -","- C46 H37 O6 Sb -","- C184 H148 O24 Sb4 -","4","1","","Hursthouse, Michael B.; Gelbrich, Thomas; Costello, J. F.; Coles, Simon J.; Barucki, H.","bis(2-Hydroxy-2,2-diphenylacetato)-triphenyl-antimony","Crystal Structure Report Archive","1999","","","94","","","","","0.71073","MoKα","","0.0474","0.0348","","","0.0959","0.1072","","","","","","0.796","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1519648","7.642","0.002","17.527","0.003","8.372","0.002","90","","102.51","0.02","90","","1094.7","0.4","","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H18 Cu N8 S2 -","- C11 Cu0.5 N4 S -","- C44 Cu2 N16 S4 -","4","1","","Mesa, Jose L.; Urtiaga, Karmele; Lezama, Luis; Arriortua, Maria I.","Crystal Structure and Spectroscopic Properties of the Bis[(S-thiocyanate) (2,2'-dipyridylamine)] Copper(II) Complex","Acta Chemica Scandinavica","1999","53","","634","638","","","x-ray","0.7107","MoKα","","","0.037","","","0.096","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519681","13.574","0.004","8.584","0.003","5.429","0.002","90","","90","","90","","632.6","0.4","","","160","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H16 N2 O6 -","- C12 N2 O6 -","- C24 N4 O12 -","2","0.5","","Tanner, David; Railton, Craig J.; Pettersson, Ingrid; Sotofte, Inger","Synthesis, Structure and Reactivity of an Evans-type Bis(imide) Derived from a C2-Symmetric Bis(oxazolidinone). A Reluctant Chiral Auxiliary.","Acta Chemica Scandinavica","1999","53","","703","709","","","x-ray","0.71073","MoKα","","","0.0466","","","0.0977","","","","","","","","","","","has coordinates","136657","2020-10-21","18:00:00",""
"1519682","9.825","0.007","13.257","0.01","18.114","0.014","90","","90","","90","","2359","3","","","297","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C14 H30 B18 Ni -","- C15 B17 Ni -","- C60 B68 Ni4 -","4","0.5","","Schubert, David M.; Harwell, David E.; Knobler, Carolyn B.; Hawthorne, M. Frederick","Structural Characterization of Charge Transfer Complexes of the Nickel(IV) Bis(3,1,2-dicarbollyl) Sandwich Compound","Acta Chemica Scandinavica","1999","53","","721","730","","","x-ray","1.5418","CuKα","","","0.077","","","0.09","","","","","","","","","","","has coordinates","136666","2020-10-21","18:00:00",""
"1519683","6.967","0.001","14.804","0.002","26.2","0.004","90","","90","","90","","2702.3","0.7","","","298","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H32 B18 Ni -","- C20 B18 Ni -","- C80 B72 Ni4 -","4","1","","Schubert, David M.; Harwell, David E.; Knobler, Carolyn B.; Hawthorne, M. Frederick","Structural Characterization of Charge Transfer Complexes of the Nickel(IV) Bis(3,1,2-dicarbollyl) Sandwich Compound","Acta Chemica Scandinavica","1999","53","","721","730","","","x-ray","0.7107","MoKα","","","0.075","","","0.094","","","","","","","","","","","has coordinates","136667","2020-10-21","18:00:00",""
"1519684","9.476","0.002","13.16","0.002","18.389","0.004","90","","90","","90","","2293.2","0.8","","","128","","","","","","","","","5","P n 21 a","P -2ac -2n","33","","","","- C12 H33 B18 N Ni -","- C12 B18 N Ni -","- C48 B72 N4 Ni4 -","4","1","","Schubert, David M.; Harwell, David E.; Knobler, Carolyn B.; Hawthorne, M. Frederick","Structural Characterization of Charge Transfer Complexes of the Nickel(IV) Bis(3,1,2-dicarbollyl) Sandwich Compound","Acta Chemica Scandinavica","1999","53","","721","730","","","x-ray","1.5418","CuKα","","","0.055","","","0.07","","","","","","","","","","","has coordinates","136668","2020-10-21","18:00:00",""
"1519933","7.107","0.005","12.527","0.005","30.468","0.011","90","","90","","90","","2713","2","","","290","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H18 N2 O2 -","","","8","2","","Utley, James H. P.; Elinson, Mikhail; Gullu, Mustafa; Ludwig, Ralf; Motevalli, Majid","Electro-organic Reactions. Part 49. The Synthesis and Stereoselective Electrochemical Hydroxylation of 2,3-Dihydro-4H-furo[2,3-d]pyrido[1,2- a]pyrimidin-4-ones","Acta Chemica Scandinavica","1999","53","","901","909","","","x-ray","0.71069","MoKα","","","0.0945","","","0.2423","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1519939","8.517","0.002","11.667","0.002","24.376","0.005","90","","91.05","0.03","90","","2421.8","0.9","","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H36 Cl2 N2 Si4 Te -","- C12 Cl2 N2 Si4 Te -","- C48 Cl8 N8 Si16 Te4 -","4","1","","Pietikainen, Jarkko; Laitinen, Risto S.; Valkonen, Jussi","Preparation and Crystal Structure of [(Me3Si)2N]2TeCl2.","Acta Chemica Scandinavica","1999","53","","963","967","","","x-ray","0.71069","MoKα","","","0.0493","","","0.0917","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1519940","8.624","0.002","12.71","0.003","10.868","0.002","90","","92.89","0.03","90","","1189.7","0.5","","","193","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C26 H36 N2 -","","","2","0.5","","Laine, Timo V.; Klinga, Martti; Maaninen, Arto; Aitola, Erkki; Leskela, Markku","Effect of Metal on the Ethylene Polymerization Behavior of a Diimine-Based Homogeneous Late Transition Metal Catalyst System","Acta Chemica Scandinavica","1999","53","","968","973","","","x-ray","0.71069","MoKα","","","0.0613","","","0.1413","","","","","","","","","","","","176428","2020-10-21","18:00:00",""
"1519941","20.864","0.006","6.882","0.004","19.89","0.006","90","","106.77","0.04","90","","2734","2","","","193","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H36 Br2 Co N2 -","","","4","0.5","","Laine, Timo V.; Klinga, Martti; Maaninen, Arto; Aitola, Erkki; Leskela, Markku","Effect of Metal on the Ethylene Polymerization Behavior of a Diimine-Based Homogeneous Late Transition Metal Catalyst System","Acta Chemica Scandinavica","1999","53","","968","973","","","x-ray","0.71069","MoKα","","","0.0793","","","0.1892","","","","","","","","","","","","176428","2020-10-21","18:00:00",""
"1520548","11.434","0.002","9.617","0.002","18.981","0.004","90","","100","0.03","90","","2055.5","0.7","","","120","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H63 Cl8 N8 O1.5 Zn2 -","- C28 Cl8 N8 O2 Zn2 -","- C56 Cl16 N16 O4 Zn4 -","2","0.5","","Springborg, Johan; Nielsen, Bente; Olsen, Carl Erik; Sotofte, Inger","Synthesis of [3(2)]Bis([2(4).3(1)]adamanzane), 1,4,8,11,15,18,22,25-Octaazapentacyclo[20.6.2.2(4,25).2(8,15).2(11,18)] hexatriacontane, and Crystal Structure of the Tetrachlorozincate Salt of the Tetraprotonated Octaamine","Acta Chemica Scandinavica","1999","53","","985","991","10.3891/acta.chem.scand.53-0985","","x-ray","0.71069","MoKα","","","0.0376","","","0.0813","","","","","","","1.076","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520549","8.354","0.002","11.683","0.003","17.753","0.004","90","","99.52","0.03","90","","1708.8","0.7","","","263","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H28 Br10 N2 Te2 -","- C18 Br10 N2 Te2 -","- C36 Br20 N4 Te4 -","2","0.5","","Hauge, Sverre; Janickis, Vitalijus; Maroy, Kjartan","Reaction of TeBr4 with SbBr3 in the Presence of [C6H5(CH3)3N]Br: Crystal Structures of [C6H5(CH3)3N]2[Te2Br10] and [C6H5(CH3)3N][SbTeOBr6]","Acta Chemica Scandinavica","1999","53","","992","996","10.3891/acta.chem.scand.53-0992","","x-ray","0.71069","MoKα","","","0.074","","","0.1725","","","","","","","0.946","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520550","7.689","0.002","12.672","0.003","10.459","0.002","90","","99.81","0.03","90","","1004.2","0.4","","","263","","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C9 H14 Br6 N O Sb Te -","- C9 Br6 N O Sb Te -","- C18 Br12 N2 O2 Sb2 Te2 -","2","0.5","","Hauge, Sverre; Janickis, Vitalijus; Maroy, Kjartan","Reaction of TeBr4 with SbBr3 in the Presence of [C6H5(CH3)3N]Br: Crystal Structures of [C6H5(CH3)3N]2[Te2Br10] and [C6H5(CH3)3N][SbTeOBr6]","Acta Chemica Scandinavica","1999","53","","992","996","10.3891/acta.chem.scand.53-0992","","x-ray","0.71069","MoKα","","","0.0756","","","0.141","","","","","","","1.074","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520551","7.281","0.001","7.606","0.001","10.436","0.002","95.68","0.02","105.21","0.02","112.57","0.02","501.89","0.18","","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C4 H16 F4 Na4 O16 U2 -","- C4 H16 F4 Na4 O16 U2 -","- C4 H16 F4 Na4 O16 U2 -","1","0.5","","Farkas, Ildiko; Csoregh, Ingeborg; Szabo, Zoltan","Crystal Structure of the Sodium Salt of the Uranyl-Oxyacetate-Fluoride Dimer, Na4(UO2)2(OCH2COO)2F4.6H2O.","Acta Chemica Scandinavica","1999","53","","1009","1012","10.3891/acta.chem.scand.53-1009","","x-ray","0.71069","MoKα","","","0.027","","","0.068","","","","","","","1.072","","","","has coordinates","189246","2020-10-21","18:00:00",""
"1520567","6.602","0.002","9.205","0.002","21.832","0.006","90","","90","","90","","1326.8","0.6","","","223","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H21 N O4 -","","","4","1","","Reufer, Christian; Zielinski, Claudia; Schafer, Hans Jurgen; Frolich, Roland","Electro-organic Synthesis 68. Diastereoselective Cathodic Reduction of Phenylglyoxylic Acid Attached to Chiral Auxiliaries","Acta Chemica Scandinavica","1999","53","","1023","1037","10.3891/acta.chem.scand.53-1023","","x-ray","1.54178","CuKα","","","0.053","","","0.115","","","","","","","","","","","","175419","2020-10-21","18:00:00",""
"1520568","12.654","0.002","12.654","0.002","6.786","0.001","90","","90","","120","","941","0.3","","","223","","","","","","","","","4","P 32","P 32","145","","","","- C12 H15 N O5 -","","","3","1","","Reufer, Christian; Zielinski, Claudia; Schafer, Hans Jurgen; Frolich, Roland","Electro-organic Synthesis 68. Diastereoselective Cathodic Reduction of Phenylglyoxylic Acid Attached to Chiral Auxiliaries","Acta Chemica Scandinavica","1999","53","","1023","1037","10.3891/acta.chem.scand.53-1023","","x-ray","1.54178","CuKα","","","0.058","","","0.179","","","","","","","","","","","","175419","2020-10-21","18:00:00",""
"1520569","12.701","0.003","12.701","0.003","6.811","0.002","90","","90","","120","","951.5","0.4","","","223","","","","","","","","","5","P 32","P 32","145","","","","- C12 H15 N O4 S -","","","3","1","","Reufer, Christian; Zielinski, Claudia; Schafer, Hans Jurgen; Frolich, Roland","Electro-organic Synthesis 68. Diastereoselective Cathodic Reduction of Phenylglyoxylic Acid Attached to Chiral Auxiliaries","Acta Chemica Scandinavica","1999","53","","1023","1037","10.3891/acta.chem.scand.53-1023","","x-ray","1.54178","CuKα","","","0.03","","","0.08","","","","","","","","","","","","175419","2020-10-21","18:00:00",""
"1520570","7.269","0.001","10.484","0.001","8.094","0.001","90","","99.41","0.01","90","","608.53","0.13","","","198","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C11 H19 N O4 -","","","2","1","","Reufer, Christian; Zielinski, Claudia; Schafer, Hans Jurgen; Frolich, Roland","Electro-organic Synthesis 68. Diastereoselective Cathodic Reduction of Phenylglyoxylic Acid Attached to Chiral Auxiliaries","Acta Chemica Scandinavica","1999","53","","1023","1037","10.3891/acta.chem.scand.53-1023","","x-ray","0.71073","MoKα","","","0.035","","","0.091","","","","","","","","","","","","176428","2020-10-21","18:00:00",""
"1520571","14.318","0.004","22.854","0.004","15.212","0.003","90","","108.42","0.02","90","","4722.7","1.9","","","122","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C27.5 H24 Cl N2 O0.5 Pt -","- C27.5 Cl N2 O0.5 Pt -","- C220 Cl8 N16 O4 Pt8 -","8","1","","Grondahl, Lisbeth; Josephsen, Jens; Bruun, Rikke Mattsson; Larsen, Sine","Platinum(II) Benzophenone Imine Complexes and the Crystal Structure of trans-(N,N)-(Benzophenone imine)chloro- [2-(1-imino-1-phenylmethyl)phenylido]platinum(II)‒Acetone (2/1)","Acta Chemica Scandinavica","1999","53","","1069","1077","10.3891/acta.chem.scand.53-1069","","x-ray","0.71069","MoKα","","","0.0372","","","0.0718","","","","","","","1.669","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520603","8.715","0.0008","11.0476","0.0007","10.9625","0.0007","90","","102.698","0.006","90","","1029.65","0.13","","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H14 Mo O6 -","","","4","1","","Lehtonen, Ari; Sillanpaa, Reijo","Dioxomolybdenum(VI) Complexes of Chelating Alkoxides","Acta Chemica Scandinavica","1999","53","","1078","1082","10.3891/acta.chem.scand.53-1078","","x-ray","0.71069","MoKα","","","0.02","","","0.05","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1520604","18.676","0.002","6.9445","0.0013","11.4529","0.0015","90","","90","","90","","1485.4","0.4","","","293","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C12 H22 Mo O6 -","","","4","1","","Lehtonen, Ari; Sillanpaa, Reijo","Dioxomolybdenum(VI) Complexes of Chelating Alkoxides","Acta Chemica Scandinavica","1999","53","","1078","1082","10.3891/acta.chem.scand.53-1078","","x-ray","0.71069","MoKα","","","0.03","","","0.065","","","","","","","","","","","","176429","2020-10-21","18:00:00",""
"1520605","22.958","0.007","16.139","0.004","10.672","0.005","90","","90","","90","","3954","2","","","293","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H32 Mo O6 -","","","8","1","","Lehtonen, Ari; Sillanpaa, Reijo","Dioxomolybdenum(VI) Complexes of Chelating Alkoxides","Acta Chemica Scandinavica","1999","53","","1078","1082","10.3891/acta.chem.scand.53-1078","","x-ray","0.71069","MoKα","","","0.042","","","0.075","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1520606","7.956","0.003","15.557","0.004","13.901","0.003","90","","98.03","0.02","90","","1703.7","0.9","","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H28 Mo O6 -","","","4","1","","Lehtonen, Ari; Sillanpaa, Reijo","Dioxomolybdenum(VI) Complexes of Chelating Alkoxides","Acta Chemica Scandinavica","1999","53","","1078","1082","10.3891/acta.chem.scand.53-1078","","x-ray","0.71069","MoKα","","","0.028","","","0.062","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1520607","12.414","0.003","10.74","0.002","13.682","0.003","75.05","0.01","109.38","0.01","109.6","0.01","1598.9","0.6","","","294","","","","","","","","","6","P -1","-P 1","2","","","","- C28 H33 Cl2 Cr N6 O11 -","- C28 Cl2 Cr N6 O11 -","- C56 Cl4 Cr2 N12 O22 -","2","1","","Eriksen, J.; Goodson, P.; Hazell, A.; Hodgson, D. J.; Michelsen, K.; Monsted, O.; Rasmussen, J. C.; Toftlund, H.","Chromium(III) Complexes of the Hexadentate Ligand N,N,N',N'- Tetrakis(2-pyridylmethyl)ethane-1,2-diamine. Synthesis, Structure and Reactivity","Acta Chemica Scandinavica","1999","53","","1083","1092","10.3891/acta.chem.scand.53-1083","","x-ray","0.71069","MoKα","","","0.037","","","0.051","","","","","","","1.24","","","","has coordinates","139402","2020-10-21","18:00:00",""
"1520608","9.78","0.002","18.702","0.004","18.323","0.004","90","","93.78","0.03","90","","3344.1","1.2","","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H28 Cl3 Cr N6 O12 -","- C26 Cl3 Cr N6 O12 -","- C104 Cl12 Cr4 N24 O48 -","4","1","","Eriksen, J.; Goodson, P.; Hazell, A.; Hodgson, D. J.; Michelsen, K.; Monsted, O.; Rasmussen, J. C.; Toftlund, H.","Chromium(III) Complexes of the Hexadentate Ligand N,N,N',N'- Tetrakis(2-pyridylmethyl)ethane-1,2-diamine. Synthesis, Structure and Reactivity","Acta Chemica Scandinavica","1999","53","","1083","1092","10.3891/acta.chem.scand.53-1083","","x-ray","0.71069","MoKα","","","0.069","","","0.1","","","","","","","1.24","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520609","9.457","0.002","10.646","0.002","14.545","0.003","93.22","0.03","94.6","0.03","99.87","0.03","1434.4","0.5","","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H29 Cl2 Cr N6 O9 -","- C26 Cl2 Cr N6 O8.982 -","- C52 Cl4 Cr2 N12 O17.964 -","2","1","","Eriksen, J.; Goodson, P.; Hazell, A.; Hodgson, D. J.; Michelsen, K.; Monsted, O.; Rasmussen, J. C.; Toftlund, H.","Chromium(III) Complexes of the Hexadentate Ligand N,N,N',N'- Tetrakis(2-pyridylmethyl)ethane-1,2-diamine. Synthesis, Structure and Reactivity","Acta Chemica Scandinavica","1999","53","","1083","1092","10.3891/acta.chem.scand.53-1083","","x-ray","0.71069","MoKα","","","0.05","","","0.102","","","","","","","1.171","","","","has coordinates","139404","2020-10-21","18:00:00",""
"1520610","9.6166","0.0004","16.119","0.001","19.445","0.001","90","","90","","90","","3014.2","0.3","","","298","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H36 Cl Cr N6 O9 -","- C26 Cl Cr N6 O9 -","- C104 Cl4 Cr4 N24 O36 -","4","1","","Eriksen, J.; Goodson, P.; Hazell, A.; Hodgson, D. J.; Michelsen, K.; Monsted, O.; Rasmussen, J. C.; Toftlund, H.","Chromium(III) Complexes of the Hexadentate Ligand N,N,N',N'- Tetrakis(2-pyridylmethyl)ethane-1,2-diamine. Synthesis, Structure and Reactivity","Acta Chemica Scandinavica","1999","53","","1083","1092","10.3891/acta.chem.scand.53-1083","","x-ray","0.71069","MoKα","","","0.034","","","0.04","","","","","","","2.077","","","","has coordinates","139405","2020-10-21","18:00:00",""
"1520632","10.184","0.002","17.559","0.004","9.161","0.004","90.68","0.03","112.57","0.03","87.78","0.02","1511.6","0.9","","","122","","","","","","","","","6","P -1","-P 1","2","","","","- C16 H44.4 N6 O13.2 Re3 Rh -","- C16 N6 O13.2 Re3 Rh -","- C32 N12 O26.4 Re6 Rh2 -","2","1","","Andersen, Peter; Galsbol, Frode; Jensen, Anette Frost; Matsui, Hayato; Monsted, Lene; Simonsen, Kim","Mononuclear Rhodium(III) Complexes with N,N',N""-Trimethyl-1,1,1- tris(aminomethyl)ethane (Me3-tame). Preparations, Characterization and Configurational Isomerization. Crystal Structure of meso-[Rh(Me3-tame)2](ReO4)3.1.2H2O.","Acta Chemica Scandinavica","1999","53","","1093","1102","10.3891/acta.chem.scand.53-1093","","x-ray","0.71073","MoKα","","","0.0386","","","0.0982","","","","","","","1.2","","","","has coordinates","139504","2020-10-21","18:00:00",""
"1520641","4.6986","0.0008","5.7293","0.0008","4.9367","0.0011","90","","90.615","0.025","90","","132.89","0.04","","","293","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- O4 W Zn -","- O4 W Zn -","- O8 W2 Zn2 -","2","0.5","","Dahlborg, Magnus Asberg; Svensson, Goran","Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data.","Acta Chemica Scandinavica","1999","53","","1103","1109","10.3891/acta.chem.scand.53-1103","","x-ray","0.71069","MoKα","","","0.0293","","","0.0706","","","","","","","1.126","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520642","4.7472","0.0007","5.767","0.0006","4.9629","0.0006","90","","90.862","0.013","90","","135.85","0.03","","","293","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cd0.11 O4 W Zn0.89 -","- Cd0.11 O4 W Zn0.89 -","- Cd0.22 O8 W2 Zn1.78 -","2","0.5","","Dahlborg, Magnus Asberg; Svensson, Goran","Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data.","Acta Chemica Scandinavica","1999","53","","1103","1109","10.3891/acta.chem.scand.53-1103","","x-ray","0.71069","MoKα","","","0.0369","","","0.0816","","","","","","","1.157","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520643","4.9192","0.0011","5.843","0.0015","5.0301","0.0022","90","","91.505","0.023","90","","144.53","0.08","","","293","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cd0.6 O4 W Zn0.4 -","- Cd0.6 O4 W Zn0.4 -","- Cd1.2 O8 W2 Zn0.8 -","2","0.5","","Dahlborg, Magnus Asberg; Svensson, Goran","Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data.","Acta Chemica Scandinavica","1999","53","","1103","1109","10.3891/acta.chem.scand.53-1103","","x-ray","0.71069","MoKα","","","0.036","","","0.0995","","","","","","","1.212","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520644","5.0053","0.0013","5.8615","0.0007","5.0664","0.0007","90","","91.467","0.021","90","","148.59","0.05","","","293","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- Cd0.884 O4 W Zn0.116 -","- Cd0.884 O4 W Zn0.116 -","- Cd1.768 O8 W2 Zn0.232 -","2","0.5","","Dahlborg, Magnus Asberg; Svensson, Goran","Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data.","Acta Chemica Scandinavica","1999","53","","1103","1109","10.3891/acta.chem.scand.53-1103","","x-ray","0.71069","MoKα","","","0.0276","","","0.0676","","","","","","","1.068","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520645","5.04","0.0008","5.8701","0.0006","5.0841","0.0007","90","","91.476","0.019","90","","150.36","0.04","","","293","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- Cd O4 W -","- Cd O4 W -","- Cd2 O8 W2 -","2","0.5","","Dahlborg, Magnus Asberg; Svensson, Goran","Structural Changes in the System Zn(1-x)Cd(x)WO4, Determined from Single Crystal Data.","Acta Chemica Scandinavica","1999","53","","1103","1109","10.3891/acta.chem.scand.53-1103","","x-ray","0.71069","MoKα","","","0.0254","","","0.0657","","","","","","","1.065","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520646","11.0967","0.0005","16.8755","0.0008","12.4165","0.0006","90","","99.078","0.001","90","","2296.02","0.19","","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 O2 S3 -","","","4","1","","Hegab, Mohamed I.; Abdel-Megeid, Farouk M. E.; Gad, Farouk A.; Shiba, Sayed A.; Sotofte, Inger; Moller, Jorgen; Senning, Alexander","New Reactions with Thiosulfines/Dithiiranes: Cycloadditions Leading to Dispiro Derivatives of 1,2,4-Trithiolane.","Acta Chemica Scandinavica","1999","53","","133","140","10.3891/acta.chem.scand.53-0133","","x-ray","0.71069","MoKα","","","0.081","","","0.1863","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1520647","10.191","0.0004","36.5703","0.0014","12.7772","0.0005","90","","90.43","0.002","90","","4761.8","0.3","","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 O2 S3 -","","","8","2","","Hegab, Mohamed I.; Abdel-Megeid, Farouk M. E.; Gad, Farouk A.; Shiba, Sayed A.; Sotofte, Inger; Moller, Jorgen; Senning, Alexander","New Reactions with Thiosulfines/Dithiiranes: Cycloadditions Leading to Dispiro Derivatives of 1,2,4-Trithiolane.","Acta Chemica Scandinavica","1999","53","","133","140","10.3891/acta.chem.scand.53-0133","","x-ray","0.71069","MoKα","","","0.1192","","","0.2545","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1520648","18.8658","0.0002","11.1475","0.0002","12.1351","0.0002","90","","92.088","0.001","90","","2550.4","0.07","","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H32 O2 S3 -","","","4","1","","Hegab, Mohamed I.; Abdel-Megeid, Farouk M. E.; Gad, Farouk A.; Shiba, Sayed A.; Sotofte, Inger; Moller, Jorgen; Senning, Alexander","New Reactions with Thiosulfines/Dithiiranes: Cycloadditions Leading to Dispiro Derivatives of 1,2,4-Trithiolane.","Acta Chemica Scandinavica","1999","53","","133","140","10.3891/acta.chem.scand.53-0133","","x-ray","0.71069","MoKα","","","0.0386","","","0.114","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1520649","8.8167","0.0002","10.8823","0.0001","26.5226","0.0006","90","","90.741","0.001","90","","2544.52","0.08","","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H32 O2 S3 -","","","4","1","","Hegab, Mohamed I.; Abdel-Megeid, Farouk M. E.; Gad, Farouk A.; Shiba, Sayed A.; Sotofte, Inger; Moller, Jorgen; Senning, Alexander","New Reactions with Thiosulfines/Dithiiranes: Cycloadditions Leading to Dispiro Derivatives of 1,2,4-Trithiolane.","Acta Chemica Scandinavica","1999","53","","133","140","10.3891/acta.chem.scand.53-0133","","x-ray","0.71069","MoKα","","","0.0702","","","0.1544","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1520650","9.8988","0.0003","10.1076","0.0003","14.4903","0.0004","78.266","0.0001","80.536","0.0001","62.967","0.001","1260.1","0.06","","","296","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H32 O2 S3 -","","","2","1","","Hegab, Mohamed I.; Abdel-Megeid, Farouk M. E.; Gad, Farouk A.; Shiba, Sayed A.; Sotofte, Inger; Moller, Jorgen; Senning, Alexander","New Reactions with Thiosulfines/Dithiiranes: Cycloadditions Leading to Dispiro Derivatives of 1,2,4-Trithiolane.","Acta Chemica Scandinavica","1999","53","","133","140","10.3891/acta.chem.scand.53-0133","","x-ray","0.71069","MoKα","","","0.0381","","","0.1013","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1520651","10.7929","0.0002","10.7929","0.0002","21.8689","0.0004","90","","90","","90","","2547.44","0.08","","","296","","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C28 H28 O4 S3 -","","","4","0.5","","Hegab, Mohamed I.; Abdel-Megeid, Farouk M. E.; Gad, Farouk A.; Shiba, Sayed A.; Sotofte, Inger; Moller, Jorgen; Senning, Alexander","New Reactions with Thiosulfines/Dithiiranes: Cycloadditions Leading to Dispiro Derivatives of 1,2,4-Trithiolane.","Acta Chemica Scandinavica","1999","53","","133","140","10.3891/acta.chem.scand.53-0133","","x-ray","0.71069","MoKα","","","0.05","","","0.0958","","","","","","","","","","","","175419","2020-10-21","18:00:00",""
"1520652","11.7934","0.0002","17.4284","0.0003","12.1621","0.0001","90","","107.812","0.001","90","","2379.97","0.06","","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 O2 S5 -","","","4","1","","Hegab, Mohamed I.; Abdel-Megeid, Farouk M. E.; Gad, Farouk A.; Shiba, Sayed A.; Sotofte, Inger; Moller, Jorgen; Senning, Alexander","New Reactions with Thiosulfines/Dithiiranes: Cycloadditions Leading to Dispiro Derivatives of 1,2,4-Trithiolane.","Acta Chemica Scandinavica","1999","53","","133","140","10.3891/acta.chem.scand.53-0133","","x-ray","0.71069","MoKα","","","0.0406","","","0.108","","","","","","","","","","","","188978","2020-10-21","18:00:00",""
"1520653","9.992","0.004","17.027","0.008","9.991","0.004","90","","109.44","0.02","90","","1602.9","1.2","","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H20 N2 O -","","","4","1","","Rosling, Ari; Hotokka, Matti; Klika, Karel D.; Fulop, Ferenc; Sillanpaa, Reijo; Mattinen, Jorma","The Conformational Behaviour of 4,4a,5,6,7,8-Hexahydropyrido[1,2-d] [1,3,4]oxadiazine Derivatives Studied by NMR Spectroscopy and Molecular Mechanics","Acta Chemica Scandinavica","1999","53","","213","221","10.3891/acta.chem.scand.53-0213","","x-ray","0.71069","MoKα","","","0.053","","","0.046","","","","","","","1.55","","","","","188978","2020-10-21","18:00:00",""
"1520654","9.621","0.004","11.641","0.006","7.681","0.003","108.01","0.04","95.03","0.04","76.95","0.04","796.8","0.7","","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C19 H20 N2 O -","","","2","1","","Rosling, Ari; Hotokka, Matti; Klika, Karel D.; Fulop, Ferenc; Sillanpaa, Reijo; Mattinen, Jorma","The Conformational Behaviour of 4,4a,5,6,7,8-Hexahydropyrido[1,2-d] [1,3,4]oxadiazine Derivatives Studied by NMR Spectroscopy and Molecular Mechanics","Acta Chemica Scandinavica","1999","53","","213","221","10.3891/acta.chem.scand.53-0213","","x-ray","0.71069","MoKα","","","0.03","","","0.036","","","","","","","1.62","","","","","188978","2020-10-21","18:00:00",""
"1520771","7.7134","","8.1139","","5.6914","","90","","90","","90","","356.201","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Bi2 Al4 O9","","- Al4 Bi2 O9 -","- Al4 Bi2 O9 -","- Al8 Bi4 O18 -","2","0.25","","Abrahams, I.; Hawkes, G. E.; Bush, A. J.; Nunes, T.","Structure and Oxide Ion Conductivity Mechanism in Bi~2~Al~4~O~9~ by Combined X-Ray and High-Resolution Neutron pPwder Diffraction and ^27^Al Solid State NMR","Journal of Solid State Chemistry","1999","147","2","631","636","10.1006/jssc.1999.8427","","","","","","","","","","","","","","","","","","","","","has coordinates","171593","2020-10-21","18:00:00",""
"1520778","6.676","","16.547","","7.543","","90","","94.41","","90","","830.791","","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","(Sr1.54 Ba0.53) (Al4.05 Si11.95) O32 (H2 O)3.16","","- Al4.05 Ba0.53 H6.32 O35.16 Si11.95 Sr1.54 -","- Al4.048 Ba0.526 O35.16 Si11.952 Sr1.542 -","- Al4.048 Ba0.526 O35.16 Si11.952 Sr1.542 -","1","0.25","","Alberti, A.; Vezzalini, G.; Sacerdoti, M.; Quartieri, S.","Heating-induced phase transformation in zeolite brewsterite: new 4-and 5-coordinated (Si, Al) sites","Physics and Chemistry of Minerals (Germany)","1999","26","","181","186","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520786","9.254","","12.287","","3.004","","90","","90","","90","","341.567","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","(Mg1.93 Fe0.967 Al0.093) O2 (B O3)","","- Al0.093 B Fe0.967 Mg1.93 O5 -","- Al0.093 B Fe0.967 Mg1.93 O5 -","- Al0.372 B4 Fe3.868 Mg7.72 O20 -","4","0.5","","Appel, P.W.U.; Brigatti, M.F.","Ludwigite from central Sweden: new data and crystal structure refinement","Mineralogical Magazine (1969-)","1999","63","","511","518","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520791","13.698","","13.698","","5.976","","90","","90","","90","","1121.31","","","","","","","","","","","","","2","I 41/a :2","-I 4ad","88","","","","- Nb O2 -","- Nb O2 -","- Nb32 O64 -","32","2","","Arakcheeva, A.V.; Shamrai, V.F.; Grinevich, V.V.; Meyer, M.; Chapuis, G.","K Nb4 O5 F and Nb O2 crystal structures. Structural aspect of chemical decomposition of K2-x Nb4 O3 (O, F)3 F in the melt of sodium and potassium chlorides","Kristallografiya","1999","44","","6","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","303120","2025-10-31","16:25:09",""
"1520792","4.155","","4.155","","8.377","","90","","90","","90","","144.621","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","K Nb4 O5 F","","- F K Nb4 O5 -","- F K Nb4 O5 -","- F K Nb4 O5 -","1","0.0625","","Arakcheeva, A.V.; Grinevich, V.V.; Chapuis, G.; Shamrai, V.F.; Meyer, M.","K Nb4 O5 F and Nb O2 crystal structures. Structural aspect of chemical decomposition of K2-x Nb4 O3 (O, F)3 F in the melt of sodium and potassium chlorides","Kristallografiya","1999","44","","6","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520793","8.435","","8.435","","10.39","","90","","90","","120","","640.201","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Cs3 (Sb2 I9)","","- Cs3 I9 Sb2 -","- Cs3 I9 Sb2 -","- Cs3 I9 Sb2 -","1","0.0833333","","Arakcheeva, A.V.; Novikova, M.S.; Lubman, G.U.; Zaitsev, A.I.","Perovskite-like modification of Cs3 Sb2 I9 as a member of the OD family A3 B2 X9","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1999","40","","705","715","","","","","","","","","","","","","","","","","","","","","","has coordinates","140337","2020-10-21","18:00:00",""
"1520794","9.8799","","10.2801","","9.8764","","90","","90.113","","90","","1003.11","","","","","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","Ca2.89 (Al5.84 Si10.16 O32) (H2 O)16.32","","- Al5.84 Ca2.89 H32.64 O48.32 Si10.16 -","- Al5.84 Ca2.88 O48.32 Si10.16 -","- Al5.84 Ca2.88 O48.32 Si10.16 -","1","0.125","","Artioli, G.; Marchi, M.","On the space group of garronite","Powder Diffraction","1999","14","","190","194","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520795","8.387","","8.387","","8.387","","90","","90","","90","","589.956","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Cu0.7 Mn0.27 Ga0.03) (Cu0.15 Mn0.36 Ga0.49)2 O4","","- Cu Ga1.01 Mn0.99 O4 -","- Cu Ga1.01 Mn0.99 O4 -","- Cu8 Ga8.08 Mn7.92 O32 -","8","0.0416667","","Asbrink, S.; Waskowska, A.; Talik, E.","Distribution of metal ions and magnetic susceptibility in Cu Ga Mn O4 spinel","Journal of Physics and Chemistry of Solids","1999","60","","573","577","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520796","3.8692","","3.8692","","11.6525","","90","","90","","90","","174.446","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.54 Ca0.46) (La0.23 Ca0.27 Ba0.5)2 Cu3 O7.06","","- Ba Ca Cu3 La O7.06 -","- Ba Ca Cu3 La O7.06 -","- Ba Ca Cu3 La O7.06 -","1","0.0625","","Awana, V.P.S.; de Lima, O.F.; Malik, S.K.; Yelon, W.B.; Narlikar, A.V.","Structural and superconducting properties of La Ba Ca Cu3 O7+d system: a neutron diffraction study","Physica C (Amsterdam)","1999","314","","93","97","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520804","9.08571","","9.08571","","9.08571","","90","","90","","90","","750.027","","","","","","","","","","","","","5","P -4 3 n","P -4n 2 3","218","","Na8 (Al Ge O4)6 (N O2)2","","- Al6 Ge6 N2 Na8 O28 -","- Al6 Ge6 N2 Na7.928 O28.02 -","- Al6 Ge6 N2 Na7.928 O28.02 -","1","0.0416667","","Bachmann, S.; Buhl, J.C.","Crystallisation, characterisation and structure of nitrite aluminogermanate sodalite Na8 (Al Ge O4)6 (N O2)2","Microporous and Mesoporous Materials","1999","28","","35","47","","","","","","","","","","","","","","","","","","","","","","has coordinates","140349","2020-10-21","18:00:00",""
"1520805","24.718","","24.718","","24.718","","90","","90","","90","","15102.2","","","","","","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","(Zn6.875 H (Al0.988 O4))8 H8 (Si104 Al88 O384)","","- Al95.904 H16 O416 Si104 Zn55 -","- Al95.8976 O416.064 Si104.006 Zn54.976 -","- Al95.8976 O416.064 Si104.006 Zn54.976 -","1","0.00520833","","Bae, D.H.; Seff, K.; Zhen, S.-Y.","Structure of dehydrated Zn(2+)-exchanged zeolite X. Overexchange, framework dealumination and reorganisation, stoichiometric retention of monomeric tetrahedral aluminate","J. Phys. Chem. B","1999","103","","5631","5636","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520806","24.92","","24.92","","24.92","","90","","90","","90","","15475.5","","","","","","","","","","","","","6","F d -3 :2","-F 2uv 2vw 3","203","","Na24 Co38 (Al92 Si100 O384) (O H)8 (H2 O)40","","- Al92 Co38 H88 Na24 O432 Si100 -","- Al91.9968 Co38.0032 Na23.9984 O432.003 Si100.003 -","- Al91.9968 Co38.0032 Na23.9984 O432.003 Si100.003 -","1","0.0104167","","Bae, D.H.; Seff, K.","Structures of cobalt(II)-exchanged zeolite X","Microporous and Mesoporous Materials","1999","33","","265","280","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520807","24.95","","24.95","","24.95","","90","","90","","90","","15531.4","","","","","","","","","","","","","6","F d -3 :2","-F 2uv 2vw 3","203","","Na11 Co38 (H3 O)18 (Al92 Si100 O384) (O H)13 (H2 O)61","","- Al92 Co38 H189 Na11 O476 Si100 -","- Al91.9968 Co37.9968 Na10.9984 O475.99 Si100.003 -","- Al91.9968 Co37.9968 Na10.9984 O475.99 Si100.003 -","1","0.0104167","","Bae, D.H.; Seff, K.","Structures of cobalt(II)-exchanged zeolite X","Microporous and Mesoporous Materials","1999","33","","265","280","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520808","8.701","","8.701","","23.41","","90","","90","","120","","1534.87","","","","","","","","","","","","","7","R -3 :H","-R 3","148","","(La0.7 Eu0.3)0.167 Pb0.333 Zr2 (P O4)2.833 (Si O4)0.167","","- Eu0.0501 La0.1169 O12 P2.833 Pb0.333 Si0.167 Zr2 -","- Eu0.05 La0.11665 O12 P2.8332 Pb0.33335 Si0.1668 Zr2 -","- Eu0.3 La0.6999 O72 P16.9992 Pb2.0001 Si1.0008 Zr12 -","6","0.333333","","Bakhous, K.; Cherkaoui, F.; Benabad, A.; Dexpert-Ghys, J.; Savariault, J.M.; El Jouhari, N.","Structural approach and luminescence properties of La1/6 Pb1/3 Zr2 (P O4)17/6 (Si O4)1/6 : Eu(3+)","Journal of Solid State Chemistry","1999","146","","499","505","","","","","","","","","","","","","","","","","","","","","","has coordinates","140354","2020-10-21","18:00:00",""
"1520809","8.692","","8.692","","23.45","","90","","90","","120","","1534.31","","","","","","","","","","","","","6","R -3 :H","-R 3","148","","La0.167 Pb0.333 Zr2 (P O4)2.833 (Si O4)0.167","","- La0.167 O12 P2.833 Pb0.333 Si0.167 Zr2 -","- La0.16665 O12 P2.8332 Pb0.33335 Si0.1668 Zr2 -","- La0.9999 O72 P16.9992 Pb2.0001 Si1.0008 Zr12 -","6","0.333333","","Bakhous, K.; Cherkaoui, F.; Benabad, A.; Savariault, J.M.","New phosphosilicates with Nasicon structure type","Materials Research Bulletin","1999","34","","263","269","","","","","","","","","","","","","","","","","","","","","","has coordinates","140355","2020-10-21","18:00:00",""
"1520811","5.6","","5.6","","3.92","","90","","90","","90","","122.931","","","","","","","","","","","","","3","P 4/n m m :1","P 4ab 2ab -1ab","129","","(N D4) I","","- D4 I N -","- D4 I N -","- D8 I2 N2 -","2","0.125","","Balagurov, A.M.; Kozlenko, D.P.; Hull, S.; Glazkov, V.P.; Savenko, B.N.; Somenkov, V.A.","Neutron diffraction study of structural changes in ammonium halides under high pressure","Physik (Berlin)","1999","265","","92","96","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1520813","8.1484","","9.8024","","6.6355","","103.832","","102.353","","106.975","","468.678","","","","","","","","","","","","","5","P -1","-P 1","2","","Li Cu Fe2 (V O4)3","","- Cu Fe2 Li O12 V3 -","- Cu Fe2 Li O12 V3 -","- Cu2 Fe4 Li2 O24 V6 -","2","1","","Belik, A.A.","Synthesis and crystal structure of Li Cu Fe2 (V O4)3 by Rietveld method","Materials Research Bulletin","1999","34","","1973","1980","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520814","10.3276","","10.3276","","37.1","","90","","90","","120","","3426.92","","","","","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","Ca9 Co Li (P O4)7","","- Ca9 Co Li O28 P7 -","- Ca9 Co Li O28 P7 -","- Ca54 Co6 Li6 O168 P42 -","6","0.333333","","Belik, A.A.; Morozov, V.A.; Khasanov, S.S.; Lazoryak, B.I.","Crystal structures of new triple Ca9 Co M (P O4)7 (M = Li, Na, K) phosphates","Materials Research Bulletin","1999","34","","883","893","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520815","3.8891","","3.8891","","9.5407","","90","","90","","90","","144.304","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Hg Ba2 Cu O4.054","","- Ba2 Cu Hg O4.054 -","- Ba2 Cu Hg O4.054 -","- Ba2 Cu Hg O4.054 -","1","0.0625","","Balagurov, A.M.; Sheptyakov, D.V.; Radaelli, P.G.; Aksenov, V.L.; Putilin, S.N.; Antipov, E.V.; Marezio, M.","Structure of Hg Ba2 Cu O4+d (0.06<d<0.19) at ambient and high pressure","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","7209","7215","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520816","10.3515","","10.3515","","37.073","","90","","90","","120","","3440.29","","","","","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","Ca9 Co Na (P O4)7","","- Ca9 Co Na O28 P7 -","- Ca9 Co Na O28 P7 -","- Ca54 Co6 Na6 O168 P42 -","6","0.333333","","Belik, A.A.; Morozov, V.A.; Khasanov, S.S.; Lazoryak, B.I.","Crystal structures of new triple Ca9 Co M (P O4)7 (M = Li, Na, K) phosphates","Materials Research Bulletin","1999","34","","883","893","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520817","10.4017","","10.4017","","37.009","","90","","90","","120","","3467.74","","","","","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","Ca9 Co K (P O4)7","","- Ca9 Co K O28 P7 -","- Ca9 Co K O28 P7 -","- Ca54 Co6 K6 O168 P42 -","6","0.333333","","Belik, A.A.; Morozov, V.A.; Khasanov, S.S.; Lazoryak, B.I.","Crystal structures of new triple Ca9 Co M (P O4)7 (M = Li, Na, K) phosphates","Materials Research Bulletin","1999","34","","883","893","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520818","3.8768","","3.8768","","9.4964","","90","","90","","90","","142.727","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Hg Ba2 Cu O4.069","","- Ba2 Cu Hg O4.069 -","- Ba2 Cu Hg O4.069 -","- Ba2 Cu Hg O4.069 -","1","0.0625","","Balagurov, A.M.; Sheptyakov, D.V.; Aksenov, V.L.; Antipov, E.V.; Putilin, S.N.; Radaelli, P.G.; Marezio, M.","Structure of Hg Ba2 Cu O4+d (0.06<d<0.19) at ambient and high pressure","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","7209","7215","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520819","15.113","","12.006","","15.892","","90","","122.85","","90","","2422.45","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Li6 (P6 O18) (H2 O)9.86","","- H19.72 Li6 O27.86 P6 -","- Li6 O27.86 P6 -","- Li24 O111.44 P24 -","4","0.5","","Chaabane, T. Ben; Smiri-Dogguy, L.","Synthesis and crystal structure of a new lithium cyclohexaphosphate hydrate: Li~6~P~6~O~18~ * 10(H~2~O)","Journal of Chemical Crystallography","1999","29","3","323","327","10.1023/A:1009577902852","","","","","","","","","","","","","","","","","","","","","has coordinates","174902","2020-10-21","18:00:00",""
"1520820","3.8693","","3.8693","","9.4913","","90","","90","","90","","142.099","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Hg Ba2 Cu O4.172","","- Ba2 Cu Hg O4.172 -","- Ba2 Cu Hg O4.172 -","- Ba2 Cu Hg O4.172 -","1","0.0625","","Balagurov, A.M.; Sheptyakov, D.V.; Aksenov, V.L.; Putilin, S.N.; Antipov, E.V.; Radaelli, P.G.; Marezio, M.","Structure of Hg Ba2 Cu O4+d (0.06<d<0.19) at ambient and high pressure","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","7209","7215","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520822","6.203","","10.057","","7.464","","90","","110.653","","90","","435.707","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(N H3 O H)2 (Ti F6) (H2 O)2","","- F6 H12 N2 O4 Ti -","- F6 H12 N2 O4 Ti -","- F12 H24 N4 O8 Ti2 -","2","0.5","","Ban, I.; Kristl, M.; Volavsek, B.; Golic, L.","Kristallstruktur und thermische Analyse von Hydroxylammoniumhexafluorotitanat(IV) - dihydrat und Hydroxyalammoniumhexafluoroindat(III)","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","1999","130","","401","408","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520824","7.764","","7.764","","7.764","","97.21","","97.21","","97.21","","455.871","","","","","","","","","","","","","5","R 3 c :R","P 3* -2n","161","","(N H3 O H)3 (In F6)","","- F6 H12 In N3 O3 -","- F6 H12 In N3 O3 -","- F12 H24 In2 N6 O6 -","2","0.333333","","Ban, I.; Kristl, M.; Volavsek, B.; Golic, L.","Kristallstruktur und thermische Analyse von Hydroxylammoniumhexafluorotitanat(IV) - dihydrat und Hydroxyalammoniumhexafluoroindat(III)","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","1999","130","","401","408","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520828","8.616","","10.449","","9.397","","90","","99.72","","90","","833.854","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","(P Cl4) (Re2 Cl9)","","- Cl13 P Re2 -","- Cl13 P Re2 -","- Cl26 P2 Re4 -","2","0.5","","Baranov, A.I.; Khvorykh, G.V.; Troyanov, S.I.","Synthesis and crystal structure of (P Cl4) (Re2 Cl9)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1240","1242","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520829","3.07378","","3.07378","","17.6803","","90","","90","","120","","144.666","","","","","","","","","","","","","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","","Barsoum, M.W.; El-Raghy, T.; Hubbard, C.R.; Rawn, C.J.; Porter, W.D.; Wang, H.; Payzant, E.A.","Thermal properties of Ti3 Si C2","Journal of Physics and Chemistry of Solids","1999","60","","429","439","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520830","5.5946","","14.8273","","5.4307","","90","","90","","90","","450.492","","","","","","","","","","","","","3","P c m n","-P 2n 2ac","62","","","","- Ca2 Fe2 O5 -","- Ca2 Fe2 O5 -","- Ca8 Fe8 O20 -","4","0.5","","Berastegui, P.; Hull, S.; Eriksson, S.G.","A neutron diffraction study of the temperature dependence of Ca2 Fe2 O5","Materials Research Bulletin","1999","34","","303","314","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520838","11.995","","11.995","","15.943","","90","","90","","90","","2293.88","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","In Sn Cl3","","- Cl3 In Sn -","- Cl3 In Sn -","- Cl48 In16 Sn16 -","16","0.5","","Beck, H.P.; Stoewe, K.; Tratzky, H.; Kallmayer, V.","The (In Sn Cl3) - type arrangement. I. A new A B X3 structure type with close cation-cation contacts","Journal of Solid State Chemistry","1999","146","","344","350","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520839","12.497","","12.497","","16.411","","90","","90","","90","","2562.99","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","In Sn Br3","","- Br3 In Sn -","- Br3 In Sn -","- Br48 In16 Sn16 -","16","0.5","","Beck, H.P.; Tratzky, H.; Kallmayer, V.; Stoewe, K.","The (In Sn Cl3) - type arrangement. I. A new A B X3 structure type with close cation-cation contacts","Journal of Solid State Chemistry","1999","146","","344","350","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520840","11.902","","11.902","","15.805","","90","","90","","90","","2238.9","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Tl Pb Cl3","","- Cl3 Pb Tl -","- Cl3 Pb Tl -","- Cl48 Pb16 Tl16 -","16","0.5","","Beck, H.P.; Schramm, M.; Haberkorn, R.","The (In Sn Cl3)-type arrangement. II. High pressure synthesis of Tl Pb Cl3 and of solid solutions containing Rb or Br","Journal of Solid State Chemistry","1999","146","","351","354","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520841","12.177","","12.177","","16.226","","90","","90","","90","","2405.98","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","Tl Pb (Cl1.3 Br1.7)","","- Br1.7 Cl1.3 Pb Tl -","- Br1.7 Cl1.3 Pb Tl -","- Br27.2 Cl20.8 Pb16 Tl16 -","16","0.5","","Beck, H.P.; Haberkorn, R.; Schramm, M.","The (In Sn Cl3)-type arrangement. II. High pressure synthesis of Tl Pb Cl3 and of solid solutions containing Rb or Br","Journal of Solid State Chemistry","1999","146","","351","354","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520842","11.918","","11.918","","15.949","","90","","90","","90","","2265.38","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Rb0.25 Tl0.75) Pb Cl3","","- Cl3 Pb Rb0.25 Tl0.75 -","- Cl3 Pb Rb0.25 Tl0.75 -","- Cl48 Pb16 Rb4 Tl12 -","16","0.5","","Beck, H.P.; Schramm, M.; Haberkorn, R.","The (In Sn Cl3)-type arrangement. II. High pressure synthesis of Tl Pb Cl3 and of solid solutions containing Rb or Br","Journal of Solid State Chemistry","1999","146","","351","354","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520843","8.63498","","15.7311","","8.38875","","90","","90","","90","","1139.51","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Rb3 Pb Cl5","","- Cl5 Pb Rb3 -","- Cl5 Pb Rb3 -","- Cl20 Pb4 Rb12 -","4","0.5","","Beck, H.P.; Monzel, H.; Haberkorn, R.; Stephens, P.W.; Dinnebier, R.E.","Synthese und Kristallstruktur von Rb3 Pb Cl5","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1998","2002","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520847","12.136","","12.136","","30.581","","90","","90","","90","","4504.05","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","H K4 (V10 O10 (H2 O)2 (O H)4 (P O4)7) (H2 O)9","","- H27 K4 O53 P7 V10 -","- K4 O53 P7 V10 -","- K16 O212 P28 V40 -","4","0.25","","Berrah, F.; Guesdon, A.; Leclaire, A.; Provost, J.; Borel, M.M.; Raveau, B.","A V(IV) hydroxyhydrogenomonophosphate with an intersecting tunnel structure: H K4 (V10 O10 (H2 O)2 (O H)4 (P O4)7) . 9(H2 O)","Journal of Solid State Chemistry","1999","148","","189","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","140403","2020-10-21","18:00:00",""
"1520852","3.8605","","3.9243","","11.6993","","90","","90","","90","","177.242","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Pr Ba2 Cu3 O7","","- Ba2 Cu3 O7 Pr -","- Ba2 Cu3 O7 Pr -","- Ba2 Cu3 O7 Pr -","1","0.125","","Bertrand, C.; Galez, P.; Jorda, J.L.; Gladyshevskii, R.E.","The Pr (Ba1-x Prx)2 Cu3 O7+d solid solution. A crystal structure and phase diagram study","Physica C (Amsterdam)","1999","321","","151","161","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520853","3.8928","","3.8928","","11.6424","","90","","90","","90","","176.428","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Pr (Ba0.85 Pr0.15)2 Cu3 O7.4","","- Ba1.7 Cu3 O7.4 Pr1.3 -","- Ba1.7 Cu3 O7.4 Pr1.3 -","- Ba1.7 Cu3 O7.4 Pr1.3 -","1","0.0625","","Bertrand, C.; Jorda, J.L.; Galez, P.; Gladyshevskii, R.E.","The Pr (Ba1-x Prx)2 Cu3 O7+d solid solution. A crystal structure and phase diagram study","Physica C (Amsterdam)","1999","321","","151","161","","","","","","","","","","","","","","","","","","","","","","has coordinates","140409","2020-10-21","18:00:00",""
"1520854","3.8894","","3.8541","","11.6099","","90","","90","","90","","174.034","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Pr (Ba0.6 Pr0.4)2 Cu3 O7.11","","- Ba1.2 Cu3 O7.11 Pr1.8 -","- Ba1.2 Cu3 O7.11 Pr1.8 -","- Ba1.2 Cu3 O7.11 Pr1.8 -","1","0.125","","Bertrand, C.; Jorda, J.L.; Galez, P.; Gladyshevskii, R.E.","The Pr (Ba1-x Prx)2 Cu3 O7+d solid solution. A crystal structure and phase diagram study","Physica C (Amsterdam)","1999","321","","151","161","","","","","","","","","","","","","","","","","","","","","","has coordinates","140410","2020-10-21","18:00:00",""
"1520855","3.8897","","3.8473","","11.5993","","90","","90","","90","","173.582","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Pr (Ba0.5 Pr0.5)2 Cu3 O7.36","","- Ba Cu3 O7.36 Pr2 -","- Ba Cu3 O7.36 Pr2 -","- Ba Cu3 O7.36 Pr2 -","1","0.125","","Bertrand, C.; Galez, P.; Gladyshevskii, R.E.; Jorda, J.L.","The Pr (Ba1-x Prx)2 Cu3 O7+d solid solution. A crystal structure and phase diagram study","Physica C (Amsterdam)","1999","321","","151","161","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520856","3.8828","","3.8493","","11.6077","","90","","90","","90","","173.489","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Nd (Ba0.6 Nd0.4)2 Cu3 O7.24","","- Ba1.2 Cu3 Nd1.8 O7.24 -","- Ba1.2 Cu3 Nd1.8 O7.24 -","- Ba1.2 Cu3 Nd1.8 O7.24 -","1","0.125","","Bertrand, C.; Jorda, J.L.; Galez, P.; Gladyshevskii, R.E.","The Pr (Ba1-x Prx)2 Cu3 O7+d solid solution. A crystal structure and phase diagram study","Physica C (Amsterdam)","1999","321","","151","161","","","","","","","","","","","","","","","","","","","","","","has coordinates","140412","2020-10-21","18:00:00",""
"1520871","6.975","","6.975","","18.31","","90","","90","","90","","890.793","","","","","","","","","","","","","5","I 41/a m d :2","-I 4bd 2","141","","Na2 (U O2)2 (Si O4) F2","","- F2 Na2 O8 Si U2 -","- F2 Na2 O8 Si U2 -","- F8 Na8 O32 Si4 U8 -","4","0.125","","Blaton, N.; Vochten, R.; Peters, O.M.; van Springel, K.","The crystal structure of Na2 (U O2)2 Si O4 F2, a compound structurally related to soddyite, and formed during uranyl silicate synthesis in Teflon-lined bombs","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","1999","1999","","253","264","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520876","9.434","","9.434","","10.492","","90","","90","","120","","808.687","","","","","","","","","","","","","4","P -6 2 c","P -6c -2c","190","","Mg (H Se O3)2 (H2 O)3","","- H8 Mg O9 Se2 -","- H7.5 Mg O9 Se2 -","- H30 Mg4 O36 Se8 -","4","0.333333","","Boldt, K.; Engelen, B.; Panthoefer, M.; Mueller, H.; Unterderweide, K.","Mg (H Se O3)2 . 3(H2 O) : crystal structure, rotational and orientational disorder of 'free' (H Se O3)(-) ions and low temperature phase transition","Journal of Molecular Structure","1999","475","","35","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520881","9.4","","9.4","","20.2","","90","","90","","120","","1545.74","","","","","","","","","","","","","3","P 3 c 1","P 3 -2""c","158","","Sr5 Co4 O12","","- Co4 O12 Sr5 -","- Co4 O12 Sr5 -","- Co24 O72 Sr30 -","6","1","","Boulahya, K.; Parras, M.; Gonzalez-Calbet, J.M.","The An+2 Bn B' O3n+3 family (B = B' = Co): ordered intergrowth between 2h-(Ba Co O3) and Ca3 Co2 O6 structures","Journal of Solid State Chemistry","1999","145","","116","127","","","","","","","","","","","","","","","","","","","","","","has coordinates","140444","2020-10-21","18:00:00",""
"1520883","4.0685","","4.0685","","4.0685","","90","","90","","90","","67.345","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Ba0.8 Bi0.2) (Fe0.8 Bi0.2) O2.6","","- Ba0.8 Bi0.4 Fe0.8 O2.6 -","- Ba0.8 Bi0.4 Fe0.8 O2.601 -","- Ba0.8 Bi0.4 Fe0.8 O2.601 -","1","0.0208333","","Boullay, P.; Hervieu, M.; Nguyen, N.; Raveau, B.","Synthesis, average structure, and magnetic properties of oxygen deficient perovskites (Ba2-3x Bi3x-1) (Fe2x Bi1-2x) O2+3x/2","Journal of Solid State Chemistry","1999","147","","45","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","140446","2020-10-21","18:00:00",""
"1520884","4.0515","","4.0515","","4.0515","","90","","90","","90","","66.504","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Ba0.71 Bi0.29) (Fe0.86 Bi0.14) O2.645","","- Ba0.71 Bi0.43 Fe0.86 O2.645 -","- Ba0.71 Bi0.43 Fe0.86 O2.6451 -","- Ba0.71 Bi0.43 Fe0.86 O2.6451 -","1","0.0208333","","Boullay, P.; Hervieu, M.; Nguyen, N.; Raveau, B.","Synthesis, average structure, and magnetic properties of oxygen deficient perovskites (Ba2-3x Bi3x-1) (Fe2x Bi1-2x) O2+3x/2","Journal of Solid State Chemistry","1999","147","","45","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","140447","2020-10-21","18:00:00",""
"1520885","4.0937","","4.0937","","4.0937","","90","","90","","90","","68.604","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ba (Fe0.67 Bi0.33) O2.5","","- Ba Bi0.33 Fe0.67 O2.5 -","- Ba Bi0.33 Fe0.67 O2.499 -","- Ba Bi0.33 Fe0.67 O2.499 -","1","0.0208333","","Boullay, P.; Hervieu, M.; Raveau, B.; Nguyen, N.","Synthesis, average structure, and magnetic properties of oxygen deficient perovskites (Ba2-3x Bi3x-1) (Fe2x Bi1-2x) O2+3x/2","Journal of Solid State Chemistry","1999","147","","45","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520886","4.0142","","4.0142","","4.0845","","90","","90","","90","","65.817","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","(Ba0.63 Bi0.37) (Fe0.94 Bi0.06) O2.7","","- Ba0.63 Bi0.43 Fe0.94 O2.7 -","- Ba0.63 Bi0.43 Fe0.94 O2.7 -","- Ba0.63 Bi0.43 Fe0.94 O2.7 -","1","0.0625","","Boullay, P.; Hervieu, M.; Nguyen, N.; Raveau, B.","Synthesis, average structure, and magnetic properties of oxygen deficient perovskites (Ba2-3x Bi3x-1) (Fe2x Bi1-2x) O2+3x/2","Journal of Solid State Chemistry","1999","147","","45","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","140449","2020-10-21","18:00:00",""
"1520887","3.9954","","3.9954","","4.09","","90","","90","","90","","65.29","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","(Ba0.57 Bi0.43) (Fe0.96 Bi0.04) O2.7","","- Ba0.57 Bi0.47 Fe0.96 O2.7 -","- Ba0.57 Bi0.47 Fe0.96 O2.7 -","- Ba0.57 Bi0.47 Fe0.96 O2.7 -","1","0.0625","","Boullay, P.; Hervieu, M.; Nguyen, N.; Raveau, B.","Synthesis, average structure, and magnetic properties of oxygen deficient perovskites (Ba2-3x Bi3x-1) (Fe2x Bi1-2x) O2+3x/2","Journal of Solid State Chemistry","1999","147","","45","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","140450","2020-10-21","18:00:00",""
"1520888","3.9804","","3.9804","","16.378","","90","","90","","90","","259.486","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","","","- Ba2 Bi2 Fe4 O11 -","- Ba2 Bi2 Fe4 O11 -","- Ba2 Bi2 Fe4 O11 -","1","0.0625","","Boullay, P.; Grebille, D.; Hervieu, M.; Raveau, B.; Suard, E.","Incommensurate nuclear and magnetic structure of the oxygen-deficient perovskites (Ba2-3x Bi3x-1) (Fe2x Bi1-2x) O2+3x/2 (0.43<x<0.50)","Journal of Solid State Chemistry","1999","147","","450","463","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520889","4.0819","","4.0819","","4.0819","","90","","90","","90","","68.012","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Ba0.89 Bi0.11) (Fe0.74 Bi0.26) O2.555","","- Ba0.89 Bi0.37 Fe0.74 O2.555 -","- Ba0.89 Bi0.37 Fe0.74 O2.5551 -","- Ba0.89 Bi0.37 Fe0.74 O2.5551 -","1","0.0208333","","Boullay, P.; Raveau, B.; Hervieu, M.; Nguyen, N.","Synthesis, average structure, and magnetic properties of oxygen deficient perovskites (Ba2-3x Bi3x-1) (Fe2x Bi1-2x) O2+3x/2","Journal of Solid State Chemistry","1999","147","","45","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","140452","2020-10-21","18:00:00",""
"1520890","4.0506","","4.0506","","4.0506","","90","","90","","90","","66.46","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Ba0.7 Bi0.3) (Fe0.9 Bi0.1) O2.67","","- Ba0.7 Bi0.4 Fe0.9 O2.67 -","- Ba0.7 Bi0.4 Fe0.9 O2.67 -","- Ba0.7 Bi0.4 Fe0.9 O2.67 -","1","0.0208333","","Boullay, P.; Grebille, D.; Hervieu, M.; Suard, E.; Raveau, B.","Incommensurate nuclear and magnetic structure of the oxygen-deficient perovskites (Ba2-3x Bi3x-1) (Fe2x Bi1-2x) O2+3x/2 (0.43<x<0.50)","Journal of Solid State Chemistry","1999","147","","450","463","","","","","","","","","","","","","","","","","","","","","","has coordinates","140453","2020-10-21","18:00:00",""
"1520891","3.9802","","3.9802","","16.376","","90","","90","","90","","259.428","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","","","- Ba0.5 Bi0.5 Fe O2.75 -","- Ba0.5 Bi0.5 Fe O2.75 -","- Ba2 Bi2 Fe4 O11 -","4","0.25","","Boullay, P.; Grebille, D.; Hervieu, M.; Suard, E.; Raveau, B.","Incommensurate nuclear and magnetic structure of the oxygen-deficient perovskites (Ba2-3x Bi3x-1) (Fe2x Bi1-2x) O2+3x/2 (0.43<x<0.50)","Journal of Solid State Chemistry","1999","147","","450","463","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520897","4.7843","","8.4287","","2.9336","","90","","90","","90","","118.299","","","","","","","","","","","","","3","P b m m","-P 2 2b","51","","Cu (Ge O3)","","- Cu Ge O3 -","- Cu Ge O3 -","- Cu2 Ge2 O6 -","2","0.25","","Braden, M.; Buechner, B.; Klotz, S.; Marshall, W.G.; Behruzi, M.; Heger, G.","Pressure dependence of the crystal structure of Cu Ge O3 to 6.2 GPa by neutron diffraction","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","9616","9622","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520899","9.599","","9.599","","5.549","","90","","90","","120","","442.79","","","","","","","","","","","","","3","P -6 2 m","P -6 -2","189","","K2 (Re H9)","","- H9 K2 Re -","- H9 K2 Re -","- H27 K6 Re3 -","3","0.25","","Bronger, W.; a Brassard, L.; Mueller, P.; Schultz, Th.; Lebech, B.","K2 Re H9, eine Neubestimmung der Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1143","1146","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520900","5.9165","","5.9165","","5.9165","","90","","90","","90","","207.107","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Rb3 (Re D9) D","","- D10 Rb3 Re -","- Rb3 Re -","- Rb3 Re -","1","0.0208333","","Bronger, W.; Auffermann, G.","Rb3 Re H10, ein neues Hydride des siebenwertigen Rheniums Hochdrucksynthese und Kristallstruktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1147","1150","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520901","5.912","","5.912","","5.912","","90","","90","","90","","206.635","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Rb3 (Re D9) D1.144","","- D10.144 Rb3 Re -","- D10.144 Rb3 Re -","- D10.144 Rb3 Re -","1","0.0208333","","Bronger, W.; Auffermann, G.","Rb3 Re H10, ein neues Hydride des siebenwertigen Rheniums Hochdrucksynthese und Kristallstruktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1147","1150","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520902","4.7223","","7.8934","","2.9137","","90","","90","","90","","108.608","","","","","","","","","","","","","3","P b m m","-P 2 2b","51","","Cu (Ge O3)","","- Cu Ge O3 -","- Cu Ge O3 -","- Cu2 Ge2 O6 -","2","0.25","","Braden, M.; Heger, G.; Buechner, B.; Klotz, S.; Behruzi, M.; Marshall, W.G.","Pressure dependence of the crystal structure of Cu Ge O3 to 6.2 GPa by neutron diffraction","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","9616","9622","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520903","8.023","","12.868","","10.41","","90","","127.49","","90","","852.753","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","K3 (Fe Se3)","","- Fe K3 Se3 -","- Fe K3 Se3 -","- Fe4 K12 Se12 -","4","1","","Bronger, W.; Genin, H.S.; Mueller, P.","K3 Fe Se3 und K3 Fe2 Se4, zwei neue Verbindungen im System K / Fe / Se","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","274","278","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520904","4.7767","","8.5345","","2.9192","","90","","90","","90","","119.006","","","","","","","","","","","","","4","P b m m","-P 2 2b","51","","Cu (Ge0.76 Si0.24 O3)","","- Cu Ge0.76 O3 Si0.24 -","- Cu Ge0.76 O3 Si0.24 -","- Cu2 Ge1.52 O6 Si0.48 -","2","0.25","","Braden, M.; Behruzi, M.; Klotz, S.; Marshall, W.G.; Buechner, B.; Heger, G.","Pressure dependence of the crystal structure of Cu Ge O3 to 6.2 GPa by neutron diffraction","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","9616","9622","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520905","7.433","","11.341","","12.016","","90","","90","","90","","1012.92","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","K3 (Fe2 Se4)","","- Fe2 K3 Se4 -","- Fe2 K3 Se4 -","- Fe8 K12 Se16 -","4","0.5","","Bronger, W.; Genin, H.S.; Mueller, P.","K3 Fe Se3 und K3 Fe2 Se4, zwei neue Verbindungen im System K / Fe /Se","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","274","278","","","","","","","","","","","","","","","","","","","","","","has coordinates","140471","2020-10-21","18:00:00",""
"1520906","9.79","","9.79","","9.79","","90","","90","","90","","938.314","","","","","","","","","","","","","3","P 21 3","P 2ac 2ab 3","198","","","","- K3 Sb Se3 -","- K3 Sb Se3 -","- K12 Sb4 Se12 -","4","0.333333","","Bronger, W.; Donike, A.; Schmitz, D.","K3 Sb Se3, Rb3 Sb Se3 und Cs3 Sb Se3 - Synthese und Kristallstruktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","435","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520907","10.152","","10.152","","10.152","","90","","90","","90","","1046.3","","","","","","","","","","","","","3","P 21 3","P 2ac 2ab 3","198","","","","- Rb3 Sb Se3 -","- Rb3 Sb Se3 -","- Rb12 Sb4 Se12 -","4","0.333333","","Bronger, W.; Donike, A.; Schmitz, D.","K3 Sb Se3, Rb3 Sb Se3 und Cs3 Sb Se3 - Synthese und Kristallstruktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","435","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520908","5.3649","","7.6062","","5.4089","","90","","90","","90","","220.718","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Pr0.8 Sr0.2) (Co O3)","","- Co O3 Pr0.8 Sr0.2 -","- Co O3 Pr0.8 Sr0.2 -","- Co4 O12 Pr3.2 Sr0.8 -","4","0.5","","Brinks, H.W.; Fjellvag, H.; Kjekshus, A.; Hauback, B.C.","Structure and magnetism of Pr1-x Srx Co O3-d","Journal of Solid State Chemistry","1999","147","","464","477","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520909","10.592","","10.592","","10.592","","90","","90","","90","","1188.32","","","","","","","","","","","","","3","P 21 3","P 2ac 2ab 3","198","","","","- Cs3 Sb Se3 -","- Cs3 Sb Se3 -","- Cs12 Sb4 Se12 -","4","0.333333","","Bronger, W.; Schmitz, D.; Donike, A.","K3 Sb Se3, Rb3 Sb Se3 und Cs3 Sb Se3 - Synthese und Kristallstruktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","435","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520910","5.3751","","5.3993","","7.6487","","90","","90.308","","90","","221.976","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Pr0.5 Sr0.5) (Co O3)","","- Co O3 Pr0.5 Sr0.5 -","- Co O3 Pr0.5 Sr0.5 -","- Co4 O12 Pr2 Sr2 -","4","1","","Brinks, H.W.; Fjellvag, H.; Kjekshus, A.; Hauback, B.C.","Structure and magnetism of Pr1-x Srx Co O3-d","Journal of Solid State Chemistry","1999","147","","464","477","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520916","12.784","","12.784","","3.965","","90","","90","","90","","648.003","","","","","","","","","","","","","4","P 4/m b m","-P 4 2ab","127","","K0.38 (Mg0.38 In0.62) F3","","- F3 In0.62 K0.38 Mg0.38 -","- F3 In0.62 K0.3798 Mg0.38 -","- F30 In6.2 K3.798 Mg3.8 -","10","0.625","","Caramanian, A.; de Kozak, A.; Dupont, N.; Gredin, P.","The crystal structure of Kx (Mgx In1-x) F3 (x=0.38): a new Magneli-bronze type fluoride","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","933","938","","","","","","","","","","","","","","","","","","","","","","has coordinates","140489","2020-10-21","18:00:00",""
"1520917","12.781","","12.787","","7.93","","90","","90","","90","","1296.01","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","K0.38 (Mg0.38 In0.62) F3","","- F3 In0.62 K0.38 Mg0.38 -","- F3 In0.62 K0.38 Mg0.38 -","- F60 In12.4 K7.6 Mg7.6 -","20","5","","Caramanian, A.; Dupont, N.; Gredin, P.; de Kozak, A.","The crystal structure of Kx (Mgx In1-x) F3 (x=0.38): a new Magneli-bronze type fluoride","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","933","938","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520919","3.3243","","5.7844","","14.811","","90","","90","","90","","284.802","","","","","","","","","","","","","2","C m 2 m","C -2 -2","38","","","","- Nb S2 -","- Nb S2 -","- Nb2 S4 -","2","0.25","","Cario, L.; Lafond, A.; Palvadeau, P.; Deudon, C.; Meerschaut, A.","Evidence of a mixed-valence state for europium in the misfit layer compound [(Eu S)1.5]1.15 Nb S2 by means of a superspace structural determination, Mossbauer spectroscopy, and magnetic measurements","Journal of Solid State Chemistry","1999","147","","58","67","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520920","12.6595","","12.6595","","5.1527","","90","","90","","120","","715.152","","","","","","","","","","","","","5","P 63","P 6c","173","","Na7.262 (C O3)0.932 Al6 Si6 O24","","- C0.932 Al6 Na7.262 O26.796 Si6 -","- C0.932 Al6 Na7.262 O26.796 Si6 -","- C0.932 Al6 Na7.262 O26.796 Si6 -","1","0.166667","","Burton, A.; Feuerstein, M.; Lobo, R.F.; Chan, J.C.C.","Characterization of cancrinite synthesized in 1,3-butanediol by Rietveld analysis of powder neutron diffraction data and solid state (23)Na NMR spectroscopy","Microporous and Mesoporous Materials","1999","30","","293","305","","","","","","","","","","","","","","","","","","","","","","has coordinates","140494","2020-10-21","18:00:00",""
"1520921","5.762","","5.7837","","29.637","","90","","90","","90","","987.673","","","","","","","","","","","","","2","F m 2 m","F -2 -2","42","","","","- Eu S -","- Eu S -","- Eu12 S12 -","12","0.75","","Cario, L.; Meerschaut, A.; Lafond, A.; Palvadeau, P.; Deudon, C.","Evidence of a mixed-valence state for europium in the misfit layer compound [(Eu S)1.5]1.15 Nb S2 by means of a superspace structural determination, Mossbauer spectroscopy, and magnetic measurements","Journal of Solid State Chemistry","1999","147","","58","67","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520923","2.83","","2.83","","20.3727","","90","","90","","120","","141.303","","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","H0.19 Na0.06 K0.25 Co O2 (H2 O)0.3","","- Co H0.79 K0.25 Na0.06 O2.3 -","- Co K0.25 Na0.06 O2.3 -","- Co3 K0.75 Na0.18 O6.9 -","3","0.166667","","Butel, M.; Gautier, L.; Delmas, C.","Cobalt oxyhydroxides obtained by 'chimie douce' reactions: structure and electronic conductivity properties","Solid State Ionics","1999","122","","271","284","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520924","5.3314","","5.3697","","31.067","","90","","90","","90","","889.387","","","","","","","","","","","","","6","A m a a","-A 2a 2","66","","(Bi0.6 Pb0.4)1.648 (Ca0.67 Sr0.33)2 (Sr0.77 Ca0.23) Mn2 O9","","- Bi0.9888 Ca1.57 Mn2 O9 Pb0.6592 Sr1.43 -","- Bi0.988 Ca1.57 Mn2 O9 Pb0.66 Sr1.43 -","- Bi3.952 Ca6.28 Mn8 O36 Pb2.64 Sr5.72 -","4","0.25","","Catti, M.; Levy, D.; Artioli, G.","Synchrotron X-ray powder diffraction study of (Bi, Pb)1.64 Sr1.43 Ca1.57 Mn2 O9, Mn-analogue of BSCCO-2212 superconductor","Journal of Solid State Chemistry","1999","147","","501","508","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520925","5.3314","","5.3697","","31.067","","90","","90","","90","","889.387","","","","","","","","","","","","","6","A b m m","-A 2b 2b","67","","(Bi0.6 Pb0.4)1.652 (Ca0.67 Sr0.33)2 (Sr0.78 Ca0.22) Mn2 O9","","- Bi0.9912 Ca1.56 Mn2 O9 Pb0.6608 Sr1.44 -","- Bi0.992 Ca1.56 Mn2 O9 Pb0.66 Sr1.44 -","- Bi3.968 Ca6.24 Mn8 O36 Pb2.64 Sr5.76 -","4","0.25","","Catti, M.; Levy, D.; Artioli, G.","Synchrotron X-ray powder diffraction study of (Bi, Pb)1.64 Sr1.43 Ca1.57 Mn2 O9, Mn-analogue of BSCCO-2212 superconductor","Journal of Solid State Chemistry","1999","147","","501","508","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520926","5.3314","","5.3697","","31.067","","90","","90","","90","","889.387","","","","","","","","","","","","","6","F m m m","-F 2 2","69","","(Bi0.6 Pb0.4)1.644 (Ca0.67 Sr0.33)2 (Sr0.77 Ca0.23) Mn2 O9","","- Bi0.9864 Ca1.57 Mn2 O9 Pb0.6576 Sr1.43 -","- Bi0.986 Ca1.57 Mn2 O9 Pb0.658 Sr1.43 -","- Bi3.944 Ca6.28 Mn8 O36 Pb2.632 Sr5.72 -","4","0.125","","Catti, M.; Levy, D.; Artioli, G.","Synchrotron X-ray powder diffraction study of (Bi, Pb)1.64 Sr1.43 Ca1.57 Mn2 O9, Mn-analogue of BSCCO-2212 superconductor","Journal of Solid State Chemistry","1999","147","","501","508","","","","","","","","","","","","","","","","","","","","","","has coordinates","140506","2020-10-21","18:00:00",""
"1520928","15.0718","","8.8556","","9.1234","","89.661","","123.912","","90.429","","1010.53","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","Li Zr2 (P O4)3","","- Li O12 P3 Zr2 -","- Li O12 P3 Zr2 -","- Li4 O48 P12 Zr8 -","4","","","Catti, M.; Stramare, S.; Ibberson, R.","Lithium location in NASICON-type Li(+) conductors by neutron diffraction. I. Triclinic alpha'-Li Zr2 (P O4)3","Solid State Ionics","1999","123","","173","180","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520929","9.466","","12.268","","19.096","","90","","90","","90","","2217.6","","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(Cu (C3 H6 (N H2)2)) (Ni (C N)4)","","- C7 H10 Cu N6 Ni -","- C7 Cu N6 Ni -","- C56 Cu8 N48 Ni8 -","8","1","","Cernak, J.; Lipkowski, J.","Two polymorphs of Cu (tn) Ni (C N)4 containing tetracyanonickellate anions with triple bridging function: preparation and crystallographic characterization","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","1999","130","","1195","1206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520930","16.815","","9.606","","21.252","","90","","91.72","","90","","3431.18","","","","","","","","","","","","","5","I 1 2/c 1","-I 2yc","15","","(Cu (C3 H6 (N H2)2)) (Ni (C N)4)","","- C7 H10 Cu N6 Ni -","- C7 Cu N6 Ni -","- C56 Cu8 N48 Ni8 -","8","1","","Cernak, J.; Lipkowski, J.","Two polymorphs of Cu (tn) Ni (C N)4 containing tetracyanonickellate anions with triple bridging function: preparation and crystallographic characterization","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","1999","130","","1195","1206","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520935","4.1852","","4.1852","","9.1595","","90","","90","","90","","160.437","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Ce Cd O As","","- As Cd Ce O -","- As Cd Ce O -","- As2 Cd2 Ce2 O2 -","2","0.125","","Charkin, D.O.; Berdonosov, P.S.; Dolgikh, V.A.; Lightfoot, P.","Novel lanthanoid-cadmium oxide pnictides with the tetragonal La O Ag S structure","Journal of Alloys Compd.","1999","292","","118","123","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520936","3.914","","3.914","","20.8629","","90","","90","","90","","319.607","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Pb0.6 Bi1.4) Cs0.6 O2 Cl2","","- Bi1.4 Cl2 Cs0.6 O2 Pb0.6 -","- Bi1.4 Cl2 Cs0.6 O2 Pb0.6 -","- Bi2.8 Cl4 Cs1.2 O4 Pb1.2 -","2","0.0625","","Charkin, D.O.; Moisejev, A.M.; Berdonosov, P.S.; Lightfoot, P.; Shagiakhmetov, R.R.; Dolgikh, V.A.","A novel family of layered bismuth compounds. I. The crystal structures of Pb0.6 Bi1.4 Cs0.6 O2 Cl2 and Pb0.6 Bi3.4 Cs0.6 O4 Cl4","Journal of Solid State Chemistry","1999","147","","527","535","","","","","","","","","","","","","","","","","","","","","","has coordinates","140518","2020-10-21","18:00:00",""
"1520937","3.897","","3.897","","35.535","","90","","90","","90","","539.656","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Pb0.6 Bi3.4 Cs0.6 O4 Cl4","","- Bi3.4 Cl4 Cs0.6 O4 Pb0.6 -","- Bi3.4 Cl4 Cs0.6 O4 Pb0.6 -","- Bi6.8 Cl8 Cs1.2 O8 Pb1.2 -","2","0.0625","","Charkin, D.O.; Berdonosov, P.S.; Moisejev, A.M.; Shagiakhmetov, R.R.; Dolgikh, V.A.; Lightfoot, P.","A novel family of layered bismuth compounds. I. The crystal structures of Pb0.6 Bi1.4 Cs0.6 O2 Cl2 and Pb0.6 Bi3.4 Cs0.6 O4 Cl4","Journal of Solid State Chemistry","1999","147","","527","535","","","","","","","","","","","","","","","","","","","","","","has coordinates","140519","2020-10-21","18:00:00",""
"1520938","14.053","","8.304","","18.91","","90","","107.7","","90","","2102.26","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","K5.5 (H5 O2)0.5 Np (S O4)5 (H2 O)","","- H4.5 K5.5 Np O22 S5 -","- H4.5 K5.5 Np O22 S5 -","- H18 K22 Np4 O88 S20 -","4","1","","Charushnikova, I.A.; Krot, N.N.; Starikova, Z.A.","Crystal structure and spectroscopic properties of double potassium neptunium(IV) sulfate","Radiokhimiya","1999","41","","104","108","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520941","7.645","","8.768","","10.264","","91.97","","92.07","","103.05","","669.164","","","","","","","","","","","","","4","P -1","-P 1","2","","","","- Cs2 Cu2 Sb2 Se5 -","- Cs2 Cu2 Sb2 Se5 -","- Cs4 Cu4 Sb4 Se10 -","2","1","","Chen, Z.; Wang, R.-J.; Li, J.; Dilks, K.J.","Rb Cu1.2 Ag3.8 Se3 and Cs2 Cu2 Sb2 Se5 : novel quaternary intermetallics synthesized from superheated organic media","Journal of Solid State Chemistry","1999","147","","132","139","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1520942","12.4007","","12.4007","","3.903","","90","","90","","90","","600.193","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Ba4 Nd2 Ti4 Ta6 O30","","- Ba4 Nd2 O30 Ta6 Ti4 -","- Ba4.002 Nd1.998 O30 Ta6 Ti4 -","- Ba4.002 Nd1.998 O30 Ta6 Ti4 -","1","0.125","","Chen, X.M.; Lu, G.L.; Yang, J.S.; Wu, Y.J.","Some tungsten-bronze compounds in the Ba O - Nd2 O3 - Ti O2 Ta2 O5 system","Journal of Solid State Chemistry","1999","148","","438","441","","","","","","","","","","","","","","","","","","","","","","has coordinates","140527","2020-10-21","18:00:00",""
"1520943","12.4826","","12.4826","","3.9295","","90","","90","","90","","612.276","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Ba5 Nd Ti3 Ta7 O30","","- Ba5 Nd O30 Ta7 Ti3 -","- Ba4.998 Nd1.002 O30 Ta7 Ti3 -","- Ba4.998 Nd1.002 O30 Ta7 Ti3 -","1","0.125","","Chen, X.M.; Wu, Y.J.; Lu, G.L.; Yang, J.S.","Some tungsten-bronze compounds in the Ba O - Nd2 O3 - Ti O2 Ta2 O5 system","Journal of Solid State Chemistry","1999","148","","438","441","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520944","3.739","","3.739","","32.941","","90","","90","","120","","398.821","","","","","","","","","","","","Synthetic","3","R -3 m :H","-R 3 2""","166","","Cu4 Sn S6","Erazoite","- Cu4 S6 Sn -","- Cu3.978 S6 Sn0.9915 -","- Cu7.956 S12 Sn1.983 -","2","0.0555556","","Chen, X.-A.; Wada, H.; Sato, A.","Preparation, crystal structure and electrical properties of Cu4 Sn S6","Materials Research Bulletin","1999","34","","239","247","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:11:46",""
"1520945","7.758","","11.234","","8.849","","90","","106.6","","90","","739.078","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Rb (Hg Sb Se3)","","- Hg Rb Sb Se3 -","- Hg Rb Sb Se3 -","- Hg4 Rb4 Sb4 Se12 -","4","1","","Chen, Z.; Wang, R.-J.; Li, J.","New quaternary selenoantimonates A Hg Sb Se3 (A = Rb, Cs): synthesis, structures and optical properties","Materials Research Society Symposia Proceedings","1999","547","","419","424","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520946","10.89","","10.89","","10.89","","90","","90","","90","","1291.47","","","","","","","","","","","","","2","I m -3","-I 2 2 3","204","","Sm6 C60","","- C60 Sm6 -","- C60 Sm6 -","- C120 Sm12 -","2","0.0416667","","Chen, X.-H.; Liu, Z.S.; Li, S.Y.; Chi, D.Y.; Iwasa, Y.","Structure and properties of a fulleride Sm6 C60","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","6183","6186","","","","","","","","","","","","","","","","","","","","","","has coordinates","140531","2020-10-21","18:00:00",""
"1520962","7.38","","9.83","","5.509","","90","","90","","90","","399.653","","","","","","","","","","","","","3","P n a m","-P 2c 2n","62","","K2 (Cr O4)","","- Cr K2 O4 -","- Cr K2 O4 -","- Cr4 K8 O16 -","4","0.5","","Edwards, C.M.; Haines, J.; Butler, I.S.; Leger, J.M.","High pressure X-ray diffraction study of potassium chromate: pressure-induced orientational disorder and its implications for amorphization in A2 B X4 compounds","Journal of Physics and Chemistry of Solids","1999","60","","529","538","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520965","8.2896","","8.2896","","39.054","","90","","90","","120","","2324.15","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Fe (P3 Si O11)","","- Fe O11 P3 Si -","- Fe O11 P3 Si -","- Fe12 O132 P36 Si12 -","12","0.333333","","Elbouaanani, L.K.; Malaman, B.; Gerardin, R.","Synthesis, crystal structure, and magnetic properties of Fe P3 Si O11: first example of iron(III) silicophosphate","Journal of Solid State Chemistry","1999","147","","565","572","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520966","13.148","","19.076","","9.41","","90","","127","","90","","1884.89","","","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","Fe (P O3)3","","- Fe O9 P3 -","- Fe O9 P3 -","- Fe12 O108 P36 -","12","3","","Elbouaanani, L.K.; Malaman, B.; Gerardin, R.","Structure refinement and magnetic properties of C - Fe (P O3)3 studied by neutron diffraction and Mossbauer techniques","Journal of Solid State Chemistry","1999","148","","455","463","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520967","24.883","","24.883","","24.883","","90","","90","","90","","15406.7","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Ca18 Tl56 (Si100 Al92 O384)","","- Al92 Ca18 O384 Si100 Tl56 -","- Al91.9968 Ca18 O384 Si100.003 Tl56.0064 -","- Al91.9968 Ca18 O384 Si100.003 Tl56.0064 -","1","0.0104167","","Choi, E.-Y.; Kim, Y.","Two anhydrous zeolite X crystal structures, Ca18 Tl56 Si100 Al92 O384 and Ca32 Tl28 Si100 Al92 O384","Journal of the Korean Chemical Society","1999","43","","384","392","","","","","","","","","","","","","","","","","","","","","","has coordinates","140577","2020-10-21","18:00:00",""
"1520969","24.973","","24.973","","24.973","","90","","90","","90","","15574.4","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Ca32 Tl28 (Si100 Al92 O384)","","- Al92 Ca32 O384 Si100 Tl28 -","- Al91.9968 Ca32 O384 Si100.003 Tl27.9968 -","- Al91.9968 Ca32 O384 Si100.003 Tl27.9968 -","1","0.0104167","","Choi, E.-Y.; Kim, Y.","Two anhydrous zeolite X crystal structures, Ca18 Tl56 Si100 Al92 O384 and Ca32 Tl28 Si100 Al92 O384","Journal of the Korean Chemical Society","1999","43","","384","392","","","","","","","","","","","","","","","","","","","","","","has coordinates","140579","2020-10-21","18:00:00",""
"1520970","26.74","","31.581","","6.918","","90","","90","","90","","5842.08","","","","","","","","","","","","","6","F d d 2","F 2 -2d","43","","Na2 (Ru (N O) Cl5) (H2 O)6","","- Cl5 H12 N Na2 O7 Ru -","- Cl5 H12 N Na2 O7 Ru -","- Cl80 H192 N16 Na32 O112 Ru16 -","16","1","","Emel'yanov, V.A.; Gromilov, S.A.; Baidina, I.A.; Logvinenko, V.A.; Virovets, A.V.; Belyaev, A.V.","Synthesis and crystal structure of Na2 (Ru N O Cl2) . 6(H2 O)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1999","40","","1091","1100","","","","","","","","","","","","","","","","","","","","","","has coordinates","279148","2022-11-09","10:26:24",""
"1520971","11.488","","17.66119","","4.2201","","90","","90","","90","","856.223","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","K2 (Gd2 Sb2 Se9)","","- Gd2 K2 Sb2 Se9 -","- Gd2 K2 Sb2 Se9 -","- Gd4 K4 Sb4 Se18 -","2","0.25","","Choi, K.-S.; Hanko, J.A.; Kanatzidis, M.G.","Eightfold superstructure in K2 Gd2 Sb2 Se9 and K2 La2 Sb2 S9 caused by three-dimensional ordering of the 5s2 lone pair of Sb(3+) ions","Journal of Solid State Chemistry","1999","147","","309","319","","","","","","","","","","","","","","","","","","","","","","has coordinates","140581","2020-10-21","18:00:00",""
"1520972","11.208","","16.8781","","4.2419","","90","","90","","90","","802.439","","","","","","","","","","","","","4","P b a m","-P 2 2ab","55","","K2 (La2 Sb2 S9)","","- K2 La2 S9 Sb2 -","- K2 La2 S9 Sb2 -","- K4 La4 S18 Sb4 -","2","0.25","","Choi, K.-S.; Hanko, J.A.; Kanatzidis, M.G.","Eightfold superstructure in K2 Gd2 Sb2 Se9 and K2 La2 Sb2 S9 caused by three-dimensional ordering of the 5s2 lone pair of Sb(3+) ions","Journal of Solid State Chemistry","1999","147","","309","319","","","","","","","","","","","","","","","","","","","","","","has coordinates","140582","2020-10-21","18:00:00",""
"1520973","22.8783","","8.4062","","20.97","","90","","123.022","","90","","3381.47","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","K2 (Gd2 Sb2 Se9)","","- Gd2 K2 Sb2 Se9 -","- Gd2 K2 Sb2 Se9 -","- Gd16 K16 Sb16 Se72 -","8","1","","Choi, K.-S.; Kanatzidis, M.G.; Hanko, J.A.","Eightfold superstructure in K2 Gd2 Sb2 Se9 and K2 La2 Sb2 S9 caused by three-dimensional ordering of the 5s2 lone pair of Sb(3+)ions","Journal of Solid State Chemistry","1999","147","","309","319","","","","","","","","","","","","","","","","","","","","","","has coordinates","140583","2020-10-21","18:00:00",""
"1520974","9.845","","9.771","","9.897","","90","","102.8","","90","","928.388","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(N H4) (Fe2 (O H) (H2 O) (P O4)2) (H2 O)","","- Fe2 H9 N O11 P2 -","- Fe2 N O11 P2 -","- Fe8 N4 O44 P8 -","4","1","","Choudhury, A.; Natarajan, S.","A synthetic iron phosphate mineral, spheniscidite, (N H4)(+) (Fe2 (O H) (H2 O) (P O4)2)(-) (H2 O), exhibiting reversible dehydratation","Proceedings of the Indian Academy of Sciences, Serie: Chem. Sci.","1999","111","","627","637","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520980","3.8461","","3.8727","","27.2278","","90","","90","","90","","405.552","","","","","","","","","","","","","6","A m m m","-A 2 2","65","","(Y0.938 Ca0.073) (Ba1.962 Ca0.048) Cu1.988 (Cu1.949 Fe0.048) O8.429","","- Ba1.962 Ca0.121 Cu3.937 Fe0.048 O8.429 Y0.938 -","- Ba1.962 Ca0.121 Cu3.937 Fe0.048 O8.429 Y0.938 -","- Ba3.924 Ca0.242 Cu7.874 Fe0.096 O16.858 Y1.876 -","2","0.125","","Escamilla, R.; Marquina, V.; Gomez, R.; Akachi, T.; Ridaura, R.; Marquina, M.L.; Jimenez, M.","Estudio de la estructura cristalina para el sistema (Y1-x Cax) Ba2 (Cu1-x Fex)4 Od con z=0.1 y x=0.0125","Revista Mexicana de Fisico","1999","45","","64","65","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1520982","17.579","","17.509","","7.788","","90","","90","","90","","2397.07","","","","","","","","","","","","","4","C m m 2","C 2 -2","35","","Sr6 (Sn2 Nb8 O30)","","- Nb8 O30 Sn2 Sr6 -","- Nb7.9997 O30 Sn2.0003 Sr6 -","- Nb31.9988 O120 Sn8.0012 Sr24 -","4","0.5","","Fang, L.; Wu, B.-L.; Zhang, H.; Yuan, R.-Z.","Synthesis and crystal structure of a new compound Sr6 Sn2 Nb8 O30","Journal of Wuhan University of Technology","1999","14","","35","39","","","","","","","","","","","","","","","","","","","","","","has coordinates","140595","2020-10-21","18:00:00",""
"1520984","10.0692","","10.0692","","10.0692","","90","","90","","90","","1020.9","","","","","","","","","","","","","3","I a -3","-I 2b 2c 3","206","","Hf2 O N2","","- Hf2 N2 O -","- Hf2 N2.0001 O0.9999 -","- Hf32 N32.0016 O15.9984 -","16","0.333333","","Clarke, S.J.; Rosseinsky, M.J.; Michie, C.W.","Structure of Zr2 O N2 by neutron powder diffraction: the absence of nitride-oxide ordering","Journal of Solid State Chemistry","1999","146","","399","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520987","10.291","","10.291","","10.291","","54.645","","54.645","","54.645","","674.495","","","","","","","","","","","","","4","R -3 :R","-P 3*","148","","Cs2 Pb ((Ta Cl)6 Cl12)","","- Cl18 Cs2 Pb Ta6 -","- Cl18 Cs2 Pb Ta6 -","- Cl18 Cs2 Pb Ta6 -","1","0.166667","","Cordier, S.; Sergent, M.; Loisel, C.; Perrin, C.","Tantalum chlorides in octahedral cluster chemistry: the structures of Cs2 Pb Ta6 Cl18 and Cs Pb Ta6 Cl18","Journal of Solid State Chemistry","1999","147","","350","357","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520988","9.2673","","9.2673","","17.249","","90","","90","","120","","1282.92","","","","","","","","","","","","","4","P -3 1 c","-P 3 2c","163","","Cs Pb ((Ta Cl)6 Cl12)","","- Cl18 Cs Pb Ta6 -","- Cl18 Cs Pb Ta6 -","- Cl36 Cs2 Pb2 Ta12 -","2","0.166667","","Cordier, S.; Loisel, C.; Sergent, M.; Perrin, C.","Tantalum chlorides in octahedral cluster chemistry: the structures of Cs2 Pb Ta6 Cl18 and Cs Pb Ta6 Cl18","Journal of Solid State Chemistry","1999","147","","350","357","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520989","5.5334","","5.5334","","18.39069","","90","","90","","90","","563.096","","","","","","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","Li2 La0.889 (Nb1.5 Ti0.5) O7","","- La0.889 Li2 Nb1.5 O7 Ti0.5 -","- La0.888 Li2 Nb1.5 O7 Ti0.5 -","- La3.552 Li8 Nb6 O28 Ti2 -","4","0.25","","Crosnier-Lopez, M.P.; Duroy, H.; Fourquet, J.L.","Synthesis and crystal structure of new layered perovskite compounds: Li2 La0.833 (Nb1.5 Ti0.5) O7 and Li2 La2.25 (Nb1.25 Ti2.75) O13","Materials Research Bulletin","1999","34","","179","191","","","","","","","","","","","","","","","","","","","","","","has coordinates","140609","2020-10-21","18:00:00",""
"1520990","5.4915","","5.4915","","33.812","","90","","90","","90","","1019.65","","","","","","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","Li2 La2.25 (Nb1.25 Ti2.75) O13","","- La2.25 Li2 Nb1.25 O13 Ti2.75 -","- La2.25 Li2 Nb1.25 O13 Ti2.75 -","- La9 Li8 Nb5 O52 Ti11 -","4","0.25","","Crosnier-Lopez, M.P.; Fourquet, J.L.; Duroy, H.","Synthesis and crystal structure of new layered perovskite compounds: Li2 La0.833 (Nb1.5 Ti0.5) O7 and Li2 La2.25 (Nb1.25 Ti2.75) O13","Materials Research Bulletin","1999","34","","179","191","","","","","","","","","","","","","","","","","","","","","","has coordinates","140610","2020-10-21","18:00:00",""
"1520993","5.645","","5.645","","4.752","","90","","90","","120","","131.14","","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","Ba (Co O3)","","- Ba Co O3 -","- Ba Co O3 -","- Ba2 Co2 O6 -","2","0.166667","","Felser, C.; Yamaura, K.; Cava, R.J.","The electronic structure of hexagonal Ba Co O3","Journal of Solid State Chemistry","1999","146","","411","417","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520998","6.152","","16.214","","9.484","","90","","90","","90","","946.015","","","","","","","","","","","","","4","P m n n","-P 2n 2","58","","K Ni4 (P O4)3","","- K Ni4 O12 P3 -","- K Ni4 O12 P3 -","- K4 Ni16 O48 P12 -","4","0.5","","Daidouh, A.; Pico, C.; Veiga, M.L.","Structure features and ionic conductivity of the A M4 (P O4)3 orthophosphates: (A = Na, K, Rb; M = Ni, Mn)","Solid State Ionics","1999","124","","109","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1520999","6.45","","16.73","","9.87","","90","","90","","90","","1065.06","","","","","","","","","","","","","4","P m n n","-P 2n 2","58","","Rb Mn4 (P O4)3","","- Mn4 O12 P3 Rb -","- Mn4 O12 P3 Rb -","- Mn16 O48 P12 Rb4 -","4","0.5","","Daidouh, A.; Pico, C.; Veiga, M.L.","Structure features and ionic conductivity of the A M4 (P O4)3 orthophosphates: (A = Na, K, Rb; M = Ni, Mn)","Solid State Ionics","1999","124","","109","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521003","3.8532","","3.8532","","19.7463","","90","","90","","90","","293.176","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Nd (La Sr) Cu2 O6","","- Cu2 La Nd O6 Sr -","- Cu2 La Nd O6 Sr -","- Cu4 La2 Nd2 O12 Sr2 -","2","0.0625","","Deng, H.; Zhao, Z.-X.; Dong, C.; Chen, H.; Wu, F.; Jia, S.-L.; Shen, J.-C.","Structural refinement of RE2 A Cu2 O6 from powder X-ray diffraction data (RE = La, Nd, A = Sr, Ca)","Physica C (Amsterdam)","1999","313","","285","293","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521004","5.7428","","5.7428","","13.4372","","90","","90","","120","","383.784","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Pb Fe V5 O11","","- Fe O11 Pb V5 -","- Fe O11 Pb V5 -","- Fe2 O22 Pb2 V10 -","2","0.166667","","Dhaussy, A.C.; Mentre, O.; Abraham, F.; Calage, Y.","Site preference of Fe and V in Pb Fex V6-x O11 by neutron diffraction and Mossbauer spectroscopy : low temperature investigation for x=1.75","Journal of Solid State Chemistry","1999","147","","609","617","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521005","5.7413","","5.7413","","13.4626","","90","","90","","120","","384.309","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Pb Fe1.22 V4.78 O11","","- Fe1.22 O11 Pb V4.78 -","- Fe1.22 O11 Pb V4.78 -","- Fe2.44 O22 Pb2 V9.56 -","2","0.166667","","Dhaussy, A.C.; Mentre, O.; Abraham, F.; Calage, Y.","Site preference of Fe and V in Pb Fex V6-x O11 by neutron diffraction and Mossbauer spectroscopy : low temperature investigation for x=1.75","Journal of Solid State Chemistry","1999","147","","609","617","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521006","5.7414","","5.7414","","13.5094","","90","","90","","120","","385.658","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Pb Fe1.75 V4.25 O11","","- Fe1.75 O11 Pb V4.25 -","- Fe1.75 O11 Pb V4.25 -","- Fe3.5 O22 Pb2 V8.5 -","2","0.166667","","Dhaussy, A.C.; Mentre, O.; Abraham, F.; Calage, Y.","Site preference of Fe and V in Pb Fex V6-x O11 by neutron diffraction and Mossbauer spectroscopy : low temperature investigation for x=1.75","Journal of Solid State Chemistry","1999","147","","609","617","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521012","20.77499","","7.822","","6.963","","90","","90","","90","","1131.5","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","K5 (La0.95 Er0.05) Li2 F10","","- Er0.05 F10 K5 La0.95 Li2 -","- Er0.05 F10 K5 La0.95 Li2 -","- Er0.2 F40 K20 La3.8 Li8 -","4","0.5","","Dominiak-Dzik, G.; Hermanowicz, K.; Golab, S.; Baluka, M.; Pietraszko, A.","K5 La Li2 F10 : Er(3+) crystals. Growth, structure and optical properties","Journal of Physics: Condensed Matter","1999","11","","5245","5256","","","","","","","","","","","","","","","","","","","","","","has coordinates","140638","2020-10-21","18:00:00",""
"1521014","8.581","","8.581","","4.777","","90","","90","","90","","351.748","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Pr (Fe10.575 Mo1.25 C0.175) C0.055","","- C0.23 Fe10.575 Mo1.25 Pr -","- C0.2298 Fe10.5748 Mo1.25 Pr -","- C0.4596 Fe21.1496 Mo2.5 Pr2 -","2","0.0625","","Du Honglin; Cheng, B.-P.; Zhang, B.-S.; Xue, Y.-J.; Yang, J.-B.; Mao, W.-H.; Yang, Y.-C.","Neutron diffraction study on the crystal and magnetic structures of arc-melted Pr Fe10.5 Mo1.1 C0.4 alloy","JAERI Conf","1999","99","","38","40","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521015","4.163","","4.163","","22.554","","90","","90","","120","","338.507","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Ca Cu3.887 As2","","- As2 Ca Cu3.887 -","- As2 Ca Cu3.886 -","- As6 Ca3 Cu11.658 -","3","0.0833333","","Duenner, J.; Mewis, A.","Synthese und Kristallstruktur von A Cu4 As2 (A: Ca - Ba, Eu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","625","628","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521016","4.203","","4.203","","23.452","","90","","90","","120","","358.781","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Sr Cu4 As2","","- As2 Cu4 Sr -","- As2 Cu4 Sr -","- As6 Cu12 Sr3 -","3","0.0833333","","Duenner, J.; Mewis, A.","Synthese und Kristallstruktur von A Cu4 As2 (A: Ca - Ba, Eu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","625","628","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521017","4.183","","4.183","","23.154","","90","","90","","120","","350.859","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Eu Cu4 As2","","- As2 Cu4 Eu -","- As2 Cu4 Eu -","- As6 Cu12 Eu3 -","3","0.0833333","","Duenner, J.; Mewis, A.","Synthese und Kristallstruktur von A Cu4 As2 (A: Ca - Ba, Eu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","625","628","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521018","4.234","","4.234","","24.475","","90","","90","","120","","379.975","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Ba Cu4 As2","","- As2 Ba Cu4 -","- As2 Ba Cu4 -","- As6 Ba3 Cu12 -","3","0.0833333","","Duenner, J.; Mewis, A.","Synthese und Kristallstruktur von A Cu4 As2 (A: Ca - Ba, Eu)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","625","628","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521019","28.44","","7.322","","27.95","","90","","108.95","","90","","5504.8","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ba5 Cu2 Al3 F23","","- Al3 Ba5 Cu2 F23 -","- Al3 Ba5 Cu2 F23 -","- Al36 Ba60 Cu24 F276 -","12","3","","Dupont, N.; Gredin, P.; Caramanian, A.; de Kozak, A.","The crystal structure of Ba5 Cu2 Al3 F23: a complex barium, copper, aluminium fluoride, with copper(II) in trigonal prismatic environment","Journal of Solid State Chemistry","1999","147","","657","663","","","","","","","","","","","","","","","","","","","","","","has coordinates","140645","2020-10-21","18:00:00",""
"1521021","5.374","","7.312","","9.371","","90","","90.2","","90","","368.228","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ba2 (Cu Al F9)","","- Al Ba2 Cu F9 -","- Al Ba2 Cu F9 -","- Al2 Ba4 Cu2 F18 -","2","0.5","","Dupont, N.; Gredin, P.; Fouquet, S.; de Kozak, A.","The crystal structure of Ba2 Cu Al F9: a new structure type in copper fluoride chemistry","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1310","1314","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521023","16.7191","","6.0833","","5.9563","","90","","90","","90","","605.799","","","","","","","","","","","","","3","I m a 2","I 2 -2a","46","","","","- Ba2 In2 O5 -","- Ba2 In2 O5 -","- Ba8 In8 O20 -","4","0.5","","Fischer, W.; Reck, G.; Schober, T.","Structural transformation of the oxygen and proton conductor Ba2 In2 O5 in humid air: an in-situ X-ray powder diffraction study","Solid State Ionics","1999","116","","211","215","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521024","4.1827","","4.1827","","8.9617","","90","","90","","90","","156.785","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Ba2 In2 O5 (H2 O)","","- Ba2 H2 In2 O6 -","- Ba2 In2 O6 -","- Ba2 In2 O6 -","1","0.0625","","Fischer, W.; Reck, G.; Schober, T.","Structural transformation of the oxygen and proton conductor Ba2 In2 O5 in humid air: an in-situ X-ray powder diffraction study","Solid State Ionics","1999","116","","211","215","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521026","7.531","","9.24","","9.546","","98.07","","109.55","","102.19","","595.586","","","","","","","","","","","","","3","P 1","P 1","1","","Sr3 Te4 O11","","- O11 Sr3 Te4 -","- O11 Sr3 Te4 -","- O22 Sr6 Te8 -","2","2","","Dytyatev, O.A.; Dolgikh, V.A.","On the crystal structure of a new binary oxide Sr3 Te4 O11","Materials Research Bulletin","1999","34","","733","740","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521027","17.09","","6.163","","6.158","","90","","90","","90","","648.595","","","","","","","","","","","","","3","C m c a","-C 2ac 2","64","","Ba2 Pd F6","","- Ba2 F6 Pd -","- Ba2 F6 Pd -","- Ba8 F24 Pd4 -","4","","","de Nadai, C.; Demourgues, A.; Gravereau, P.; Grannec, J.","Crystal structure of new palladium fluorides A2 Pd F6 and A A' Pd F6 (A(2+) = Ba(2+), Sr(2+), Pb(2+))","Journal of Solid State Chemistry","1999","148","","242","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521030","16.872","","6.007","","6.014","","90","","90","","90","","609.52","","","","","","","","","","","","","4","C m c a","-C 2ac 2","64","","Ba Sr Pd F6","","- Ba F6 Pd Sr -","- Ba F6 Pd Sr -","- Ba4 F24 Pd4 Sr4 -","4","","","de Nadai, C.; Demourgues, A.; Grannec, J.; Gravereau, P.","Crystal structure of new palladium fluorides A2 Pd F6 and A A' Pd F6 (A(2+) = Ba(2+), Sr(2+), Pb(2+))","Journal of Solid State Chemistry","1999","148","","242","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521035","5.3636","","5.3636","","7.565","","90","","90","","90","","217.631","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Ca0.73 Sr0.27) (V O3)","","- Ca0.73 O3 Sr0.27 V -","- Ca0.73 O3 Sr0.27 V -","- Ca2.92 O12 Sr1.08 V4 -","4","0.125","","Garcia-Jaca, J.; Larramendi, J.I.R.; Insausti, M.; Mesa, J.L.; Arriortua, M.I.; Rojo, T.","Synthesis, crystal structure, stoichiometry and magnetic properties of (Ca1-x Srx) V O3","Materials Research Bulletin","1999","34","","289","301","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521039","3.8319","","3.8319","","3.8319","","90","","90","","90","","56.266","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Ca0.26 Sr0.74) (V O3)","","- Ca0.26 O3 Sr0.74 V -","- Ca0.26 O3 Sr0.74 V -","- Ca0.26 O3 Sr0.74 V -","1","0.0208333","","Garcia-Jaca, J.; Mesa, J.L.; Insausti, M.; Larramendi, J.I.R.; Arriortua, M.I.; Rojo, T.","Synthesis, crystal structure, stoichiometry and magnetic properties of (Ca1-x Srx) V O3","Materials Research Bulletin","1999","34","","289","301","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521040","5.3433","","7.5574","","5.3602","","90","","90","","90","","216.453","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Ca0.89 Sr0.11) (V O3)","","- Ca0.89 O3 Sr0.11 V -","- Ca0.89 O3 Sr0.11 V -","- Ca3.56 O12 Sr0.44 V4 -","4","0.5","","Garcia-Jaca, J.; Mesa, J.L.; Insausti, M.; Larramendi, J.I.R.; Arriortua, M.I.; Rojo, T.","Synthesis, crystal structure, stoichiometry and magnetic properties of (Ca1-x Srx) V O3","Materials Research Bulletin","1999","34","","289","301","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521046","5.3531","","7.5656","","5.3764","","90","","90","","90","","217.741","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Ca0.8 Sr0.2) (V O3)","","- Ca0.8 O3 Sr0.2 V -","- Ca0.8 O3 Sr0.2 V -","- Ca3.2 O12 Sr0.8 V4 -","4","0.5","","Garcia-Jaca, J.; Rojo, T.; Mesa, J.L.; Arriortua, M.I.; Insausti, M.; Larramendi, J.I.R.","Synthesis, crystal structure, stoichiometry and magnetic properties of (Ca1-x Srx) V O3","Materials Research Bulletin","1999","34","","289","301","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521048","5.3915","","5.3915","","7.6032","","90","","90","","90","","221.012","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","(Ca0.58 Sr0.42) (V O3)","","- Ca0.58 O3 Sr0.42 V -","- Ca0.58 O3 Sr0.42 V -","- Ca2.32 O12 Sr1.68 V4 -","4","0.125","","Garcia-Jaca, J.; Larramendi, J.I.R.; Insausti, M.; Mesa, J.L.; Arriortua, M.I.; Rojo, T.","Synthesis, crystal structure, stoichiometry and magnetic properties of (Ca1-x Srx) V O3","Materials Research Bulletin","1999","34","","289","301","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521049","4.034","","4.034","","14.604","","90","","90","","120","","205.814","","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","Ca3 Cu2 Zn2 P4","","- Ca3 Cu2 P4 Zn2 -","- Ca3 Cu2 P4 Zn2 -","- Ca3 Cu2 P4 Zn2 -","1","0.0833333","","Frik, L.; Mewis, A.","Stapelvarianten aus Sr Pt Sb - und Ca Al2 Si2 - analogen Baubloecken","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","126","130","","","","","","","","","","","","","","","","","","","","","","has coordinates","140680","2020-10-21","18:00:00",""
"1521051","9.538","","9.538","","24.66","","90","","90","","120","","1942.85","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Rb2 Mo12 Se14","","- Mo12 Rb2 Se14 -","- Mo12 Rb2 Se14 -","- Mo36 Rb6 Se42 -","3","0.166667","","Gautier, R.; Picard, S.; Gougeon, P.; Potel, M.","Synthesis, crystal and electronic structures, and electrical properties of Rb2 Mo12 Se14 containing trioctahedral Mo12 clusters","Materials Research Bulletin","1999","34","","93","101","","","","","","","","","","","","","","","","","","","","","","has coordinates","140682","2020-10-21","18:00:00",""
"1521053","4.15","","4.15","","15.21","","90","","90","","120","","226.859","","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","","Eu3 Cu2 Zn2 P4","","- Cu2 Eu3 P4 Zn2 -","- Cu2 Eu3 P4 Zn2 -","- Cu2 Eu3 P4 Zn2 -","1","0.0833333","","Frik, L.; Mewis, A.","Stapelvarianten aus Sr Pt Sb - und Ca Al2 Si2 - analogen Baubloecken","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","126","130","","","","","","","","","","","","","","","","","","","","","","has coordinates","140684","2020-10-21","18:00:00",""
"1521054","4.048","","4.048","","21.466","","90","","90","","120","","304.623","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ca2 Cu Zn2 P3","","- Ca2 Cu P3 Zn2 -","- Ca2 Cu P3 Zn2 -","- Ca4 Cu2 P6 Zn4 -","2","0.0833333","","Frik, L.; Mewis, A.","Stapelvarianten aus Sr Pt Sb - und Ca Al2 Si2 - analogen Baubloecken","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","126","130","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521055","4.041","","4.041","","37.06","","90","","90","","120","","524.1","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Ca4 Cu3 Zn2 P5","","- Ca4 Cu3 P5 Zn2 -","- Ca4 Cu3 P5 Zn2 -","- Ca8 Cu6 P10 Zn4 -","2","0.0833333","","Frik, L.; Mewis, A.","Stapelvarianten aus Sr Pt Sb - und Ca Al2 Si2 - analogen Baubloecken","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","126","130","","","","","","","","","","","","","","","","","","","","","","has coordinates","140688","2020-10-21","18:00:00",""
"1521056","9.979","","9.979","","19.644","","90","","90","","90","","1956.16","","","","","","","","","","","","","3","I 41/a c d :2","-I 4bd 2c","142","","Zn (N H2)2","","- H4 N2 Zn -","- H4 N2 Zn -","- H128 N64 Zn32 -","32","1","","Froehling, B.; Kreiner, G.; Jacobs, H.","Synthese und Kristallstruktur von Mangan(II)- und Zinkamid, Mn (N H2)2 und Zn (N H2)2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","211","216","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521057","10.185","","10.185","","20.349","","90","","90","","90","","2110.89","","","","","","","","","","","","","3","I 41/a c d :2","-I 4bd 2c","142","","Mn (N H2)2","","- H4 Mn N2 -","- H4 Mn N2 -","- H128 Mn32 N64 -","32","1","","Froehling, B.; Kreiner, G.; Jacobs, H.","Synthese und Kristallstruktur von Mangan(II)- und Zinkamid, Mn (N H2)2 und Zn (N H2)2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","211","216","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521058","7.7164","","10.3566","","10.4956","","113.963","","93.557","","107.616","","713.863","","","","","","","","","","","","","4","P -1","-P 1","2","","(N D4)4 D2 (Se O4)3","","- D18 N4 O12 Se3 -","- D18 N4 O12 Se3 -","- D36 N8 O24 Se6 -","2","1","","Fukami, T.; Chen, R.-H.","Refinement of crystal structures at room temperature and structural phase transitions for (N H4)4 H2 (Se O4)3 and (N D4)4 D2 (Se O4)3 crystals","Physica Status Solidi, Sectio B: Basic Research","1999","214","","219","227","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521059","6.2517","","8.7906","","6.2271","","90","","90","","90","","342.218","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ba (Ce O3)","","- Ba Ce O3 -","- Ba Ce O3 -","- Ba4 Ce4 O12 -","4","0.5","","Genet, F.; Loridant, S.; Ritter, C.; Lucazeau, G.","Phase transitions in Ba Ce O3 : neutron diffraction and Raman studies","Journal of Physics and Chemistry of Solids","1999","60","","2009","2021","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521062","24.47559","","6.7516","","5.4572","","90","","90","","90","","901.799","","","","","","","","","","","","","2","P n a 21","P 2c -2n","33","","","","- Mo4 O11 -","- Mo4 O11 -","- Mo16 O44 -","4","1","","Fun, H.-K.; Yang, P.; Sasaki, M.; Inoue, M.; Kadomatsu, H.","Rietveld refinement of the crystal structure of gamma-(Mo4 O11)","Powder Diffraction","1999","14","","284","288","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521063","6.2514","","6.2514","","6.2514","","60.11","","60.11","","60.11","","173.18","","","","","","","","","","","","","3","R -3 c :R","-P 3* 2n","167","","Ba (Ce O3)","","- Ba Ce O3 -","- Ba Ce O3 -","- Ba2 Ce2 O6 -","2","0.166667","","Genet, F.; Ritter, C.; Loridant, S.; Lucazeau, G.","Phase transitions in Ba Ce O3 : neutron diffraction and Raman studies","Journal of Physics and Chemistry of Solids","1999","60","","2009","2021","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521065","15.964","","4.5842","","9.532","","90","","94.366","","90","","695.548","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Be3 (P O4)2 (H2 O)2","","- Be3 H4 O10 P2 -","- Be3 H4 O10 P2 -","- Be12 H16 O40 P8 -","4","0.5","","Gier, T.E.; Bu Xianhui; Harrison, W.T.A.; Stucky, G.D.","Tetrahedral networks containing beryllium: syntheses and structures of Be3 (P O4)2 . 2(H2 O) and Be (H As O4) . (H2 O)","Journal of Solid State Chemistry","1999","146","","394","398","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521066","9.7471","","4.6794","","8.5929","","90","","90","","90","","391.927","","","","","","","","","","","","","4","P c a 21","P 2c -2ac","29","","Be (H As O4) (H2 O)","","- As Be H3 O5 -","- As Be O5 -","- As4 Be4 O20 -","4","1","","Gier, T.E.; Stucky, G.D.; Bu Xianhui; Harrison, W.T.A.","Tetrahedral networks containing beryllium: syntheses and structures of Be3 (P O4)2 . 2(H2 O) and Be (H As O4) . (H2 O)","Journal of Solid State Chemistry","1999","146","","394","398","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521071","10.521","","10.521","","16.866","","90","","90","","90","","1866.92","","","","","","","","","","","","","4","P 42/n m c :2","-P 4ac 2a","137","","((Pd (N H3)4)3 (Pd (N H3)3 Cl)2) Cl8","","- Cl10 H54 N18 Pd5 -","- Cl10 H52 N18 Pd5 -","- Cl20 H104 N36 Pd10 -","2","0.125","","Gromilov, S.A.; Virovets, A.V.; Baidina, I.A.; Tatarchuk, V.V.; Druzhinina, I.A.","Crystal structure of (Pd (N H3)4)3 (Pd (N H3)3 Cl)2 Cl8","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1999","40","","777","781","","","","","","","","","","","","","","","","","","","","","","has coordinates","186594","2020-10-21","18:00:00",""
"1521078","7.674","","3.881","","11.724","","90","","90","","90","","349.173","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Y Ba2 Cu3 O6.48","","- Ba2 Cu3 O6.48 Y -","- Ba2 Cu3 O6.485 Y -","- Ba4 Cu6 O12.97 Y2 -","2","0.25","","Grybos, J.; Wabia, M.; Guskos, N.; Kubanek, F.","Main- and superstructure by X-ray scattering for annealed single crystal of Y Ba2 Cu3 O6.5","Physica C (Amsterdam)","1999","320","","51","64","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521087","7.7878","","3.8349","","23.1521","","90","","90","","90","","691.448","","","","","","","","","","","","","4","B 2 m m","B -2 2","38","","Nd2 Ba Cu3 O6.995","","- Ba Cu3 Nd2 O6.995 -","- Ba Cu3 Nd2 O6.995 -","- Ba4 Cu12 Nd8 O27.98 -","4","0.5","","Goodilin, E.; Khasanova, N.; Tajima, S.; Wu, X.-J.; Kamiyama, T.; Shiohara, Y.; Izumi, F.","Phase diagram and structure-related studies of the Nd-rich Nd1+x Ba2-x Cu3 Oz solid solution","High Temperature Superconductor and Novel Inorganic Materials","1999","62","","145","150","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521088","8.651","","8.651","","4.83","","90","","90","","90","","361.476","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Pr Fe10.205 Mo1.795 N0.44","","- Fe10.205 Mo1.795 N0.44 Pr -","- Fe10.204 Mo1.796 N0.44 Pr -","- Fe20.408 Mo3.592 N0.88 Pr2 -","2","0.0625","","Gou, C.; Sun, K.; Cheng, Z.-X.; Zhang, B.-S.; Cheng, Y.-F.; Du Honglin","Neutron diffraction studies of the magnetic structure of rare earth- iron - rich permanent magnetic alloys and the crystallographic structure of D(H)LAP","Yuanzineng Kexue Jishu","1999","33","","515","520","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521089","3.7683","","3.7683","","13.259","","90","","90","","90","","188.279","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.8 K0.2) Cu O4","","- Cu K0.2 La1.8 O4 -","- Cu K0.2 La1.8 O4 -","- Cu2 K0.4 La3.6 O8 -","2","0.0625","","Guenther, W.; Paulus, W.; Schoellhorn, R.","Correlation between synthesis, stoichiometry, structure and superconductivity of La2-x Kx Cu O4-d","Physica C (Amsterdam)","1999","312","","61","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521090","7.108","","7.108","","7.108","","90","","90","","90","","359.122","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","((N H4) I)0.55 (K I)0.45","","- H2.2 I K0.45 N0.55 -","- H2.1984 I K0.45 N0.55 -","- H8.7936 I4 K1.8 N2.2 -","4","0.0208333","","Guethoff, F.; Ohl, M.; Reehuis, M.; Loidl, A.","Phase transitions and relaxation dynamics in (N H4 I)x (K I)1-x mixed crystals","Physik (Berlin)","1999","266","","310","320","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521091","5.513","","8.289","","5.307","","90","","96.22","","90","","241.088","","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","Te O F2","","- F2 O Te -","- F2 O Te -","- F8 O4 Te4 -","4","2","","Guillet, L.; Ider, A.; Laval, J.P.; Frit, B.","Crystal structure of Te O F2","Journal of Fluorine Chemistry","1999","93","","33","38","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521099","5.6","","5.98","","5.998","","90","","90","","90","","200.861","","","","","","","","","","","","","2","I b a m","-I 2 2c","72","","","","- Ag N3 -","- Ag N3 -","- Ag4 N12 -","4","0.25","","Guo, G.-C.; Wang, Q.-M.; Mak, T. C. W.","Structure refinement and Raman spectrum of silver azide","Journal of Chemical Crystallography","1999","29","5","561","564","10.1023/A:1009544702195","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521100","5.465","","5.45","","7.697","","90","","90","","90","","229.249","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Nd0.67 Sr0.33) (Mn O3)","","- Mn Nd0.67 O3 Sr0.33 -","- Mn Nd0.67 O3 Sr0.33 -","- Mn4 Nd2.68 O12 Sr1.32 -","4","0.5","","Guo, Y.-Q.; Liu, Y.-C.; Tao, K.; Zhou, H.-P.; Wappling, R.","The crystallographic and magnetoresistance of (Ca F2)doped Nd0.67 Sr0.33 Mn O3 compounds","Journal of Solid State Chemistry","1999","148","","236","241","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521102","5.459","","5.451","","7.695","","90","","90","","90","","228.98","","","","","","","","","","","","","6","P b n m","-P 2c 2ab","62","","(Nd0.653 Sr0.327 Ca0.02) Mn (O2.952 F0.035)","","- Ca0.02 F0.035 Mn Nd0.653 O2.952 Sr0.327 -","- Ca0.02 F0.034 Mn Nd0.653 O2.952 Sr0.328 -","- Ca0.08 F0.136 Mn4 Nd2.612 O11.808 Sr1.312 -","4","0.5","","Guo, Y.-Q.; Liu, Y.-C.; Zhou, H.-P.; Tao, K.; Wappling, R.","The crystallographic and magnetoresistance of (Ca F2)doped Nd0.67 Sr0.33 Mn O3 compounds","Journal of Solid State Chemistry","1999","148","","236","241","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521103","5.447","","5.451","","7.684","","90","","90","","90","","228.15","","","","","","","","","","","","","6","P b n m","-P 2c 2ab","62","","(Nd0.588 Sr0.295 Ca0.118) Mn (O2.745 F0.225)","","- Ca0.118 F0.225 Mn Nd0.588 O2.745 Sr0.295 -","- Ca0.117 F0.226 Mn Nd0.588 O2.744 Sr0.295 -","- Ca0.468 F0.904 Mn4 Nd2.352 O10.976 Sr1.18 -","4","0.5","","Guo, Y.-Q.; Zhou, H.-P.; Liu, Y.-C.; Tao, K.; Wappling, R.","The crystallographic and magnetoresistance of (Ca F2)doped Nd0.67 Sr0.33 Mn O3 compounds","Journal of Solid State Chemistry","1999","148","","236","241","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521104","5.433","","5.451","","7.671","","90","","90","","90","","227.179","","","","","","","","","","","","","6","P b n m","-P 2c 2ab","62","","(Nd0.553 Sr0.267 Ca0.20) Mn (O2.527 F0.355)","","- Ca0.2 F0.355 Mn Nd0.553 O2.527 Sr0.267 -","- Ca0.2 F0.356 Mn Nd0.553 O2.528 Sr0.267 -","- Ca0.8 F1.424 Mn4 Nd2.212 O10.112 Sr1.068 -","4","0.5","","Guo, Y.-Q.; Liu, Y.-C.; Zhou, H.-P.; Tao, K.; Wappling, R.","The crystallographic and magnetoresistance of (Ca F2)doped Nd0.67 Sr0.33 Mn O3 compounds","Journal of Solid State Chemistry","1999","148","","236","241","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521109","6.966","","11.455","","11.667","","87.677","","87.491","","79.083","","912.756","","","","","","","","","","","","","5","P -1","-P 1","2","","K8 Nd3 Si12 O32 (O H)","","- H K8 Nd3 O33 Si12 -","- K8 Nd3 O33 Si12 -","- K8 Nd3 O33 Si12 -","1","0.5","","Haile, S.M.; Wuensch, B.J.; Siegrist, T.","The structure and conductivity of K8 Nd3 Si12 O32 (O H): a layered silicate with paths for possible fast-ion conduction","Journal of Solid State Chemistry","1999","148","","406","418","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521114","5.6894","","8.0684","","5.6944","","90","","90","","90","","261.398","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Sr (Nb O3)","","- Nb O3 Sr -","- Nb O3 Sr -","- Nb4 O12 Sr4 -","4","0.5","","Hannerz, H.; Svensson, G.; D'yachenko, O.G.; Istomin, S.Ya.","Transmission electron microscopy and neutron powder diffraction studies of (Gd Fe O3)-type Sr Nb O3","Journal of Solid State Chemistry","1999","147","","421","428","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521119","11.3123","","9.552","","3.5858","","90","","90","","90","","387.464","","","","","","","","","","","","","3","P m n 21","P 2ac -2","31","","Li V2 O5","","- Li O5 V2 -","- Li O5 V2 -","- Li4 O20 V8 -","4","1","","Galy, J.; Millet, P.; Satto, C.; Sciau, P.","Atomic modeling of the delta - epsilon - (Li V2 O5) phase transition and simulation of the XRD powder pattern evolution","Journal of Solid State Chemistry","1999","146","","129","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521120","23.77","","5.1036","","18.1","","90","","94.491","","90","","2189.02","","","","","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","(C (N H2)3)2 (Zn4 (H P O4)5)","","- C2 H17 N6 O20 P5 Zn4 -","- C2 N6 O20 P5 Zn4 -","- C8 N24 O80 P20 Zn16 -","4","0.5","","Harrison, W.T.A.; Phillips, M.L.F.; Teat, S.J.; Clegg, W.","(C N3 H6)2 . Zn4 H5 (P O4)5, a new layered guanidinium zinc phosphate built up from 3-, 4-, and 8-ring units","Journal of Solid State Chemistry","1999","148","","433","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521121","9.6953","","9.6953","","9.2084","","90","","90","","120","","749.613","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Tm6 Re O12","","- O12 Re Tm6 -","- O12 Re Tm6 -","- O36 Re3 Tm18 -","3","0.166667","","Hartmann, T.; Ehrenberg, H.; Miehe, G.; Wltschek, G.; Fuess, H.","Preparation and characterization of rare earth rhenium oxides Ln6 Re O12, Ln = Ho, Er, Tm, Yb, Lu","Journal of Solid State Chemistry","1999","148","","220","223","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521122","9.083","","5.763","","4.532","","90","","90.3","","90","","237.226","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","V O2","","- O2 V -","- O2 V -","- O16 V8 -","8","1","","Galy, J.; Miehe, G.","Ab initio structures of (M2) and (M3) V O2","Solid State Sciences","1999","1","","433","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521123","24.5528","","24.5528","","24.5528","","90","","90","","90","","14801.4","","","","","","","","","","","","","5","F m -3 c","-F 4a 2 3","226","","Na94.75 (Al96 Si96 O384) (H2 O)39.17","","- Al96 H78.34 Na94.75 O423.17 Si96 -","- Al96 H78.336 Na94.752 O423.168 Si96 -","- Al96 H78.336 Na94.752 O423.168 Si96 -","1","0.00520833","","Hasegawa, K.; Nishibori, E.; Yu, J.; Sakata, M.; Takata, M.; Togashi, N.; Terasaki, O.","A synchrotron powder diffraction study of Na-LTA","Japanese Journal of Applied Physics, Part 1","1999","38","","65","68","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521124","4.506","","2.899","","4.617","","90","","91.79","","90","","60.282","","","","","","","","","","","","","2","P 1 2/m 1","-P 2y","10","","V O2","","- O2 V -","- O2 V -","- O4 V2 -","2","0.5","","Galy, J.; Miehe, G.","Ab initio structures of (M2) and (M3) V O2","Solid State Sciences","1999","1","","433","448","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521129","7.0433","","7.0433","","7.7826","","90","","90","","120","","334.355","","","","","","","","","","","","","4","P -6 2 c","P -6c -2c","190","","Tb Ni Al D0.303","","- Al D0.303 Ni Tb -","- Al D0.303333 Ni Tb -","- Al6 D1.82 Ni6 Tb6 -","6","0.5","","Hauback, B.C.; Fjellvag, H.; Palhaugen, L.; Yartys', V.A.; Yvon, K.","Crystal and magnetic structure of Tb Ni Al - based deuterides, Tb Ni Al D0.3 and Tb Ni Al D1.04, studied by neutron diffraction and synchrotron radiation","Journal of Alloys Compd.","1999","293","","178","184","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521131","3.8257","","12.4668","","7.2964","","90","","90","","90","","347.996","","","","","","","","","","","","","4","A m m 2","A 2 -2","38","","Tb Ni Al D1.04","","- Al D1.04 Ni Tb -","- Al D1.04 Ni Tb -","- Al6 D6.24 Ni6 Tb6 -","6","0.75","","Hauback, B.C.; Palhaugen, L.; Fjellvag, H.; Yartys', V.A.; Yvon, K.","Crystal and magnetic structure of Tb Ni Al - based deuterides, Tb Ni Al D0.3 and Tb Ni Al D1.04, studied by neutron diffraction and synchrotron radiation","Journal of Alloys Compd.","1999","293","","178","184","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521134","5.3297","","7.5665","","5.3511","","90","","90","","90","","215.795","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Ca0.81 Sr0.19) (V O3)","","- Ca0.81 O3 Sr0.19 V -","- Ca0.81 O3 Sr0.19 V -","- Ca3.24 O12 Sr0.76 V4 -","4","0.5","","Garcia-Jaca, J.; Mesa, J.L.; Insausti, M.; Larramendi, J.I.R.; Arriortua, M.I.; Rojo, T.","Synthesis, crystal structure, stoichiometry and magnetic properties of (Ca1-x Srx) V O3","Materials Research Bulletin","1999","34","","289","301","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521136","5.2432","","5.052","","8.8432","","90","","90","","90","","234.244","","","","","","","","","","","","","3","P 21 21 2","P 2 2ab","18","","Co (Te Mo O6)","","- Co Mo Te -","- Co Mo Te -","- Co2 Mo2 Te2 -","2","0.5","","Hayashi, H.; Kokawa, N.; Moriga, T.; Koto, K.; Sugiyama, S.","The Rietveld analysis of crystal structure of an additive telluromolybdate Co Te Mo O6","Journal of Molecular Catalysis","1999","145","","301","307","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521137","9.708","","9.708","","9.708","","90","","90","","90","","914.933","","","","","","","","","","","","","4","F -4 3 m","F -4 2 3","216","","Cu6 P S4.99 Br0.99","","- Br0.99 Cu6 P S4.99 -","- Br0.989 Cu6 P S4.989 -","- Br3.956 Cu24 P4 S19.956 -","4","0.0416667","","Haznar, A.; Pietraszko, A.; Studenyak, I.P.","X-ray study of the superionic phase transition in Cu6 P S5 Br","Solid State Ionics","1999","119","","31","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521138","9.73","","9.73","","9.73","","90","","90","","90","","921.167","","","","","","","","","","","","","4","F -4 3 m","F -4 2 3","216","","Cu6 P S4.98 Br0.98","","- Br0.98 Cu6 P S4.98 -","- Br0.98 Cu6 P S4.98 -","- Br3.92 Cu24 P4 S19.92 -","4","0.0416667","","Haznar, A.; Studenyak, I.P.; Pietraszko, A.","X-ray study of the superionic phase transition in Cu6 P S5 Br","Solid State Ionics","1999","119","","31","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521139","11.8147","","6.816","","11.92","","90","","109.391","","90","","905.455","","","","","","","","","","","","","4","C 1 c 1","C -2yc","9","","Cu6 P S5 Br","","- Br Cu6 P S5 -","- Br Cu6 P S5 -","- Br4 Cu24 P4 S20 -","4","1","","Haznar, A.; Pietraszko, A.; Studenyak, I.P.","X-ray study of the superionic phase transition in Cu6 P S5 Br","Solid State Ionics","1999","119","","31","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521140","6.778","","6.778","","12.74","","90","","90","","90","","585.292","","","","","","","","","","","","","2","I 41/a c d :2","-I 4bd 2c","142","","Na2 C2","","- C2 Na2 -","- C2 Na2 -","- C16 Na16 -","8","0.25","","Hemmersbach, S.; Zibrowius, B.; Ruschewitz, U.","Na2 C2 und K2 C2: Synthese, Kristallstruktur und spektroskopische Eigenschaften","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1440","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140796","2020-10-21","18:00:00",""
"1521141","7.569","","7.569","","14.521","","90","","90","","90","","831.905","","","","","","","","","","","","","2","I 41/a c d :2","-I 4bd 2c","142","","K2 C2","","- C2 K2 -","- C2 K2 -","- C16 K16 -","8","0.25","","Hemmersbach, S.; Zibrowius, B.; Ruschewitz, U.","Na2 C2 und K2 C2: Synthese, Kristallstruktur und spektroskopische Eigenschaften","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1440","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140798","2020-10-21","18:00:00",""
"1521142","6.756","","6.756","","6.756","","90","","90","","90","","308.368","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Na2 C2","","- C2 Na2 -","- C2 Na2 -","- C4 Na4 -","2","0.0104167","","Hemmersbach, S.; Zibrowius, B.; Ruschewitz, U.","Na2 C2 und K2 C2: Synthese, Kristallstruktur und spektroskopische Eigenschaften","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1440","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140801","2020-10-21","18:00:00",""
"1521143","7.553","","7.553","","7.553","","90","","90","","90","","430.882","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","K2 C2","","- C2 K2 -","- C2 K2 -","- C8 K8 -","4","0.0208333","","Hemmersbach, S.; Zibrowius, B.; Ruschewitz, U.","Na2 C2 und K2 C2: Synthese, Kristallstruktur und spektroskopische Eigenschaften","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1440","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","140803","2020-10-21","18:00:00",""
"1521144","6.0913","","6.0539","","8.5509","","90","","90.161","","90","","315.323","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ba2 Pr Nb O6","","- Ba2 Nb O6 Pr -","- Ba2 Nb O6 Pr -","- Ba4 Nb2 O12 Pr2 -","2","0.5","","Henmi, K.; Hinatsu, Y.; Masaki, N.M.","Crystal structures and magnetic properties of ordered perovskites Ba2 Ln Nb O6 (Ln = lanthanide elements)","Journal of Solid State Chemistry","1999","148","","353","360","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521145","6.507","","6.507","","6.507","","90","","90","","90","","275.513","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Mg2 Ni H4","","- H4 Mg2 Ni -","- H4.0008 Mg2 Ni -","- H16.0032 Mg8 Ni4 -","4","0.0208333","","Garcia, G.N.; Abriata, J.P.; Sofo, J.O.","Calculation of the electronic and structural properties of cubic Mg2 Ni H4","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","11746","11754","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521146","12.245","","12.245","","12.245","","90","","90","","90","","1836.02","","","","","","","","","","","","","7","P m -3 m","-P 4 2 3","221","","Cs3 Na8 H (Si12 Al12 O48) Xe2.5","","- Al12 Cs3 H Na8 O48 Si12 Xe2.5 -","- Al12 Cs3 Na8 O48 Si12 Xe2.4996 -","- Al12 Cs3 Na8 O48 Si12 Xe2.4996 -","1","0.0208333","","Heo, N.-H.; Lim, W.T.; Lee, S.Y.; Kim, B.J.; Seff, K.; Kim, M.C.","Crystal structures of encapsulates within zeolites. 3. Xenon in zeolite A","J. Phys. Chem. B","1999","103","","1881","1889","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521147","12.258","","12.258","","12.258","","90","","90","","90","","1841.87","","","","","","","","","","","","","7","P m -3 m","-P 4 2 3","221","","Cs3 Na8 H (Si12 Al12 O48) Xe4.5","","- Al12 Cs3 H Na8 O48 Si12 Xe4.5 -","- Al12 Cs3 Na8 O48 Si12 Xe4.5 -","- Al12 Cs3 Na8 O48 Si12 Xe4.5 -","1","0.0208333","","Heo, N.-H.; Lim, W.T.; Seff, K.; Kim, B.J.; Lee, S.Y.; Kim, M.C.","Crystal structures of encapsulates within zeolites. 3. Xenon in zeolite A","J. Phys. Chem. B","1999","103","","1881","1889","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521148","12.236","","12.236","","12.236","","90","","90","","90","","1831.97","","","","","","","","","","","","","7","P m -3 m","-P 4 2 3","221","","Cs3 Na8 H (Si12 Al12 O48) Xe5.25","","- Al12 Cs3 H Na8 O48 Si12 Xe5.25 -","- Al12 Cs3 Na8 O48 Si12 Xe5.2496 -","- Al12 Cs3 Na8 O48 Si12 Xe5.2496 -","1","0.0208333","","Heo, N.-H.; Lim, W.T.; Kim, B.J.; Kim, M.C.; Lee, S.Y.; Seff, K.","Crystal structures of encapsulates within zeolites. 3. Xenon in zeolite A","J. Phys. Chem. B","1999","103","","1881","1889","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521153","5.67921","","7.70305","","5.54104","","90","","90","","90","","242.405","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","La (Mn O3)","","- La Mn O3 -","- La Mn O3 -","- La4 Mn4 O12 -","4","0.5","","Hibble, S.J.; Cooper, S.P.; Hannon, A.C.; Fawcett, I.D.; Greenblatt, M.","Local distortions in the colossal magnetoresistive manganates La0.70 Ca0.30 Mn O3, La0.80 Ca0.20 Mn O3 and La0.70 Sr0.30 Mn O3 revealed by total neutron diffraction","Journal of Physics: Condensed Matter","1999","11","","9221","9238","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521154","5.45917","","7.71684","","5.47539","","90","","90","","90","","230.665","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(La0.7 Ca0.3) (Mn O3)","","- Ca0.3 La0.7 Mn O3 -","- Ca0.3 La0.7 Mn O3 -","- Ca1.2 La2.8 Mn4 O12 -","4","0.5","","Hibble, S.J.; Cooper, S.P.; Fawcett, I.D.; Hannon, A.C.; Greenblatt, M.","Local distortions in the colossal magnetoresistive manganates La0.70 Ca0.30 Mn O3, La0.80 Ca0.20 Mn O3 and La0.70 Sr0.30 Mn O3 revealed by total neutron diffraction","Journal of Physics: Condensed Matter","1999","11","","9221","9238","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521155","5.47967","","7.7495","","5.50384","","90","","90","","90","","233.719","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(La0.8 Ca0.2) (Mn O3)","","- Ca0.2 La0.8 Mn O3 -","- Ca0.2 La0.8 Mn O3 -","- Ca0.8 La3.2 Mn4 O12 -","4","0.5","","Hibble, S.J.; Fawcett, I.D.; Cooper, S.P.; Hannon, A.C.; Greenblatt, M.","Local distortions in the colossal magnetoresistive manganates La0.70 Ca0.30 Mn O3, La0.80 Ca0.20 Mn O3 and La0.70 Sr0.30 Mn O3 revealed by total neutron diffraction","Journal of Physics: Condensed Matter","1999","11","","9221","9238","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521156","5.503","","5.503","","13.34241","","90","","90","","120","","349.916","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(La0.7 Sr0.3) (Mn O3)","","- La0.7 Mn O3 Sr0.3 -","- La0.7 Mn O3 Sr0.3 -","- La4.2 Mn6 O18 Sr1.8 -","6","0.166667","","Hibble, S.J.; Cooper, S.P.; Fawcett, I.D.; Hannon, A.C.; Greenblatt, M.","Local distortions in the colossal magnetoresistive manganates La0.70 Ca0.30 Mn O3, La0.80 Ca0.20 Mn O3 and La0.70 Sr0.30 Mn O3 revealed by total neutron diffraction","Journal of Physics: Condensed Matter","1999","11","","9221","9238","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521168","7.73808","","9.58698","","16.58949","","90","","90","","90","","1230.69","","","","","","","","","","","","","3","P c a 21","P 2c -2ac","29","","(V O)2 (P2 O7)","","- O9 P2 V2 -","- O9 P2 V2 -","- O72 P16 V16 -","8","2","","Hiroi, Z.; Ikeda, T.; Azuma, M.; Saito, T.; Takano, M.; Fujishiro, Y.; Izumi, F.; Kamiyama, T.","Structural study of the quantum-spin chain compound (V O)2 P2 O7","Journal of Solid State Chemistry","1999","146","","369","379","","","","","","","","","","","","","","","","","","","","","","has coordinates","140835","2020-10-21","18:00:00",""
"1521174","10.4842","","10.4842","","10.4842","","90","","90","","90","","1152.41","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Cs (V O) (Te O4)","","- Cs O5 Te V -","- Cs O5.001 Te0.9996 V -","- Cs8 O40.008 Te7.9968 V8 -","8","0.0416667","","Hong, Y.-S.; Darriet, J.; Yoon, J.-B.; Choy, J.-H.","X-ray absorption near edge structure and x-ray diffraction studies of new cubic Cs V Te O5 and Cs V Te O6 compounds","Japanese Journal of Applied Physics, Part 1","1999","38","","1506","1509","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521179","9.128","","5.728","","7.436","","90","","90","","90","","388.793","","","","","","","","","","","","Synthetic","3","P n m a","-P 2ac 2n","62","","K (Mn O4)","Bahariyaite","- K Mn O4 -","- K Mn O4 -","- K4 Mn4 O16 -","4","0.5","","Hoppe, R.; Fischer, D.; Schneider, J.","Zur Kenntnis von Oxyden A (M O4): Ueber Li Mn O4, K Mn O4, Rb Mn O4, Cs Mn O4 sowie Rb I O4 und Cs I O4. (-Was heisst eigentlich ""Die Kristallstruktur von...""?-)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1135","1142","","","","","","","","","","","","","","","","","","","","","","has coordinates","303120","2025-10-31","16:25:09",""
"1521180","9.5411","","5.7392","","7.6363","","90","","90","","90","","418.151","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Rb (Mn O4)","","- Mn O4 Rb -","- Mn O4 Rb -","- Mn4 O16 Rb4 -","4","0.5","","Hoppe, R.; Fischer, D.; Schneider, J.","Zur Kenntnis von Oxyden A (M O4): Ueber Li Mn O4, K Mn O4, Rb Mn O4, Cs Mn O4 sowie Rb I O4 und Cs I O4. (-Was heisst eigentlich ""Die Kristallstruktur von...""?-)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1135","1142","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521181","10.063","","5.8012","","7.9435","","90","","90","","90","","463.721","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Cs (Mn O4)","","- Cs Mn O4 -","- Cs Mn O4 -","- Cs4 Mn4 O16 -","4","0.5","","Hoppe, R.; Fischer, D.; Schneider, J.","Zur Kenntnis von Oxyden A (M O4): Ueber Li Mn O4, K Mn O4, Rb Mn O4, Cs Mn O4 sowie Rb I O4 und Cs I O4. (-Was heisst eigentlich ""Die Kristallstruktur von...""?-)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1135","1142","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521182","5.863","","6.035","","14.377","","90","","90","","90","","508.704","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Cs (I O4)","","- Cs I O4 -","- Cs I O4 -","- Cs4 I4 O16 -","4","0.5","","Hoppe, R.; Fischer, D.; Schneider, J.","Zur Kenntnis von Oxyden A (M O4): Ueber Li Mn O4, K Mn O4, Rb Mn O4, Cs Mn O4 sowie Rb I O4 und Cs I O4. (-Was heisst eigentlich ""Die Kristallstruktur von...""?-)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1135","1142","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521183","5.9199","","5.9199","","13.042","","90","","90","","90","","457.06","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Rb (I O4)","","- I O4 Rb -","- I O4 Rb -","- I4 O16 Rb4 -","4","0.25","","Hoppe, R.; Fischer, D.; Schneider, J.","Zur Kenntnis von Oxyden A (M O4): Ueber Li Mn O4, K Mn O4, Rb Mn O4, Cs Mn O4 sowie Rb I O4 und Cs I O4. (-Was heisst eigentlich ""Die Kristallstruktur von...""?-)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1135","1142","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521187","5.5429","","5.5429","","13.4328","","90","","90","","120","","357.414","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","La (Ga O3)","","- Ga La O3 -","- Ga La O3 -","- Ga6 La6 O18 -","6","0.166667","","Howard, C.J.; Kennedy, B.J.","The orthorhombic and rhombohedral phases of La Ga O3 - a neutron powder diffraction study","Journal of Physics: Condensed Matter","1999","11","","3229","3236","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521193","9.273","","4.053","","10.38","","90","","90","","90","","390.116","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ba Cu2 S2 -","- Ba Cu2 S2 -","- Ba4 Cu8 S8 -","4","0.5","","Huster, J.; Bronger, W.","alpha- und beta-(Ba Cu2 X2) (X = S, Se) - Darstellung von Einkristallen in Kaliumchalkogenocyanat-Schmelzen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","2033","2040","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521194","9.595","","4.208","","10.773","","90","","90","","90","","434.968","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ba Cu2 Se2 -","- Ba Cu2 Se2 -","- Ba4 Cu8 Se8 -","4","0.5","","Huster, J.; Bronger, W.","alpha- und beta-(Ba Cu2 X2) (X = S, Se) - Darstellung von Einkristallen in Kaliumchalkogenocyanat-Schmelzen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","2033","2040","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521196","4.04","","4.04","","13.1855","","90","","90","","90","","215.208","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Ba Cu2 Se2 -","- Ba Cu2 Se2 -","- Ba2 Cu4 Se4 -","2","0.0625","","Huster, J.; Bronger, W.","alpha- und beta-(Ba Cu2 X2) (X = S, Se) - Darstellung von Einkristallen in Kaliumchalkogenocyanat-Schmelzen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","2033","2040","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521197","2.9763","","2.9763","","13.3503","","90","","90","","120","","102.418","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","H Cr O2","","- Cr H O2 -","- Cr H O2 -","- Cr3 H3 O6 -","3","0.0833333","","Ichikawa, M.; Gustafsson, T.; Tsuchida, T.; Olovsson, I.","Powder neutron-diffraction profile analysis of zero-dimensional H-bonded crystal H Cr O2","Journal of Physics and Chemistry of Solids","1999","60","","1875","1880","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521198","3.84897","","3.84897","","35.5352","","90","","90","","90","","526.439","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","Tl1.778 (Ba0.85 Sr0.15)2 Ca2 Cu3 O9.728","","- Ba1.7 Ca2 Cu3 O9.728 Sr0.3 Tl1.778 -","- Ba1.7 Ca2 Cu3 O9.728 Sr0.3 Tl1.778 -","- Ba3.4 Ca4 Cu6 O19.456 Sr0.6 Tl3.556 -","2","0.0625","","Idemoto, Y.; Izumi, F.; Huang, Q.; Matsuzawa, M.; Koura, N.; Santoro, A.","Effects of Sr substitution on the Tc and crystal structure of Tl2 (Ba1-x Srx)2 Ca2 Cu3 Oy","High Temperature Superconductor and Novel Inorganic Materials","1999","62","","129","132","","","","","","","","","","","","","","","","","","","","","","has coordinates","140877","2020-10-21","18:00:00",""
"1521199","3.84697","","3.84697","","35.4833","","90","","90","","90","","525.124","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","Tl1.772 (Ba0.80 Sr0.20)2 Ca2 Cu3 O9.752","","- Ba1.6 Ca2 Cu3 O9.752 Sr0.4 Tl1.772 -","- Ba1.6 Ca2 Cu3 O9.752 Sr0.4 Tl1.772 -","- Ba3.2 Ca4 Cu6 O19.504 Sr0.8 Tl3.544 -","2","0.0625","","Idemoto, Y.; Santoro, A.; Izumi, F.; Huang, Q.; Matsuzawa, M.; Koura, N.","Effects of Sr substitution on the Tc and crystal structure of Tl2 (Ba1-x Srx)2 Ca2 Cu3 Oy","High Temperature Superconductor and Novel Inorganic Materials","1999","62","","129","132","","","","","","","","","","","","","","","","","","","","","","has coordinates","140878","2020-10-21","18:00:00",""
"1521200","3.84615","","3.84615","","35.4424","","90","","90","","90","","524.295","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","Tl1.810 (Ba0.75 Sr0.25)2 Ca2 Cu3 O9.784","","- Ba1.5 Ca2 Cu3 O9.784 Sr0.5 Tl1.81 -","- Ba1.5 Ca2 Cu3 O9.784 Sr0.5 Tl1.81 -","- Ba3 Ca4 Cu6 O19.568 Sr Tl3.62 -","2","0.0625","","Idemoto, Y.; Izumi, F.; Santoro, A.; Huang, Q.; Matsuzawa, M.; Koura, N.","Effects of Sr substitution on the Tc and crystal structure of Tl2 (Ba1-x Srx)2 Ca2 Cu3 Oy","High Temperature Superconductor and Novel Inorganic Materials","1999","62","","129","132","","","","","","","","","","","","","","","","","","","","","","has coordinates","140880","2020-10-21","18:00:00",""
"1521201","15.059","","15.206","","9.005","","90","","90","","90","","2062.03","","","","","","","","","","","","","3","F d d 2","F 2 -2d","43","","Ba Te F6","","- Ba F6 Te -","- Ba F6 Te -","- Ba16 F96 Te16 -","16","1","","Ider, A.; Laval, J.P.; El Farissi, M.","Cationic ordering in tysonite type structures. I. Crystal structure of Ba Te F6","Journal of Fluorine Chemistry","1999","99","","161","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521202","6.62","","3.801","","7.643","","90","","90","","90","","192.318","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Sc0.85 Lu0.15) Mn Si","","- Lu0.15 Mn Sc0.85 Si -","- Lu0.15 Mn Sc0.85 Si -","- Lu0.6 Mn4 Sc3.4 Si4 -","4","0.5","","Ijjaali, I.; Malaman, B.; Welter, R.; Venturini, G.","Refinements of the Ti Ni Si - type R Mn Si (R = Tb, Lu, Sc) and Dy Co Si structures from single crystal X-ray diffraction","Journal of Alloys Compd.","1999","292","","4","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521203","6.82","","3.962","","7.839","","90","","90","","90","","211.816","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Lu Mn Si -","- Lu Mn Si -","- Lu4 Mn4 Si4 -","4","0.5","","Ijjaali, I.; Welter, R.; Malaman, B.; Venturini, G.","Refinements of the Ti Ni Si - type R Mn Si (R = Tb, Lu, Sc) and Dy Co Si structures from single crystal X-ray diffraction","Journal of Alloys Compd.","1999","292","","4","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521204","6.992","","4.086","","7.974","","90","","90","","90","","227.812","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Tb Mn Si","","- Mn Si Tb -","- Mn Si Tb -","- Mn4 Si4 Tb4 -","4","0.5","","Ijjaali, I.; Welter, R.; Malaman, B.; Venturini, G.","Refinements of the Ti Ni Si - type R Mn Si (R = Tb, Lu, Sc) and Dy Co Si structures from single crystal X-ray diffraction","Journal of Alloys Compd.","1999","292","","4","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521205","6.866","","4.158","","7.086","","90","","90","","90","","202.297","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Dy Co Si","","- Co Dy Si -","- Co Dy Si -","- Co4 Dy4 Si4 -","4","0.5","","Ijjaali, I.; Welter, R.; Venturini, G.; Malaman, B.","Refinements of the Ti Ni Si - type R Mn Si (R = Tb, Lu, Sc) and Dy Co Si structures from single crystal X-ray diffraction","Journal of Alloys Compd.","1999","292","","4","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521206","13.7258","","13.7258","","8.4031","","90","","90","","120","","1371.03","","","","","","","","","","","","","6","P 6 c c","P 6 -2c","184","","(Al (P O4)) ((C2 H5)3 N)0.0433","","- C0.2598 H0.6495 Al N0.0433 O4 P -","- C0.26 H0.65 Al N0.0433333 O4 P -","- C3.12 H7.8 Al12 N0.52 O48 P12 -","12","1","","Ikeda, T.; Miyazawa, K.; Huang, Q.; Izumi, F.; Santoro, A.","Structural study of the aluminophosphate (Al P O4)-5 by neutron powder diffraction","Journal of Physics and Chemistry of Solids","1999","60","","1531","1535","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521207","13.7711","","23.846","","8.3769","","90","","90","","90","","2750.85","","","","","","","","","","","","","3","P n n 2","P 2 -2n","34","","Al (P O4)","","- Al O4 P -","- Al O4 P -","- Al24 O96 P24 -","24","6","","Ikeda, T.; Izumi, F.; Miyazawa, K.; Santoro, A.; Huang, Q.","Structural study of the aluminophosphate (Al P O4)-5 by neutron powder diffraction","Journal of Physics and Chemistry of Solids","1999","60","","1531","1535","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521208","8.178","","9.7","","3.934","","90","","90","","90","","312.071","","","","","","","","","","","","","3","P n a m","-P 2c 2n","62","","Sb S Br","","- Br S Sb -","- Br S Sb -","- Br4 S4 Sb4 -","4","0.5","","Inushima, T.","X-ray study of crystal structure and diffuse scattering spectra of ferroelectric Sb S Br having pseudo-Jahn-Teller phase transition","Journal of Physics and Chemistry of Solids","1999","60","","587","598","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521209","9.3249","","5.4133","","9.3415","","90","","109.106","","90","","445.57","","","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","Zr V2 D1.94","","- D1.94 V2 Zr -","- D1.94 V2 Zr -","- D15.52 V16 Zr8 -","8","2","","Irodova, A.V.; Suard, E.","Evolution of hydrogen superstructure with k = (1/2,1/2,1/2) in Zr V2 D2+d, -0.8<d<0.2","Journal of Alloys Compd.","1999","291","","184","189","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521210","9.3564","","5.4265","","9.3709","","90","","109.205","","90","","449.306","","","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","Zr V2 D2.18","","- D2.18 V2 Zr -","- D2.179 V2 Zr -","- D17.432 V16 Zr8 -","8","2","","Irodova, A.V.; Suard, E.","Evolution of hydrogen superstructure with k = (1/2,1/2,1/2) in Zr V2 D2+d, -0.8<d<0.2","Journal of Alloys Compd.","1999","291","","184","189","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521211","9.2301","","5.3616","","9.2448","","90","","109.043","","90","","432.47","","","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","Hf V2 D1.922","","- D1.922 Hf V2 -","- D1.922 Hf V2 -","- D15.376 Hf8 V16 -","8","2","","Irodova, A.V.; Suard, E.","Evolution of hydrogen superstructure with k = (1/2,1/2,1/2) in Zr V2 D2+d, -0.8<d<0.2","Journal of Alloys Compd.","1999","291","","184","189","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521217","29.791","","29.873","","27.112","","90","","90","","90","","24128.2","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","(N H3) K3 C60","","- C60 H3 K3 N -","- C60 K3 N -","- C1920 K96 N32 -","32","1","","Ishii, K.; Iwasa, Y.; Watanuki, T.; Fujii, Y.; Fujiwara, A.; Mitani, T.; Suematsu, H.; Shimoda, H.; Murakami, Y.; Nakao, H.","Structural phase transition in the ammoniated alkali C60 compound (N H3) K3 C60","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","3956","3960","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521219","7.2835","","7.2185","","10.2281","","90","","90","","90","","537.752","","","","","","","","","","","","","3","P m n 21","P 2ac -2","31","","Cu8 Si Se6","","- Cu8 Se6 Si -","- Cu8 Se6 Si -","- Cu16 Se12 Si2 -","2","0.5","","Ishii, M.; Shibata, K.; Onoda, M.","Structure and vibrational spectra of argyrodite family compounds Cu8 Si X6 (X = S, Se) and Cu8 Ge S6","Solid State Ionics","1999","121","","11","18","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521220","3.5296","","3.5296","","10.5308","","90","","90","","90","","131.194","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Y0.918 Tb0.082) Ni2 B2 C","","- C B2 Ni2 Tb0.082 Y0.918 -","- C B2 Ni2 Tb0.082 Y0.918 -","- C2 B4 Ni4 Tb0.164 Y1.836 -","2","0.0625","","Jaenicke-Roessler, U.; Belger, A.; Zahn, G.; Bitterlich, H.; Wehner, B.; Paufler, P.","Structural studies with Tb Ni2 B2 C single crystals and Tbx Y1-x Ni2 B2 C polycrystals","Physica C (Amsterdam)","1999","314","","43","50","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521222","3.5354","","3.5354","","10.5086","","90","","90","","90","","131.348","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Y0.672 Tb0.328) Ni2 B2 C","","- C B2 Ni2 Tb0.328 Y0.672 -","- C B2 Ni2 Tb0.328 Y0.672 -","- C2 B4 Ni4 Tb0.656 Y1.344 -","2","0.0625","","Jaenicke-Roessler, U.; Belger, A.; Bitterlich, H.; Zahn, G.; Paufler, P.; Wehner, B.","Structural studies with Tb Ni2 B2 C single crystals and Tbx Y1-x Ni2 B2 C polycrystals","Physica C (Amsterdam)","1999","314","","43","50","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521224","3.5455","","3.5455","","10.4659","","90","","90","","90","","131.562","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Y0.302 Tb0.698) Ni2 B2 C","","- C B2 Ni2 Tb0.698 Y0.302 -","- C B2 Ni2 Tb0.698 Y0.302 -","- C2 B4 Ni4 Tb1.396 Y0.604 -","2","0.0625","","Jaenicke-Roessler, U.; Zahn, G.; Belger, A.; Wehner, B.; Bitterlich, H.; Paufler, P.","Structural studies with Tb Ni2 B2 C single crystals and Tbx Y1-x Ni2 B2 C polycrystals","Physica C (Amsterdam)","1999","314","","43","50","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521226","3.5507","","3.5507","","10.4467","","90","","90","","90","","131.706","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Y0.048 Tb0.952) Ni2 B2 C","","- C B2 Ni2 Tb0.952 Y0.048 -","- C B2 Ni2 Tb0.952 Y0.048 -","- C2 B4 Ni4 Tb1.904 Y0.096 -","2","0.0625","","Jaenicke-Roessler, U.; Belger, A.; Zahn, G.; Wehner, B.; Paufler, P.; Bitterlich, H.","Structural studies with Tb Ni2 B2 C single crystals and Tbx Y1-x Ni2 B2 C polycrystals","Physica C (Amsterdam)","1999","314","","43","50","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521228","3.54757","","3.54757","","10.4484","","90","","90","","90","","131.496","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Tb Ni2 B2 C","","- C B2 Ni2 Tb -","- C B2 Ni2 Tb -","- C2 B4 Ni4 Tb2 -","2","0.0625","","Jaenicke-Roessler, U.; Belger, A.; Zahn, G.; Wehner, B.; Bitterlich, H.; Paufler, P.","Structural studies with Tb Ni2 B2 C single crystals and Tbx Y1-x Ni2 B2 C polycrystals","Physica C (Amsterdam)","1999","314","","43","50","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521230","7.834","","20.176","","8.463","","90","","97.54","","90","","1326.08","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","(C (N H2)3)3 (Br3 (Bi Br3)2)","","- C3 H18 Bi2 Br9 N9 -","- C3 Bi2 Br9 N9 -","- C6 Bi4 Br18 N18 -","2","0.5","","Jakubas, R.; Zaleski, J.; Kosturek, B.; Bator, G.","Structure and phase transitions in the ferroelastic (C (N H2)3)3 Bi2 Br9 crystal","Journal of Physics: Condensed Matter","1999","11","","4731","4746","","","","","","","","","","","","","","","","","","","","","","has coordinates","140911","2020-10-21","18:00:00",""
"1521232","24.904","","24.904","","24.904","","90","","90","","90","","15445.7","","","","","","","","","","","","","6","F d -3 :2","-F 2uv 2vw 3","203","","(N H3)134.6 (Ca46 (Si100 Al92 O384))","","- Al92 Ca46 H403.8 N134.6 O384 Si100 -","- Al91.9968 Ca46 N134.602 O384 Si100.003 -","- Al91.9968 Ca46 N134.602 O384 Si100.003 -","1","0.0104167","","Jang, S.B.; Jeong, M.S.; Kim, Y.; Song, S.H.; Seff, K.","Crystal structure of an ammonia sorption complex of dehydrated fully Ca(2+)-exchanged zeolite X","Microporous and Mesoporous Materials","1999","28","","173","183","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521235","8.61","","8.61","","5.743","","90","","90","","90","","425.741","","","","","","","","","","","","","3","P 4/n :2","-P 4a","85","","Eu2 (Re O5)","","- Eu2 O5 Re -","- Eu2 O5 Re -","- Eu8 O20 Re4 -","4","0.5","","Jeitschko, W.; Heumannskaemper, D.H.; Schriewer-Poettgen, M.S.; Rodewald, U.C.","Preparation, crystal structures, and properties of rhenates with multiple Re - Re bonds: Ln2 Re O5 (Ln = Sm, Eu, Gd), Ln3 Re2 O9 (Ln = Pr, Nd, Sm), and Ln4 Re6 O19 (Ln = La Nd)","Journal of Solid State Chemistry","1999","147","","218","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521237","8.588","","8.588","","5.696","","90","","90","","90","","420.101","","","","","","","","","","","","","3","P 4/n :2","-P 4a","85","","Gd2 (Re O5)","","- Gd2 O5 Re -","- Gd2 O5 Re -","- Gd8 O20 Re4 -","4","0.5","","Jeitschko, W.; Heumannskaemper, D.H.; Rodewald, U.C.; Schriewer-Poettgen, M.S.","Preparation, crystal structures, and properties of rhenates with multiple Re - Re bonds: Ln2 Re O5 (Ln = Sm, Eu, Gd), Ln3 Re2 O9 (Ln= Pr, Nd, Sm), and Ln4 Re6 O19 (Ln = La - Nd)","Journal of Solid State Chemistry","1999","147","","218","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521238","5.518","","6.788","","10.867","","76.57","","75.56","","68.66","","362.605","","","","","","","","","","","","","3","P -1","-P 1","2","","Sm3 (Re2 O9)","","- O9 Re2 Sm3 -","- O9 Re2 Sm3 -","- O18 Re4 Sm6 -","2","1","","Jeitschko, W.; Rodewald, U.C.; Heumannskaemper, D.H.; Schriewer-Poettgen, M.S.","Preparation, crystal structures, and properties of rhenates with multiple Re - Re bonds: Ln2 Re O5 (Ln = Sm, Eu, Gd), Ln3 Re2 O9 (Ln= Pr, Nd, Sm), and Ln4 Re6 O19 (Ln = La - Nd)","Journal of Solid State Chemistry","1999","147","","218","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","140921","2020-10-21","18:00:00",""
"1521240","10.3807","","10.3807","","10.3807","","90","","90","","90","","1118.61","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Bi1.89 Ga Sb O6.84","","- Bi1.89 Ga O6.84 Sb -","- Bi1.89 Ga O6.84 Sb -","- Bi15.12 Ga8 O54.72 Sb8 -","8","0.0416667","","Ismunandar; Hunter, B.A.; Kennedy, B.J.","Observations on pyrochlore oxide structures","Materials Research Bulletin","1999","34","","1263","1274","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521242","10.4433","","10.4433","","10.4433","","90","","90","","90","","1138.97","","","","","","","","","","","","","4","F -4 3 m","F -4 2 3","216","","Pb2 (Ga0.5 Sb1.5) O6.5","","- Ga0.5 O6.5 Pb2 Sb1.5 -","- Ga0.5 O6.49 Pb1.98 Sb1.5 -","- Ga4 O51.92 Pb15.84 Sb12 -","8","0.0833333","","Ismunandar; Hunter, B.A.; Kennedy, B.J.","Observations on pyrochlore oxide structures","Materials Research Bulletin","1999","34","","1263","1274","","","","","","","","","","","","","","","","","","","","","","has coordinates","140926","2020-10-21","18:00:00",""
"1521243","10.5052","","10.5052","","10.5052","","90","","90","","90","","1159.35","","","","","","","","","","","","","4","F -4 3 m","F -4 2 3","216","","Pb2 (Ni0.333 Sb1.667) O6.5","","- Ni0.333 O6.5 Pb2 Sb1.667 -","- Ni0.334 O6.53 Pb2.01 Sb1.666 -","- Ni2.672 O52.24 Pb16.08 Sb13.328 -","8","0.0833333","","Ismunandar; Kennedy, B.J.; Hunter, B.A.","Observations on pyrochlore oxide structures","Materials Research Bulletin","1999","34","","1263","1274","","","","","","","","","","","","","","","","","","","","","","has coordinates","140928","2020-10-21","18:00:00",""
"1521244","14.6673","","5.5925","","5.1888","","90","","90","","90","","425.621","","","","","","","","","","","","","6","P b c n","-P 2n 2ab","60","","(Y0.96 Dy0.04) (Ti1.08 Nb0.92) O5.92 (O H)0.08","","- Dy0.04 H0.08 Nb0.92 O6 Ti1.08 Y0.96 -","- Dy0.04 Nb0.92 O6 Ti1.08 Y0.96 -","- Dy0.16 Nb3.68 O24 Ti4.32 Y3.84 -","4","0.5","","Johnsen, O.; Stahl, K.; Petersen, O.V.; Micheelsen, H.I.","Structure refinement of natural non-metamict polycrase-(Y) from Zomba-Malosa complex, Malawi","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","1999","1999","","1","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521245","14.6977","","14.6977","","14.6977","","90","","90","","90","","3175.03","","","","","","","","","","","","","5","I 2 3","I 2 2 3","197","","Na14.6 Cs8.17 (Al24 Ge24 O96)","","- Al24 Cs8.17 Ge24 Na14.6 O96 -","- Al24 Cs8.162 Ge24 Na14.6 O96 -","- Al24 Cs8.162 Ge24 Na14.6 O96 -","1","0.0416667","","Johnson, G.M.; Tripathi, A.; Parise, J.B.","Synthesis and structure of a microporous aluminogermanate with the zeolite rho topology","Microporous and Mesoporous Materials","1999","28","","139","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","140930","2020-10-21","18:00:00",""
"1521247","14.6737","","14.6737","","14.6737","","90","","90","","90","","3159.5","","","","","","","","","","","","","5","I 2 3","I 2 2 3","197","","Na14.86 Cs7.94 (Al24 Ge24 O96)","","- Al24 Cs7.94 Ge24 Na14.86 O96 -","- Al24 Cs7.946 Ge24 Na14.864 O96 -","- Al24 Cs7.946 Ge24 Na14.864 O96 -","1","0.0416667","","Johnson, G.M.; Tripathi, A.; Parise, J.B.","Synthesis and structure of a microporous aluminogermanate with the zeolite rho topology","Microporous and Mesoporous Materials","1999","28","","139","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","140932","2020-10-21","18:00:00",""
"1521249","25.589","","25.589","","25.589","","90","","90","","90","","16755.6","","","","","","","","","","","","","4","F d -3 :2","-F 2uv 2vw 3","203","","Na96 (Al96 Ge96 O384) (H2 O)438.08","","- Al96 Ge96 Na51.04 O822.08 -","- Al96 Ge96 Na51.04 O822.08 -","- Al96 Ge96 Na51.04 O822.08 -","1","0.0104167","","Johnson, G.M.; Parise, J.B.; Lee, Y.-J.; Tripathi, A.","Structural studies of hydrated germanium X-type zeolite via Rietveld analysis of synchrotron powder X-ray diffraction data","Microporous and Mesoporous Materials","1999","31","","195","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","140934","2020-10-21","18:00:00",""
"1521250","3.60388","","3.60388","","27.67189","","90","","90","","120","","311.251","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Zr N Cl","","- Cl N Zr -","- Cl N Zr -","- Cl6 N6 Zr6 -","6","0.166667","","Istomin, S.Ya.; Koehler, J.; Simon, A.","Crystal structure of beta-(Zr N Cl) refined from X-ray powder diffraction data, electronic band structures of beta-(Zr N Cl) and superconducting Lix Zr N Cl","Physica C (Amsterdam)","1999","319","","219","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521253","8.0946","","5.6758","","11.5674","","90","","90","","90","","531.445","","","","","","","","","","","","","4","P m c n","-P 2n 2a","62","","(Ca0.612 Sr0.388) Zr O3","","- Ca0.612 O3 Sr0.388 Zr -","- Ca0.6118 O3 Sr0.3882 Zr -","- Ca4.8944 O24 Sr3.1056 Zr8 -","8","1","","Joseph, J.; Sivasubramaniam, V.; Vimala, T.M.; Murthy, V.R.K.","Structural study on Ca0.6 Sr0.4 Zr O3","Japanese Journal of Applied Physics, Part 1","1999","38","","822","823","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521256","5.5642","","5.5642","","8.6363","","90","","90","","90","","267.383","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Ba2 Cu (W O6)","","- Ba2 Cu O6 W -","- Ba2 Cu O6 W -","- Ba4 Cu2 O12 W2 -","2","0.125","","Iwanaga, D.; Itoh, M.; Inaguma, Y.","Crystal structure and magnetic properties of B-site ordered perovskite-type oxides A2 Cu B' O6 (A = Ba, Sr; B'= W, Te)","Journal of Solid State Chemistry","1999","147","","291","295","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521258","5.429","","5.429","","8.4155","","90","","90","","90","","248.039","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Sr2 Cu (W O6)","","- Cu O6 Sr2 W -","- Cu O6 Sr2 W -","- Cu2 O12 Sr4 W2 -","2","0.125","","Iwanaga, D.; Inaguma, Y.; Itoh, M.","Crystal structure and magnetic properties of B-site ordered perovskite-type oxides A2 Cu B' O6 (A = Ba, Sr; B'= W, Te)","Journal of Solid State Chemistry","1999","147","","291","295","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521260","5.4308","","5.4308","","8.4664","","90","","90","","90","","249.705","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Sr2 Cu (Te O6)","","- Cu O6 Sr2 Te -","- Cu O6 Sr2 Te -","- Cu2 O12 Sr4 Te2 -","2","0.125","","Iwanaga, D.; Inaguma, Y.; Itoh, M.","Crystal structure and magnetic properties of B-site ordered perovskite-type oxides A2 Cu B' O6 (A = Ba, Sr; B'= W, Te)","Journal of Solid State Chemistry","1999","147","","291","295","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521262","5.5903","","5.5903","","8.6426","","90","","90","","90","","270.094","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Ba2 Cu (Te O6)","","- Ba2 Cu O6 Te -","- Ba2 Cu O6 Te -","- Ba4 Cu2 O12 Te2 -","2","0.125","","Iwanaga, D.; Itoh, M.; Inaguma, Y.","Crystal structure and magnetic properties of B-site ordered perovskite-type oxides A2 Cu B' O6 (A = Ba, Sr; B'= W, Te)","Journal of Solid State Chemistry","1999","147","","291","295","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521267","3.9247","","3.9247","","3.9247","","90","","90","","90","","60.453","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Ba0.256 Sr0.744) Ti O3","","- Ba0.256 O3 Sr0.744 Ti -","- Ba0.256 O3 Sr0.744 Ti -","- Ba0.256 O3 Sr0.744 Ti -","1","0.0208333","","Joseph, J.; Murthy, V.R.K.; Raju, J.; Vimala, T.M.","Structural investigations on the (Ba, Sr) (Zr, Ti) O3 system","Journal of Physics D, Applied Physics","1999","32","","1049","1057","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521268","3.9849","","3.9849","","3.9849","","90","","90","","90","","63.278","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","(Ba0.25 Sr0.749) (Zr0.283 Ti0.715) O3","","- Ba0.25 O3 Sr0.749 Ti0.715 Zr0.283 -","- Ba0.2496 O3 Sr0.7488 Ti0.7152 Zr0.2832 -","- Ba0.2496 O3 Sr0.7488 Ti0.7152 Zr0.2832 -","1","0.0208333","","Joseph, J.; Vimala, T.M.; Raju, J.; Murthy, V.R.K.","Structural investigations on the (Ba, Sr) (Zr, Ti) O3 system","Journal of Physics D, Applied Physics","1999","32","","1049","1057","","","","","","","","","","","","","","","","","","","","","","has coordinates","140955","2020-10-21","18:00:00",""
"1521269","4.0184","","4.0184","","4.0084","","90","","90","","90","","64.726","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(Ba0.272 Sr0.728) (Zr0.403 Ti0.597) O3","","- Ba0.272 O3 Sr0.728 Ti0.597 Zr0.403 -","- Ba0.272 O3 Sr0.728 Ti0.5968 Zr0.4032 -","- Ba0.272 O3 Sr0.728 Ti0.5968 Zr0.4032 -","1","0.0625","","Joseph, J.; Vimala, T.M.; Raju, J.; Murthy, V.R.K.","Structural investigations on the (Ba, Sr) (Zr, Ti) O3 system","Journal of Physics D, Applied Physics","1999","32","","1049","1057","","","","","","","","","","","","","","","","","","","","","","has coordinates","140956","2020-10-21","18:00:00",""
"1521270","5.7312","","5.6651","","8.1106","","90","","90","","90","","263.334","","","","","","","","","","","","","5","I b m m","-I 2c 2c","74","","(Ba0.262 Sr0.738) (Zr0.513 Ti0.487) O3","","- Ba0.262 O3 Sr0.738 Ti0.487 Zr0.513 -","- Ba0.2624 O3 Sr0.7376 Ti0.4872 Zr0.5128 -","- Ba1.0496 O12 Sr2.9504 Ti1.9488 Zr2.0512 -","4","0.25","","Joseph, J.; Vimala, T.M.; Raju, J.; Murthy, V.R.K.","Structural investigations on the (Ba, Sr) (Zr, Ti) O3 system","Journal of Physics D, Applied Physics","1999","32","","1049","1057","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521271","5.7731","","5.727","","8.0968","","90","","90","","90","","267.701","","","","","","","","","","","","","5","I b m m","-I 2c 2c","74","","(Ba0.273 Sr0.727) (Zr0.656 Ti0.344) O3","","- Ba0.273 O3 Sr0.727 Ti0.344 Zr0.656 -","- Ba0.2728 O3 Sr0.7272 Ti0.344 Zr0.656 -","- Ba1.0912 O12 Sr2.9088 Ti1.376 Zr2.624 -","4","0.25","","Joseph, J.; Raju, J.; Vimala, T.M.; Murthy, V.R.K.","Structural investigations on the (Ba, Sr) (Zr, Ti) O3 system","Journal of Physics D, Applied Physics","1999","32","","1049","1057","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521272","5.8241","","5.778","","8.1622","","90","","90","","90","","274.671","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(Ba0.27 Sr0.729) (Zr0.802 Ti0.202) O3","","- Ba0.27 O3 Sr0.729 Ti0.202 Zr0.802 -","- Ba0.2696 O3 Sr0.7288 Ti0.2024 Zr0.8018 -","- Ba1.0784 O12 Sr2.9152 Ti0.8096 Zr3.2072 -","4","0.5","","Joseph, J.; Vimala, T.M.; Murthy, V.R.K.; Raju, J.","Structural investigations on the (Ba, Sr) (Zr, Ti) O3 system","Journal of Physics D, Applied Physics","1999","32","","1049","1057","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521273","5.838","","5.8025","","8.1972","","90","","90","","90","","277.68","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(Ba0.269 Sr0.731) (Zr0.901 Ti0.099) O3","","- Ba0.269 O3 Sr0.731 Ti0.099 Zr0.901 -","- Ba0.269 O3 Sr0.731 Ti0.0992 Zr0.9008 -","- Ba1.076 O12 Sr2.924 Ti0.3968 Zr3.6032 -","4","0.5","","Joseph, J.; Vimala, T.M.; Raju, J.; Murthy, V.R.K.","Structural investigations on the (Ba, Sr) (Zr, Ti) O3 system","Journal of Physics D, Applied Physics","1999","32","","1049","1057","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521274","5.8412","","5.8463","","8.2485","","90","","90","","90","","281.681","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(Ba0.267 Sr0.733) (Zr0.979 Ti0.021) O3","","- Ba0.267 O3 Sr0.733 Ti0.021 Zr0.979 -","- Ba0.2672 O3 Sr0.7328 Ti0.0208 Zr0.9792 -","- Ba1.0688 O12 Sr2.9312 Ti0.0832 Zr3.9168 -","4","0.5","","Joseph, J.; Vimala, T.M.; Raju, J.; Murthy, V.R.K.","Structural investigations on the (Ba, Sr) (Zr, Ti) O3 system","Journal of Physics D, Applied Physics","1999","32","","1049","1057","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521291","5.8404","","11.7057","","8.1751","","90","","90","","90","","558.899","","","","","","","","","","","","","3","P b a m","-P 2 2ab","55","","Pb (Hf O3)","","- Hf O3 Pb -","- Hf O3 Pb -","- Hf8 O24 Pb8 -","8","1","","Madigou, V.; Nihoul, G.; Bouree, F.; Baudour, J.L.; Favotto, C.; Roubin, M.","Crystallographic structure of lead hafnate (Pb Hf O3) from neutron powder diffraction and electron microscopy","Philosophical Magazine, Part A","1999","79","","847","858","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521294","10.032","","10.032","","10.032","","90","","90","","90","","1009.63","","","","","","","","","","","","","6","F m -3 m","-F 4 2 3","225","","(Cu3 (Co (C N)6)2)1.333 (H2 O)15.333","","- C15.996 H30.666 Co2.666 Cu3.999 N15.996 O15.333 -","- C16.0008 Co2.6668 Cu4 N16.0008 O15.3316 -","- C16.0008 Co2.6668 Cu4 N16.0008 O15.3316 -","1","0.00520833","","Malecki, G.; Ratuszna, A.","Crystal structure of cyanometallates Me3 (Co (C N)6)2 and K Me (Fe (C N)6) with Me = Mn(2+), Ni(2+), Cu(2+)","Powder Diffraction","1999","14","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","141026","2020-10-21","18:00:00",""
"1521295","10.413","","10.413","","10.413","","90","","90","","90","","1129.09","","","","","","","","","","","","","6","F m -3 m","-F 4 2 3","225","","(Mn3 (Co (C N)6)2)1.333 (H2 O)15.333","","- C15.996 H30.666 Co2.666 Mn3.999 N15.996 O15.333 -","- C16.0008 Co2.6668 Mn4 N16.0008 O15.3316 -","- C16.0008 Co2.6668 Mn4 N16.0008 O15.3316 -","1","0.00520833","","Malecki, G.; Ratuszna, A.","Crystal structure of cyanometallates Me3 (Co (C N)6)2 and K Me (Fe (C N)6) with Me = Mn(2+), Ni(2+), Cu(2+)","Powder Diffraction","1999","14","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","141027","2020-10-21","18:00:00",""
"1521296","10.108","","10.104","","10.114","","90","","92.93","","90","","1031.6","","","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","K Mn (Fe (C N)6) (H2 O)","","- C6 H2 Fe K Mn N6 O -","- C6 Fe K Mn N6 O -","- C24 Fe4 K4 Mn4 N24 O4 -","4","1","","Malecki, G.; Ratuszna, A.","Crystal structure of cyanometallates Me3 (Co (C N)6)2 and K Me (Fe (C N)6) with Me = Mn(2+), Ni(2+), Cu(2+)","Powder Diffraction","1999","14","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521297","8.28187","","8.28187","","8.28187","","90","","90","","90","","568.048","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Co (Co1.108 Ru0.892) O4","","- Co2.108 O4 Ru0.892 -","- Co2.108 O4 Ru0.892 -","- Co16.864 O32 Ru7.136 -","8","0.0416667","","Mandrus, D.; Keppens, V.; Chakoumakos, B.C.","Spin-glass formation in Co2 Ru O4","Materials Research Bulletin","1999","34","","1013","1022","","","","","","","","","","","","","","","","","","","","","","has coordinates","141030","2020-10-21","18:00:00",""
"1521298","8.638","","8.638","","4.837","","90","","90","","90","","360.913","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Pr Fe10.844 V1.156 N0.43","","- Fe10.844 N0.43 Pr V1.156 -","- Fe10.844 N0.428 Pr V1.156 -","- Fe21.688 N0.856 Pr2 V2.312 -","2","0.0625","","Mao, W.-H.; Xue, Y.-J.; Zhang, X.-D.; Cheng, B.-P.; Du Honglin; Ji, C.-G.; Zhang, B.-S.; Yang, Y.-C.","Neutron diffraction studies of Pr (Fe, V)12 and Pr (Fe, V)12 Nx","Journal of Physics: Condensed Matter","1999","11","","2487","2492","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521303","11.9515","","11.9515","","22.8949","","90","","90","","90","","3270.27","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Ba9 Pr6 O Br34","","- Ba9 Br34 O Pr6 -","- Ba9 Br34 Pr6 -","- Ba18 Br68 Pr12 -","2","0.125","","Masselmann, S.; Meyer, G.","Die Polyeder-Cluster ((M6 Z) Br36) in den bromiden Ba8 ((M6 Z) Br32) und Ba9 ((M6 Z) Br34)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1","2","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521306","8.014","","8.014","","13.867","","90","","90","","90","","890.597","","","","","","","","","","","","","4","I 4/m c m","-I 4 2c","140","","","","- Ba La2 Mn S5 -","- Ba0.999 La2.001 Mn S5 -","- Ba3.996 La8.004 Mn4 S20 -","4","0.125","","Masuda, H.; Fujino, T.; Yamada, K.; Sato, N.","Crystal structure and electrical properties of new quaternary manganese mixed sulfide, Ba La2 Mn S5","Kidorui","1999","34","","114","115","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521308","5.142","","5.142","","8.104","","90","","90","","120","","185.564","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Zr Mn6 Ge6","","- Ge6 Mn6 Zr -","- Ge6 Mn6 Zr -","- Ge6 Mn6 Zr -","1","0.0416667","","Mazet, T.; Welter, R.; Venturini, G.; Ressouche, E.; Malaman, B.","Neutron diffraction study of the Zr Mn6 Ge6, Lu Mn6 Ge6 and Sc Mn6 Ge6 compounds","Solid State Communications","1999","110","","407","412","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521309","5.215","","5.215","","8.14","","90","","90","","120","","191.718","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Lu Mn6 Ge6","","- Ge6 Lu Mn6 -","- Ge6 Lu Mn6 -","- Ge6 Lu Mn6 -","1","0.0416667","","Mazet, T.; Welter, R.; Malaman, B.; Ressouche, E.; Venturini, G.","Neutron diffraction study of the Zr Mn6 Ge6, Lu Mn6 Ge6 and Sc Mn6 Ge6 compounds","Solid State Communications","1999","110","","407","412","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521310","5.161","","5.161","","8.076","","90","","90","","120","","186.292","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Sc Mn6 Ge6","","- Ge6 Mn6 Sc -","- Ge6 Mn6 Sc -","- Ge6 Mn6 Sc -","1","0.0416667","","Mazet, T.; Welter, R.; Malaman, B.; Venturini, G.; Ressouche, E.","Neutron diffraction study of the Zr Mn6 Ge6, Lu Mn6 Ge6 and Sc Mn6 Ge6 compounds","Solid State Communications","1999","110","","407","412","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521312","3.83841","","3.83841","","11.5731","","90","","90","","90","","170.511","","","","","","","","","","","","","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.; Fitch, A.N.; Zhou, W.; Tallon, J.L.; Attfield, J.P.","Structure and microstructure of the ferromagnetic superconductor Ru Sr2 Gd Cu2 O8","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","7512","7516","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521313","9.1878","","9.1878","","9.1878","","68.458","","68.458","","68.458","","646.373","","","","","","","","","","","","","4","R -3 :R","-P 3*","148","","La2 Ti10.26 Ga9.63 O38","","- Ga9.63 La2 O38 Ti10.26 -","- Ga9.64 La2 O38 Ti10.26 -","- Ga9.64 La2 O38 Ti10.26 -","1","0.166667","","Meden, A.; Skapin, S.; Kolar, D.","Crystal structure and powder data of davidite-type La2 Ti10.27 Ga9.63 O38","Powder Diffraction","1999","14","","36","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521316","18.334","","18.606","","6.602","","90","","90","","90","","2252.09","","","","","","","","","","","","","6","F d d 2","F 2 -2d","43","","Na15.62 K0.46 Al16 Si24 O80 (H2 O)15.36","","- Al16 H30.72 K0.46 Na15.62 O95.36 Si24 -","- Al16 H30.72 K0.464 Na15.616 O95.36 Si24 -","- Al16 H30.72 K0.464 Na15.616 O95.36 Si24 -","1","0.0625","","Meneghinello, E.; Martucci, A.; di Renzo, F.; Alberti, A.","Structural refinement of a K-rich natrolite : evidence of a new extraframework cation site","Microporous and Mesoporous Materials","1999","30","","89","94","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521317","15.523","","6.0671","","10.46","","90","","102.74","","90","","960.866","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(Rb1.62 (N H4)1.38) H (Se O4)2","","- H6.52 N1.38 O8 Rb1.62 Se2 -","- H N1.38 O8 Rb1.62 Se2 -","- H4 N5.52 O32 Rb6.48 Se8 -","4","0.5","","Merinov, B.V.; Synitsyn, V.V.; Bismayer, U.; Baranov, A.I.","Mixed alkali metal selenate proton conductors: phase transitions and crystal structure of (Rb0.54 (N H4)0.46)3 H (Se O4)2","Phase Transition","1999","69","","439","453","","","","","","","","","","","","","","","","","","","","","","has coordinates","141058","2020-10-21","18:00:00",""
"1521318","5.84","","9.063","","4.987","","90","","90","","90","","263.952","","","","","","","","","","","","","5","P m n 21","P 2ac -2","31","","(N H4) Mn (As O4) (H2 O)","","- As H6 Mn N O5 -","- As Mn N O5 -","- As2 Mn2 N2 O10 -","2","0.5","","Mesa, J.L.; Pizarro, J.L.; Lezama, L.; Goni, A.; Arriortua, M.I.; Rojo, T.","Hydrothermal synthesis and structural, spectroscopic, and magnetic studies of the N H4 Mn (As O4) . (H2 O) arsenate type dittmarite","Materials Research Bulletin","1999","34","","1545","1555","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521319","9.4444","","5.4493","","8.8085","","90","","90","","90","","453.333","","","","","","","","","","","","","4","P c m n","-P 2n 2ac","62","","Li Cs (S O4)","","- Cs Li O4 S -","- Cs Li O4 S -","- Cs4 Li4 O16 S4 -","4","0.5","","Mestres, L.; Simkin, V.G.; Baccali, A.; Martinez-Sarrion, M.L.; Smirnov, L.S.; Balagurov, A.M.","X-ray and neutron powder diffraction studies of phase transitions in Li Cs S O4","Kristallografiya","1999","44","","83","88","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521320","11.4","","7.3","","2.73","","90","","90","","90","","227.191","","","","","","","","","","","","","2","F 2 2 2","F 2 2","22","","","","- Cu O2 -","- Cu O2 -","- Cu4 O8 -","4","0.25","","Migliori, A.; Gemmi, M.; Calestani, G.; Dionigi, C.; Belletti, D.; Nozar, P.; Matacotta, F.C.","Structure determination by electron diffraction and HREM of the incommensurate modulated phase Bax Cu O2 (0.67 < x < 0.70)","Physica C (Amsterdam)","1999","328","","89","103","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521321","5.7","","7.3","","3.91","","90","","90","","90","","162.695","","","","","","","","","","","","","1","A m m m","-A 2 2","65","","","","- Ba -","- Ba -","- Ba2 -","2","0.125","","Migliori, A.; Gemmi, M.; Belletti, D.; Calestani, G.; Nozar, P.; Matacotta, F.C.; Dionigi, C.","Structure determination by electron diffraction and HREM of the incommensurate modulated phase Bax Cu O2 (0.67 < x < 0.70)","Physica C (Amsterdam)","1999","328","","89","103","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521322","5.5471","","5.5471","","7.6498","","90","","90","","90","","235.387","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Y Ba Mn2 O5","","- Ba Mn2 O5 Y -","- Ba Mn2 O5 Y -","- Ba2 Mn4 O10 Y2 -","2","0.125","","Millange, F.; Suard, E.; Caignaert, V.; Raveau, B.","Y Ba Mn2 O5 : crystal and magnetic structure reinvestigation","Materials Research Bulletin","1999","34","","1","9","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521323","3.82428","","3.82428","","12.4283","","90","","90","","90","","181.765","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","La Sr Ni O3.914","","- La Ni O3.914 Sr -","- La Ni O3.914 Sr -","- La2 Ni2 O7.828 Sr2 -","2","0.0625","","Millburn, J.E.; Rosseinsky, M.J.; Green, M.A.; Neumann, D.A.","Evolution of the structure of the K2 Ni F4 phases La2-x Srx Ni O4+d with oxidation state: octahedral distortion and phase separation (0.2 < x < 1.0)","Journal of Solid State Chemistry","1999","145","","401","420","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521324","3.8268","","3.8268","","12.7086","","90","","90","","90","","186.11","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.67 Sr0.33) Ni O4","","- La1.67 Ni O4 Sr0.33 -","- La1.666 Ni O4 Sr0.334 -","- La3.332 Ni2 O8 Sr0.668 -","2","0.0625","","Millburn, J.E.; Green, M.A.; Neumann, D.A.; Rosseinsky, M.J.","Evolution of the structure of the K2 Ni F4 phases La2-x Srx Ni O4+d with oxidation state: octahedral distortion and phase separation (0.2 < x < 1.0)","Journal of Solid State Chemistry","1999","145","","401","420","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521325","3.8144","","3.8144","","12.5597","","90","","90","","90","","182.739","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.2 Sr0.8) Ni O4","","- La1.2 Ni O4 Sr0.8 -","- La1.2 Ni O4 Sr0.8 -","- La2.4 Ni2 O8 Sr1.6 -","2","0.0625","","Millburn, J.E.; Rosseinsky, M.J.; Green, M.A.; Neumann, D.A.","Evolution of the structure of the K2 Ni F4 phases La2-x Srx Ni O4+d with oxidation state: octahedral distortion and phase separation (0.2 < x < 1.0)","Journal of Solid State Chemistry","1999","145","","401","420","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521326","7.983","","8.877","","8.437","","90","","100.62","","90","","587.648","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cu (V O) (Se O3)2","","- Cu O7 Se2 V -","- Cu O7 Se2 V -","- Cu4 O28 Se8 V4 -","4","1","","Millet, P.; Enjalbert, R.; Galy, J.","Cu (V O) (Se O3)2 (A) und (B) forms: synthesis and crystal structures of new copper(II)-vanadyl(IV) diselenites","Journal of Solid State Chemistry","1999","147","","296","303","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521327","7.071","","8.223","","9.5","","90","","90","","90","","552.376","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Cu (V O) (Se O3)2","","- Cu O7 Se2 V -","- Cu O7 Se2 V -","- Cu4 O28 Se8 V4 -","4","0.5","","Millet, P.; Enjalbert, R.; Galy, J.","Cu (V O) (Se O3)2 (A) und (B) forms: synthesis and crystal structures of new copper(II)-vanadyl(IV) diselenites","Journal of Solid State Chemistry","1999","147","","296","303","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521328","10.886","","10.886","","9.538","","90","","90","","120","","978.869","","","","","","","","","","","","","3","P 3 1 c","P 3 -2c","159","","Na2 (V3 O7)","","- Na2 O7 V3 -","- Na2 O7 V3 -","- Na12 O42 V18 -","6","1","","Millet, P.; Henry, J.Y.; Galy, J.; Mila, F.","Vanadium(IV)-oxide nanotubes: crystal structure of the low-dimensional quantum magnet Na2 V3 O7","Journal of Solid State Chemistry","1999","147","","676","678","","","","","","","","","","","","","","","","","","","","","","has coordinates","141074","2020-10-21","18:00:00",""
"1521329","12.515","","12.662","","13.036","","106.263","","108.627","","109.68","","1660.19","","","","","","","","","","","","","7","P -1","-P 1","2","","K4 (Te4 (Re (C N)3)4) (H2 O)5","","- C12 H10 K4 N12 O5 Re4 Te4 -","- C12 K4 N12 O5 Re4 Te4 -","- C24 K8 N24 O10 Re8 Te8 -","2","1","","Mironov, Yu.V.; Virovets, A.V.; Artemkina, S.B.; Fedorov, V.E.","Crystal structure of the tellurocyanide cluster complex K4 (Re4 Te4(C N)12) . 5(H2 O)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1999","40","","375","379","","","","","","","","","","","","","","","","","","","","","","has coordinates","141075","2020-10-21","18:00:00",""
"1521334","5.375","","8.569","","13.863","","90","","111.79","","90","","592.886","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Y1.335 La0.665) Si2 O7","","- La0.665 O7 Si2 Y1.335 -","- La0.665 O7 Si2 Y1.335 -","- La2.66 O28 Si8 Y5.34 -","4","1","","Monteverde, F.; Celotti, G.","Structural data from X-ray powder diffraction of a new phase formed in the Si3 N4 - La2 O3 - Y2 O3 system after oxidation in air","Journal of the European Ceramic Society","1999","19","","2021","2026","","","","","","","","","","","","","","","","","","","","","","has coordinates","141081","2020-10-21","18:00:00",""
"1521338","3.8591","","3.8591","","20.17259","","90","","90","","90","","300.423","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Sr3 Fe2 O6.93","","- Fe2 O6.93 Sr3 -","- Fe2 O6.93 Sr3 -","- Fe4 O13.86 Sr6 -","2","0.0625","","Mori, K.; Kamiyama, T.; Kobayashi, H.; Izumi, F.; Torii, S.; Asano, H.","Crystal structure of Sr3 Fe2 O7-d","Journal of Physics and Chemistry of Solids","1999","60","","1443","1446","","","","","","","","","","","","","","","","","","","","","","has coordinates","141085","2020-10-21","18:00:00",""
"1521339","4.016","","4.016","","7.16","","90","","90","","90","","115.478","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","","","- Gd Mn Si -","- Gd Mn Si -","- Gd2 Mn2 Si2 -","2","0.125","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521340","4.90363","","4.90363","","23.93459","","90","","90","","120","","498.416","","","","","","","","","","","","","4","R 3 2 :H","R 3 2""","155","","Sr (Al2 B2 O7)","","- Al2 B2 O7 Sr -","- Al2 B2 O7 Sr -","- Al6 B6 O21 Sr3 -","3","0.166667","","Kaduk, J.A.; Satek, L.C.; McKenna, S.T.","Crystal structures of metal aluminium borates","The Rigaku Journal","1999","16","","17","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521341","5.8442","","5.8523","","8.2504","","90","","90","","90","","282.18","","","","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","(Ba0.282 Sr0.718) (Zr0.983 Ti0.017) O3","","- Ba0.282 O3 Sr0.718 Ti0.017 Zr0.983 -","- Ba0.2818 O3 Sr0.7182 Ti0.0168 Zr0.9832 -","- Ba1.1272 O12 Sr2.8728 Ti0.0672 Zr3.9328 -","4","0.5","","Joseph, J.; Vimala, T.M.; Murthy, V.R.K.; Raju, J.","Structural investigations on the (Ba, Sr) (Zr, Ti) O3 system","Journal of Physics D, Applied Physics","1999","32","","1049","1057","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521342","5.838","","5.8464","","8.2407","","90","","90","","90","","281.266","","","","","","","","","","","","","6","P b n m","-P 2c 2ab","62","","(Ba0.288 Sr0.712) (Zr0.952 Ti0.038 Ta0.01) O3","","- Ba0.288 O3 Sr0.712 Ta0.01 Ti0.038 Zr0.952 -","- Ba0.288 O3 Sr0.712 Ta0.0104 Ti0.038 Zr0.9516 -","- Ba1.152 O12 Sr2.848 Ta0.0416 Ti0.152 Zr3.8064 -","4","0.5","","Joseph, J.; Vimala, T.M.; Raju, J.; Murthy, V.R.K.","Structural investigations on the (Ba, Sr) (Zr, Ti) O3 system","Journal of Physics D, Applied Physics","1999","32","","1049","1057","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521343","5.399","","5.399","","4.307","","90","","90","","120","","108.726","","","","","","","","","","","","","4","P 6 m m","P 6 -2","183","","La Ni4.8 Sn0.2 D6.17","","- D6.17 La Ni4.8 Sn0.2 -","- D6.166 La Ni4.799 Sn0.201 -","- D6.166 La Ni4.799 Sn0.201 -","1","0.0833333","","Joubert, J.M.; Yvon, K.; Latroche, M.; Cerny, R.; Percheron-Guegan, A.; Bowman, R.C.jr.","Crystallographic study of La Ni5-x Snx (0.2<x<0.5) compounds and their hydrides","Journal of Alloys Compd.","1999","293","","124","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521344","5.392","","5.392","","4.313","","90","","90","","120","","108.595","","","","","","","","","","","","","4","P 6/m m m","-P 6 2","191","","La Ni4.6 Sn0.4 D5.51","","- D5.51 La Ni4.6 Sn0.4 -","- D5.51 La Ni4.601 Sn0.399 -","- D5.51 La Ni4.601 Sn0.399 -","1","0.0416667","","Joubert, J.M.; Latroche, M.; Cerny, R.; Yvon, K.; Bowman, R.C.jr.; Percheron-Guegan, A.","Crystallographic study of La Ni5-x Snx (0.2<x<0.5) compounds and their hydrides","Journal of Alloys Compd.","1999","293","","124","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521345","12.0671","","12.0671","","7.5535","","90","","90","","90","","1099.9","","","","","","","","","","","","","5","I 4/m","-I 4","87","","Na4 (Al3 Si9 O24) Cl","","- Al3 Cl Na4 O24 Si9 -","- Al3 Cl Na4 O24 Si9 -","- Al6 Cl2 Na8 O48 Si18 -","2","0.125","","Kabalov, Yu.K.; Sokolova, E.V.; Kalygina, N.V.; Schneider, J.","Changes in the crystal structure of marialite during heating","Kristallografiya","1999","44","","1049","1053","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521347","7.20447","","12.58817","","5.81214","","90","","90","","90","","527.109","","","","","","","","","","annealed at 850 C for 2 days, 950 C for 3 days, 1000 C for 1.5 days","","","4","P b n m","-P 2c 2ab","62","","Ba Sm2 Zn O5","","- Ba O5 Sm2 Zn -","- Ba O5 Sm2 Zn -","- Ba4 O20 Sm8 Zn4 -","4","0.5","","Kaduk, J.A.; Wong-Ng, W.; Dillingham, J.; Greenwood, W.; Toby, B.H.","Crystal structures and reference powder patterns of Ba R2 Zn O5 (R = La, Nd, Sm, Eu, Gd, Dy, Ho, Y, Er and Tm)","Journal of Research of the National Institute of standards and Technology","1999","104","","147","171","10.6028/jres.104.011","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178088","2020-10-21","18:00:00",""
"1521348","7.1789","","12.53575","","5.79103","","90","","90","","90","","521.152","","","","","","","","","","annealed at 850 C for 2 days, 950 C for 3 days, 1000 C for 1.5 days","","","4","P b n m","-P 2c 2ab","62","","Ba Eu2 Zn O5","","- Ba Eu2 O5 Zn -","- Ba Eu2 O5 Zn -","- Ba4 Eu8 O20 Zn4 -","4","0.5","","Kaduk, J.A.; Wong-Ng, W.; Greenwood, W.; Dillingham, J.; Toby, B.H.","Crystal structures and reference powder patterns of Ba R2 Zn O5 (R = La, Nd, Sm, Eu, Gd, Dy, Ho, Y, Er and Tm)","Journal of Research of the National Institute of standards and Technology","1999","104","","147","171","10.6028/jres.104.011","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178088","2020-10-21","18:00:00",""
"1521349","7.15729","","12.49393","","5.77424","","90","","90","","90","","516.348","","","","","","","","","","annealed at 850 C for 2 days, 950 C for 3 days, 1000 C for 1.5 days","","","4","P b n m","-P 2c 2ab","62","","Ba Gd2 Zn O5","","- Ba Gd2 O5 Zn -","- Ba Gd2 O5 Zn -","- Ba4 Gd8 O20 Zn4 -","4","0.5","","Kaduk, J.A.; Wong-Ng, W.; Toby, B.H.; Dillingham, J.; Greenwood, W.","Crystal structures and reference powder patterns of Ba R2 Zn O5 (R = La, Nd, Sm, Eu, Gd, Dy, Ho, Y, Er and Tm)","Journal of Research of the National Institute of standards and Technology","1999","104","","147","171","10.6028/jres.104.011","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178088","2020-10-21","18:00:00",""
"1521350","6.878","","11.847","","4.588","","90","","90","","90","","373.847","","","","","","","","","","","","","5","P m m n :2","-P 2ab 2a","59","","Ba Fe2 (P2 O7) F2","","- Ba F2 Fe2 O7 P2 -","- Ba F2 Fe2 O7 P2 -","- Ba2 F4 Fe4 O14 P4 -","2","0.25","","le Meins, J.M.; Greneche, J.M.; Courbion, G.","Hydrothermal synthesis, structural, and magnetic studies of a new fluoropyrophosphate: Ba Fe(II)2 P2 O7 F2","Journal of Solid State Chemistry","1999","148","","286","294","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521351","7.07113","","12.34199","","5.71158","","90","","90","","90","","498.46","","","","","","","","","","annealed at 850 C for 2 days, 950 C for 3 days, 1000 C for 1.5 days, 1080 C for 5 days, 1090 C for 1.5 days","","","4","P b n m","-P 2c 2ab","62","","Ba Ho2 Zn O5","","- Ba Ho2 O5 Zn -","- Ba Ho2 O5 Zn -","- Ba4 Ho8 O20 Zn4 -","4","0.5","","Kaduk, J.A.; Wong-Ng, W.; Toby, B.H.; Dillingham, J.; Greenwood, W.","Crystal structures and reference powder patterns of Ba R2 Zn O5 (R = La, Nd, Sm, Eu, Gd, Dy, Ho, Y, Er and Tm)","Journal of Research of the National Institute of standards and Technology","1999","104","","147","171","10.6028/jres.104.011","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178088","2020-10-21","18:00:00",""
"1521352","7.04515","","12.29815","","5.6941","","90","","90","","90","","493.35","","","","","","","","","","annealed at 850 C for 2 days, 950 C for 3 days, 1000 C for 1.5 days, 1080 C for 5 days, 1090 C for 1.5 days","","","4","P b n m","-P 2c 2ab","62","","Ba Er2 Zn O5","","- Ba Er2 O5 Zn -","- Ba Er2 O5 Zn -","- Ba4 Er8 O20 Zn4 -","4","0.5","","Kaduk, J.A.; Wong-Ng, W.; Greenwood, W.; Dillingham, J.; Toby, B.H.","Crystal structures and reference powder patterns of Ba R2 Zn O5 (R = La, Nd, Sm, Eu, Gd, Dy, Ho, Y, Er and Tm)","Journal of Research of the National Institute of standards and Technology","1999","104","","147","171","10.6028/jres.104.011","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","178088","2020-10-21","18:00:00",""
"1521353","7.01855","","12.25445","","5.67786","","90","","90","","90","","488.344","","","","","","","","","","annealed at 850 C for 2 days, 950 C for 3 days, 1000 C for 1.5 days, 1100 C for 1.5 days, 1200 C for 3 days","","","4","P b n m","-P 2c 2ab","62","","Ba Tm2 Zn O5","","- Ba O5 Tm2 Zn -","- Ba O5 Tm2 Zn -","- Ba4 O20 Tm8 Zn4 -","4","0.5","","Kaduk, J.A.; Wong-Ng, W.; Greenwood, W.; Dillingham, J.; Toby, B.H.","Crystal structures and reference powder patterns of Ba R2 Zn O5 (R = La, Nd, Sm, Eu, Gd, Dy, Ho, Y, Er and Tm)","Journal of Research of the National Institute of standards and Technology","1999","104","","147","171","10.6028/jres.104.011","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521354","10.57945","","10.57945","","5.67357","","90","","90","","90","","635.013","","","","","","","","","","","","","4","I 4/m","-I 4","87","","Cu2 (Al6 B4 O17)","","- Al6 B4 Cu2 O17 -","- Al6.004 B4 Cu1.996 O17 -","- Al12.008 B8 Cu3.992 O34 -","2","0.125","","Kaduk, J.A.; McKenna, S.T.; Satek, L.C.","Crystal structures of metal aluminium borates","The Rigaku Journal","1999","16","","17","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","141563","2020-10-21","18:00:00",""
"1521356","8.393","","12.083","","4.843","","90","","90.37","","90","","491.131","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Na2 (Si2 O5)","","- Na2 O5 Si2 -","- Na2 O5 Si2 -","- Na8 O20 Si8 -","4","1","","Kahlenberg, V.; Doersam, G.; Wendschuh-Josties, M.; Fischer, R.X.","The crystal structure of delta-(Na2 Si2 O5)","Journal of Solid State Chemistry","1999","146","","380","386","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521359","9.176","","9.176","","9.176","","90","","90","","90","","772.61","","","","","","","","","","","","","3","I m -3","-I 2 2 3","204","","Sr0.935 Fe4 Sb12","","- Fe4 Sb12 Sr0.935 -","- Fe4 Sb12 Sr0.935 -","- Fe8 Sb24 Sr1.87 -","2","0.0416667","","Kaiser, J.W.; Jeitschko, W.","The antimony-rich parts of the ternary systems calcium, strontium, barium and cerium with iron and antimony; structure refinements of the (La Fe4 Sb12)-type compounds Sr Fe4 Sb12 and Ce Fe4 Sb12; the new compounds Ca Os4 Sb12 and Yb Os4 Sb12","Journal of Alloys Compd.","1999","291","","66","72","","","","","","","","","","","","","","","","","","","","","","has coordinates","141568","2020-10-21","18:00:00",""
"1521360","9.126","","9.126","","9.126","","90","","90","","90","","760.049","","","","","","","","","","","","","3","I m -3","-I 2 2 3","204","","","","- Ce0.892 Fe4 Sb12 -","- Ce0.892 Fe4 Sb12 -","- Ce1.784 Fe8 Sb24 -","2","0.0416667","","Kaiser, J.W.; Jeitschko, W.","The antimony-rich parts of the ternary systems calcium, strontium, barium and cerium with iron and antimony; structure refinements of the (La Fe4 Sb12)-type compounds Sr Fe4 Sb12 and Ce Fe4 Sb12; the new compounds Ca Os4 Sb12 and Yb Os4 Sb12","Journal of Alloys Compd.","1999","291","","66","72","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521364","3.8665","","3.8665","","12.0802","","90","","90","","90","","180.597","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Hg0.62 Mo0.38) Sr2 (Sr0.45 La0.55) Cu2 O6.93","","- Cu2 Hg0.62 La0.55 Mo0.38 O6.93 Sr2.45 -","- Cu2 Hg0.62 La0.55 Mo0.38 O6.928 Sr2.45 -","- Cu2 Hg0.62 La0.55 Mo0.38 O6.928 Sr2.45 -","1","0.0625","","Kandyel, E.","Studies on (Hg0.7 Mo0.3) Sr2 (Sr1-x Lax)Cu2 Oz with a wide range of doping state","Journal of Superconductivity","1999","12","","403","408","","","","","","","","","","","","","","","","","","","","","","has coordinates","141573","2020-10-21","18:00:00",""
"1521366","3.815","","3.815","","15.255","","90","","90","","90","","222.025","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Hg0.7 Bi0.3) Sr2 (Ca0.87 Sr0.13)2 Cu3 O8.91","","- Bi0.3 Ca1.74 Cu3 Hg0.7 O8.91 Sr2.26 -","- Bi0.3 Ca1.74 Cu3 Hg0.7 O8.91 Sr2.26 -","- Bi0.3 Ca1.74 Cu3 Hg0.7 O8.91 Sr2.26 -","1","0.0625","","Kandyel, E.; Adachi, S.; Wu, X.-J.; Tajima, S.","Structural and superconducting properties of (Hg~0.7~Bi~0.3~)Sr~2~Ca~n-1~Cu~n~O~x~ (n = 3,4) superconductors synthesized under high pressure","Superconductor Science and Technology","1999","12","12","1168","1174","10.1088/0953-2048/12/12/329","","","","","","","","","","","","","","","","","","","","","has coordinates","206900","2020-10-21","18:00:00",""
"1521367","3.82","","3.82","","18.27","","90","","90","","90","","266.603","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Hg0.7 Bi0.3) Sr2 Ca3 Cu4 O10.74","","- Bi0.3 Ca3 Cu4 Hg0.7 O10.74 Sr2 -","- Bi0.3 Ca3 Cu4 Hg0.7 O10.74 Sr2 -","- Bi0.3 Ca3 Cu4 Hg0.7 O10.74 Sr2 -","1","0.0625","","Kandyel, E.; Adachi, S.; Wu, X.-J.; Tajima, S.","Structural and superconducting properties of (Hg~0.7~Bi~0.3~)Sr~2~Ca~n-1~Cu~n~O~x~ (n = 3,4) superconductors synthesized under high pressure","Superconductor Science and Technology","1999","12","12","1168","1174","10.1088/0953-2048/12/12/329","","","","","","","","","","","","","","","","","","","","","has coordinates","206900","2020-10-21","18:00:00",""
"1521375","3.8314","","3.8314","","11.745","","90","","90","","90","","172.412","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","Cu (Ba0.8 Sr0.2)2 (Yb0.9 Ca0.1) Cu2 O6.104","","- Ba1.6 Ca0.1 Cu3 O6.104 Sr0.4 Yb0.9 -","- Ba1.6 Ca0.1 Cu3 O6.104 Sr0.4 Yb0.9 -","- Ba1.6 Ca0.1 Cu3 O6.104 Sr0.4 Yb0.9 -","1","0.0625","","Karppinen, M.; Yamauchi, H.; Fujinami, K.; Nakane, T.; Tellgren, R.; Peitola, K.; Rundloef, H.","Ca-substitution and O-doping effects in superconducting Cu (Ba0.8 Sr0.2)2 (Yb1-x Cax) Cu2 O6+z obtained from neutron diffraction refinements","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","4378","4385","","","","","","","","","","","","","","","","","","","","","","has coordinates","141584","2020-10-21","18:00:00",""
"1521376","3.8272","","3.8272","","11.735","","90","","90","","90","","171.888","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","Cu (Ba0.8 Sr0.2)2 (Yb0.8 Ca0.2) Cu2 O6.166","","- Ba1.6 Ca0.2 Cu3 O6.166 Sr0.4 Yb0.8 -","- Ba1.6 Ca0.2 Cu3 O6.166 Sr0.4 Yb0.8 -","- Ba1.6 Ca0.2 Cu3 O6.166 Sr0.4 Yb0.8 -","1","0.0625","","Karppinen, M.; Yamauchi, H.; Tellgren, R.; Peitola, K.; Nakane, T.; Fujinami, K.; Rundloef, H.","Ca-substitution and O-doping effects in superconducting Cu (Ba0.8 Sr0.2)2 (Yb1-x Cax) Cu2 O6+z obtained from neutron diffraction refinements","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","4378","4385","","","","","","","","","","","","","","","","","","","","","","has coordinates","141585","2020-10-21","18:00:00",""
"1521377","3.832","","3.832","","11.736","","90","","90","","90","","172.334","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","Cu (Ba0.8 Sr0.2)2 (Yb0.75 Ca0.25) Cu2 O6.072","","- Ba1.6 Ca0.25 Cu3 O6.072 Sr0.4 Yb0.75 -","- Ba1.6 Ca0.25 Cu3 O6.072 Sr0.4 Yb0.75 -","- Ba1.6 Ca0.25 Cu3 O6.072 Sr0.4 Yb0.75 -","1","0.0625","","Karppinen, M.; Yamauchi, H.; Tellgren, R.; Fujinami, K.; Nakane, T.; Peitola, K.; Rundloef, H.","Ca-substitution and O-doping effects in superconducting Cu (Ba0.8 Sr0.2)2 (Yb1-x Cax) Cu2 O6+z obtained from neutron diffraction refinements","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","4378","4385","","","","","","","","","","","","","","","","","","","","","","has coordinates","141586","2020-10-21","18:00:00",""
"1521378","3.8334","","3.8334","","11.734","","90","","90","","90","","172.431","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","Cu (Ba0.8 Sr0.2)2 (Yb0.65 Ca0.35) Cu2 O6.075","","- Ba1.6 Ca0.35 Cu3 O6.075 Sr0.4 Yb0.65 -","- Ba1.6 Ca0.35 Cu3 O6.075 Sr0.4 Yb0.65 -","- Ba1.6 Ca0.35 Cu3 O6.075 Sr0.4 Yb0.65 -","1","0.0625","","Karppinen, M.; Yamauchi, H.; Rundloef, H.; Nakane, T.; Fujinami, K.; Peitola, K.; Tellgren, R.","Ca-substitution and O-doping effects in superconducting Cu (Ba0.8 Sr0.2)2 (Yb1-x Cax) Cu2 O6+z obtained from neutron diffraction refinements","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","4378","4385","","","","","","","","","","","","","","","","","","","","","","has coordinates","141587","2020-10-21","18:00:00",""
"1521379","3.8342","","3.8342","","11.743","","90","","90","","90","","172.635","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Cu (Ba0.8 Sr0.2)2 Yb Cu2 O6.201","","- Ba1.6 Cu3 O6.201 Sr0.4 Yb -","- Ba1.6 Cu3 O6.201 Sr0.4 Yb -","- Ba1.6 Cu3 O6.201 Sr0.4 Yb -","1","0.0625","","Karppinen, M.; Yamauchi, H.; Fujinami, K.; Nakane, T.; Rundloef, H.; Peitola, K.; Tellgren, R.","Ca-substitution and O-doping effects in superconducting Cu (Ba0.8 Sr0.2)2 (Yb1-x Cax) Cu2 O6+z obtained from neutron diffraction refinements","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","4378","4385","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521380","3.8172","","3.8465","","11.667","","90","","90","","90","","171.305","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Cu (Ba0.8 Sr0.2)2 Yb Cu2 O6.35","","- Ba1.6 Cu3 O6.35 Sr0.4 Yb -","- Ba1.6 Cu3 O6.35 Sr0.4 Yb -","- Ba1.6 Cu3 O6.35 Sr0.4 Yb -","1","0.125","","Karppinen, M.; Fujinami, K.; Yamauchi, H.; Nakane, T.; Peitola, K.; Rundloef, H.; Tellgren, R.","Ca-substitution and O-doping effects in superconducting Cu (Ba0.8 Sr0.2)2 (Yb1-x Cax) Cu2 O6+z obtained from neutron diffraction refinements","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","4378","4385","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521381","3.804","","3.8583","","11.637","","90","","90","","90","","170.796","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Cu (Ba0.8 Sr0.2)2 Yb Cu2 O6.817","","- Ba1.6 Cu3 O6.817 Sr0.4 Yb -","- Ba1.6 Cu3 O6.817 Sr0.4 Yb -","- Ba1.6 Cu3 O6.817 Sr0.4 Yb -","1","0.125","","Karppinen, M.; Yamauchi, H.; Nakane, T.; Fujinami, K.; Tellgren, R.; Peitola, K.; Rundloef, H.","Ca-substitution and O-doping effects in superconducting Cu (Ba0.8 Sr0.2)2 (Yb1-x Cax) Cu2 O6+z obtained from neutron diffraction refinements","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","4378","4385","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521382","3.7934","","3.8615","","11.614","","90","","90","","90","","170.124","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Cu (Ba0.8 Sr0.2)2 Yb Cu2 O6.999","","- Ba1.6 Cu3 O6.999 Sr0.4 Yb -","- Ba1.6 Cu3 O6.999 Sr0.4 Yb -","- Ba1.6 Cu3 O6.999 Sr0.4 Yb -","1","0.125","","Karppinen, M.; Yamauchi, H.; Rundloef, H.; Fujinami, K.; Peitola, K.; Nakane, T.; Tellgren, R.","Ca-substitution and O-doping effects in superconducting Cu (Ba0.8 Sr0.2)2 (Yb1-x Cax) Cu2 O6+z obtained from neutron diffraction refinements","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","4378","4385","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521383","7.665","","7.665","","9.36","","90","","90","","120","","476.245","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Zn Ni10 P3","","- Ni10 P3 Zn -","- Ni10 P3 Zn -","- Ni30 P9 Zn3 -","3","0.25","","Keimes, V.; Blume, H.M.; Mewis, A.","Darstellung und Kristallstruktur von A Ni10 P3 (A: Zn, Ga, Sn, Sb)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","207","210","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521384","7.674","","7.674","","9.621","","90","","90","","120","","490.676","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Sn Ni10 P3","","- Ni10 P3 Sn -","- Ni10 P3 Sn -","- Ni30 P9 Sn3 -","3","0.25","","Keimes, V.; Blume, H.M.; Mewis, A.","Darstellung und Kristallstruktur von A Ni10 P3 (A: Zn, Ga, Sn, Sb)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","207","210","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521385","5.4768","","5.5212","","7.789","","90","","90","","90","","235.528","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Na (Ta O3)","","- Na O3 Ta -","- Na O3 Ta -","- Na4 O12 Ta4 -","4","0.5","","Kennedy, B.J.; Prodjosantoso, A.K.; Howard, C.J.","Powder neutron diffraction study of the high temperature phase transitions in Na Ta O3","Journal of Physics: Condensed Matter","1999","11","","6319","6327","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521386","5.5503","","5.5503","","3.9335","","90","","90","","90","","121.175","","","","","","","","","","","","","3","P 4/m b m","-P 4 2ab","127","","Na (Ta O3)","","- Na O3 Ta -","- Na O3 Ta -","- Na2 O6 Ta2 -","2","0.125","","Kennedy, B.J.; Prodjosantoso, A.K.; Howard, C.J.","Powder neutron diffraction study of the high temperature phase transitions in Na Ta O3","Journal of Physics: Condensed Matter","1999","11","","6319","6327","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521387","5.9763","","5.8171","","8.2048","","90","","90","","90","","285.238","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Sr (Zr O3)","","- O3 Sr Zr -","- O3 Sr Zr -","- O12 Sr4 Zr4 -","4","0.5","","Kennedy, B.J.; Howard, C.J.; Chakoumakos, B.C.","High-temperature phase transitions in Sr Zr O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","4023","4027","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521388","8.27","","8.2732","","8.2586","","90","","90","","90","","565.048","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Sr (Zr O3)","","- O3 Sr Zr -","- O3 Sr Zr -","- O24 Sr8 Zr8 -","8","0.5","","Kennedy, B.J.; Howard, C.J.; Chakoumakos, B.C.","High-temperature phase transitions in Sr Zr O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","4023","4027","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521389","4.1514","","4.1514","","4.1514","","90","","90","","90","","71.546","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Sr (Zr O3)","","- O3 Sr Zr -","- O3 Sr Zr -","- O3 Sr Zr -","1","0.0208333","","Kennedy, B.J.; Howard, C.J.; Chakoumakos, B.C.","High-temperature phase transitions in Sr Zr O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","4023","4027","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521390","5.7516","","5.7646","","8.1344","","90","","90","","90","","269.702","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","Sr (Hf O3)","","- Hf O3 Sr -","- Hf O3 Sr -","- Hf4 O12 Sr4 -","4","0.5","","Kennedy, B.J.; Howard, C.J.; Chakoumakos, B.C.","High-temperature phase transitions in Sr Hf O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","2972","2975","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521391","8.1741","","8.1974","","8.1797","","90","","90","","90","","548.092","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Sr (Hf O3)","","- Hf O3 Sr -","- Hf O3 Sr -","- Hf8 O24 Sr8 -","8","0.5","","Kennedy, B.J.; Howard, C.J.; Chakoumakos, B.C.","High-temperature phase transitions in Sr Hf O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","2972","2975","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521392","4.1138","","4.1138","","4.1138","","90","","90","","90","","69.619","","","","","","","","","","","","","3","P m -3 m","-P 4 2 3","221","","Sr (Hf O3)","","- Hf O3 Sr -","- Hf O3 Sr -","- Hf O3 Sr -","1","0.0208333","","Kennedy, B.J.; Howard, C.J.; Chakoumakos, B.C.","High-temperature phase transitions in Sr Hf O3","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","2972","2975","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521393","6.962","","5.663","","4.658","","90","","107.73","","90","","174.923","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","K (S O2 F)","","- F K O2 S -","- F K O2 S -","- F2 K2 O4 S2 -","2","0.5","","Kessler, U.; Jansen, M.","Kristallstrukturen der Monofluorosulfite M S O2 F (M = K, Rb)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","385","388","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521394","7.172","","5.867","","4.84","","90","","107.14","","90","","194.613","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","Rb (S O2 F)","","- F O2 Rb S -","- F O2 Rb S -","- F2 O4 Rb2 S2 -","2","0.5","","Kessler, U.; Jansen, M.","Kristallstrukturen der Monofluorosulfite M S O2 F (M = K, Rb)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","385","388","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521395","11.2877","","8.4286","","10.767","","90","","90","","90","","1024.37","","","","","","","","","","","","","5","P n n a","-P 2a 2bc","52","","Li2 (Pd (N O2)4) (H2 O)2","","- H4 Li2 N4 O10 Pd -","- Li2 N4 O10 Pd -","- Li8 N16 O40 Pd4 -","4","0.5","","Khranenko, S.P.; Belyaev, A.V.; Gromilov, S.A.; Virovets, A.V.; Baidina, I.A.","Synthesis and crystal structure of Li2 (Pd (N O2)4) . 2(H2 O)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1999","40","","383","387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521396","7.76","","3.79","","13.16","","90","","90","","90","","387.041","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Ce (Cr S3)","","- Ce Cr S3 -","- Ce Cr S3 -","- Ce4 Cr4 S12 -","4","0.5","","Kikkawa, S.; Fujii, Y.; Miyamoto, Y.; Rouxel, J.; Meerschaut, A.; Lafond, A.","High pressure synthesis of Ln Cr S3 (Ln = La, Ce, Nd, Sm) and La Cr1-x Fex S3 (x < 0.2) with N H4 Cd Cl3 structure type","Materials Research Bulletin","1999","34","","279","288","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521397","7.69","","3.77","","13.06","","90","","90","","90","","378.626","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Nd (Cr S3)","","- Cr Nd S3 -","- Cr Nd S3 -","- Cr4 Nd4 S12 -","4","0.5","","Kikkawa, S.; Fujii, Y.; Meerschaut, A.; Miyamoto, Y.; Lafond, A.; Rouxel, J.","High pressure synthesis of Ln Cr S3 (Ln = La, Ce, Nd, Sm) and La Cr1-x Fex S3 (x < 0.2) with N H4 Cd Cl3 structure type","Materials Research Bulletin","1999","34","","279","288","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521398","7.64","","3.74","","12.97","","90","","90","","90","","370.6","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Sm (Cr S3)","","- Cr S3 Sm -","- Cr S3 Sm -","- Cr4 S12 Sm4 -","4","0.5","","Kikkawa, S.; Fujii, Y.; Miyamoto, Y.; Rouxel, J.; Lafond, A.; Meerschaut, A.","High pressure synthesis of Ln Cr S3 (Ln = La, Ce, Nd, Sm) and La Cr1-x Fex S3 (x < 0.2) with N H4 Cd Cl3 structure type","Materials Research Bulletin","1999","34","","279","288","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521399","5.377","","5.377","","7.622","","90","","90","","90","","220.368","","","","","","","","","","","","","4","P -4 b 2","P -4 -2ab","117","","(Li0.479 Nd0.521) Ti O2.604","","- Li0.479 Nd0.521 O2.604 Ti -","- Li0.479 Nd0.521 O2.6045 Ti -","- Li1.916 Nd2.084 O10.418 Ti4 -","4","0.5","","Kim, J.-S.; Cheon, C.-I.; Nam, S.; Lee, C.-H.; Kang, H.-J.; Kim, K.-Y.; Byun Jae Dong","Crystal structure and microwave dielectric properties of Ca Ti O3 -(Li1/2 Nd1/2) Ti O3 - (Ln1/3 Nd1/3) Ti O3 (Ln = La, Dy) ceramics","Japanese Journal of Applied Physics, Part 1","1999","38","","5633","5637","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521404","25.214","","25.214","","25.214","","90","","90","","90","","16029.7","","","","","","","","","","","","","4","F d -3 :2","-F 2uv 2vw 3","203","","Sr46 (Si100 Al92 O384)","","- Al92 O384 Si100 Sr46 -","- Al91.9968 O384 Si100.003 Sr46 -","- Al91.9968 O384 Si100.003 Sr46 -","1","0.0104167","","Kim, M.J.; Seff, K.; Jeong, M.S.; Kim, Y.","Crystal structures of fully dehydrated fully Sr(2+)-exchanged zeolite X and of its ammonia sorption complex","Microporous and Mesoporous Materials","1999","30","","233","241","","","","","","","","","","","","","","","","","","","","","","has coordinates","141614","2020-10-21","18:00:00",""
"1521405","25.127","","25.127","","25.127","","90","","90","","90","","15864.3","","","","","","","","","","","","","6","F d -3 :2","-F 2uv 2vw 3","203","","(Sr46 (Si100 Al92 O384)) (N H3)102","","- Al92 H306 N102 O384 Si100 Sr46 -","- Al91.9968 N102 O384 Si100.013 Sr46 -","- Al91.9968 N102 O384 Si100.013 Sr46 -","1","0.0104167","","Kim, M.J.; Jeong, M.S.; Seff, K.; Kim, Y.","Crystal structures of fully dehydrated fully Sr(2+)-exchanged zeolite X and of its ammonia sorption complex","Microporous and Mesoporous Materials","1999","30","","233","241","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521406","10.239","","10.029","","6.3154","","90","","90","","90","","648.509","","","","","","","","","","","","","3","F d d d :2","-F 2uv 2vw","70","","Tb (V O4)","","- O4 Tb V -","- O4 Tb V -","- O32 Tb8 V8 -","8","0.25","","Kirschbaum, K.; Martin, A.; Parrish, D.A.; Pinkerton, A.A.","Cooperative Jahn-Teller induced phase transition of Tb V O4: singlecrystal structure analyses of the tetragonal high temperaturephaseand the twinned orthorhombic phase below 33 K","Journal of Physics: Condensed Matter","1999","11","","4483","4490","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521426","5.3601","","5.3601","","7.6978","","90","","90","","120","","191.533","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Ca3 (P O4)2","","- Ca3 O8 P2 -","- Ca3 O7.998 P2 -","- Ca3 O7.998 P2 -","1","0.0416667","","Knowles, J.C.; Gibson, I.R.; Abrahams, I.","High temperature phase transition in Ca3 (P O4)2 measured by neutron diffraction","Bioceramics","1999","1999","","341","344","","","","","","","","","","","","","","","","","","","","","","has coordinates","141637","2020-10-21","18:00:00",""
"1521427","5.4677","","5.4396","","41.2475","","90","","90","","90","","1226.79","","","","","","","","","","","","","4","A 21 a m","A -2 2a","36","","Bi5 Ti3 Fe O15","","- Bi5 Fe O15 Ti3 -","- Bi5 Fe O15 Ti3 -","- Bi20 Fe4 O60 Ti12 -","4","0.5","","Ko, T.-Y.; Jun, C.-H.; Lee, J.-S.","A combined Rietveld refinement on the crystal structure of a magnetoelectric Aurivillius phase Bi5 Ti3 Fe O15 using neutron and X-ray powder diffraction","The Korean Journal of Ceramics","1999","5","","341","347","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521428","3.8071","","3.8071","","6.816","","90","","90","","90","","98.791","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","","","- Ba O1.94 -","- Ba O1.8832 -","- Ba2 O3.7664 -","2","0.0625","","Koenigstein, M.","Structural properties of nonstoichiometric barium and strontium peroxides: Ba O2-x (1.97>2-x>1.72) and Sr O2-x (1.98>2-x>1.90)","Journal of Solid State Chemistry","1999","147","","478","484","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521429","3.8096","","3.8096","","6.78","","90","","90","","90","","98.398","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","Ba O1.86","","- Ba O1.7232 -","- Ba O1.7232 -","- Ba2 O3.4464 -","2","0.0625","","Koenigstein, M.","Structural properties of nonstoichiometric barium and strontium peroxides: Ba O2-x (1.97>2-x>1.72) and Sr O2-x (1.98>2-x>1.90)","Journal of Solid State Chemistry","1999","147","","478","484","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521430","3.8085","","3.8085","","6.6986","","90","","90","","90","","97.161","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","","","- Ba O1.68 -","- Ba O1.6816 -","- Ba2 O3.3632 -","2","0.0625","","Koenigstein, M.","Structural properties of nonstoichiometric barium and strontium peroxides: Ba O2-x (1.97>2-x>1.72) and Sr O2-x (1.98>2-x>1.90)","Journal of Solid State Chemistry","1999","147","","478","484","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521431","3.563","","3.563","","6.616","","90","","90","","90","","83.99","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","Sr O1.978","","- O1.978 Sr -","- O1.9552 Sr -","- O3.9104 Sr2 -","2","0.0625","","Koenigstein, M.","Structural properties of nonstoichiometric barium and strontium peroxides: Ba O2-x (1.97>2-x>1.72) and Sr O2-x (1.98>2-x>1.90)","Journal of Solid State Chemistry","1999","147","","478","484","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521432","3.5619","","3.5619","","6.576","","90","","90","","90","","83.431","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","Sr O1.962","","- O1.962 Sr -","- O1.9232 Sr -","- O3.8464 Sr2 -","2","0.0625","","Koenigstein, M.","Structural properties of nonstoichiometric barium and strontium peroxides: Ba O2-x (1.97>2-x>1.72) and Sr O2-x (1.98>2-x>1.90)","Journal of Solid State Chemistry","1999","147","","478","484","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521433","3.5585","","3.5585","","6.563","","90","","90","","90","","83.107","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","Sr O1.9","","- O1.8016 Sr -","- O1.8016 Sr -","- O3.6032 Sr2 -","2","0.0625","","Koenigstein, M.","Structural properties of nonstoichiometric barium and strontium peroxides: Ba O2-x (1.97>2-x>1.72) and Sr O2-x (1.98>2-x>1.90)","Journal of Solid State Chemistry","1999","147","","478","484","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521442","10.743","","11.435","","5.497","","90","","118.715","","90","","592.239","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Tb2 Co3 Si5","","- Co3 Si5 Tb2 -","- Co3 Si5 Tb2 -","- Co12 Si20 Tb8 -","4","0.5","","Kolenda, M.; Hofmann, M.; Penc, B.; Szytula, A.; Starowicz, P.","Magnetic structures of Tb2 Co3 Si5 and Dy2 Co3 Si5 compounds","Journal of Alloys Compd.","1999","292","","45","50","","","","","","","","","","","","","","","","","","","","","","has coordinates","141653","2020-10-21","18:00:00",""
"1521443","10.725","","11.41","","5.474","","90","","118.695","","90","","587.598","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Dy2 Co3 Si5","","- Co3 Dy2 Si5 -","- Co3 Dy2 Si5 -","- Co12 Dy8 Si20 -","4","0.5","","Kolenda, M.; Hofmann, M.; Penc, B.; Starowicz, P.; Szytula, A.","Magnetic structures of Tb2 Co3 Si5 and Dy2 Co3 Si5 compounds","Journal of Alloys Compd.","1999","292","","45","50","","","","","","","","","","","","","","","","","","","","","","has coordinates","141654","2020-10-21","18:00:00",""
"1521445","7.243","","7.243","","17.38539","","90","","90","","120","","789.863","","","","","","","","","","","","","6","R -3 m :H","-R 3 2""","166","","Ba (V0.57 Fe0.43)3 (P O4)2 ((O H)5 (H2 O))","","- Ba Fe1.29 H7 O14 P2 V1.71 -","- Ba Fe1.29 O14 P2 V1.71 -","- Ba3 Fe3.87 O42 P6 V5.13 -","3","0.0833333","","Kolitsch, U.; Pring, A.; Fallon, G.D.; Taylor, M.R.","Springcreekite, Ba V(3+)3 (P O4)2 (O H, H2 O)6, a new member of thecrandallite group, from the Spring Creek mine, South Australia : the first natural V(3+)-member of the alunite family and its crystal structure","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","1999","1999","","529","544","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521446","10.452","","13.429","","6.528","","90","","90","","90","","916.269","","","","","","","","","","","","","4","I m m a","-I 2b 2","74","","Sr Fe3 (P O4)3","","- Fe3 O12 P3 Sr -","- Fe3 O12 P3 Sr -","- Fe12 O48 P12 Sr4 -","4","0.25","","Korzenski, M.B.; Long, G.J.; Kolis, J.W.","Hydrothermal synthesis, structural characterization, and physical properties of a new mixed valence iron phosphate, Sr Fe3 (P O4)3","Journal of Solid State Chemistry","1999","147","","390","398","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521447","4.195","","4.195","","6.581","","90","","90","","120","","100.297","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Y Al2 Si2","","- Al2 Si2 Y -","- Al2 Si2 Y -","- Al2 Si2 Y -","1","0.0833333","","Kranenberg, C.; Johrendt, D.; Mewis, A.","Untersuchungen zum Existenzgebiet des Ca Al2 Si2 Strukturtyps bei ternaeren Siliciden","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1787","1793","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521448","4.202","","4.202","","6.723","","90","","90","","120","","102.803","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Sm Al2 Si2","","- Al2 Si2 Sm -","- Al2 Si2 Sm -","- Al2 Si2 Sm -","1","0.0833333","","Kranenberg, C.; Johrendt, D.; Mewis, A.","Untersuchungen zum Existenzgebiet des Ca Al2 Si2 Strukturtyps bei ternaeren Siliciden","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1787","1793","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521449","4.184","","4.184","","6.596","","90","","90","","120","","99.999","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Tb Al2 Si2","","- Al2 Si2 Tb -","- Al2 Si2 Tb -","- Al2 Si2 Tb -","1","0.0833333","","Kranenberg, C.; Mewis, A.; Johrendt, D.","Untersuchungen zum Existenzgebiet des Ca Al2 Si2 Strukturtyps bei ternaeren Siliciden","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1787","1793","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521450","4.185","","4.185","","6.569","","90","","90","","120","","99.637","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Dy Al2 Si2","","- Al2 Dy Si2 -","- Al2 Dy Si2 -","- Al2 Dy Si2 -","1","0.0833333","","Kranenberg, C.; Johrendt, D.; Mewis, A.","Untersuchungen zum Existenzgebiet des Ca Al2 Si2 Strukturtyps bei ternaeren Siliciden","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1787","1793","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521451","3.977","","3.977","","10.643","","90","","90","","90","","168.335","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd Al Mn Si2","","- Al Gd Mn Si2 -","- Al Gd Mn Si2 -","- Al2 Gd2 Mn2 Si4 -","2","0.0625","","Kranenberg, C.; Mewis, A.; Johrendt, D.","Untersuchungen zum Existenzgebiet des Ca Al2 Si2 Strukturtyps bei ternaeren Siliciden","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1787","1793","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521455","11.1108","","11.1108","","11.1108","","90","","90","","90","","1371.63","","","","","","","","","","","","","2","I a -3","-I 2b 2c 3","206","","","","- Ce O1.695 -","- Ce O1.695 -","- Ce32 O54.24 -","32","0.666667","","Kuemmerle, E.A.; Heger, G.","The structures of C-(Ce2 O3+d), Ce7 O12 and Ce11 O20","Journal of Solid State Chemistry","1999","147","","485","500","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521456","5.6126","","5.6549","","7.9497","","90","","90","","90","","252.313","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La (Mg0.616 Nb0.384) O3","","- La Mg0.616 Nb0.384 O3 -","- La Mg0.616 Nb0.384 O3 -","- La4 Mg2.464 Nb1.536 O12 -","4","0.5","","Kim, J.-S.; Kang, H.-J.; Cheon, C.-I.; Byun Jae Dong; Shim, H.-S.; Nam, S.; Lee, C.-H.","Crystal structure of La (Mg2/3 M1/3) O3 (M = Nb, Ta) microwave dielectric ceramics","Materials Letters","1999","38","","294","299","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521457","5.6126","","5.6549","","7.9497","","90","","90","","90","","252.313","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La (Mg0.704 Nb0.296) O3","","- La Mg0.704 Nb0.296 O3 -","- La Mg0.704 Nb0.296 O3 -","- La4 Mg2.816 Nb1.184 O12 -","4","0.5","","Kim, J.-S.; Kang, H.-J.; Cheon, C.-I.; Shim, H.-S.; Nam, S.; Lee, C.-H.; Byun Jae Dong","Crystal structure of La (Mg2/3 M1/3) O3 (M = Nb, Ta) microwave dielectric ceramics","Materials Letters","1999","38","","294","299","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521458","6.778","","6.778","","6.778","","99.42","","99.42","","99.42","","297.189","","","","","","","","","","","","","2","R -3 :R","-P 3*","148","","","","- Ce7 O12 -","- Ce7 O12 -","- Ce7 O12 -","1","0.166667","","Kuemmerle, E.A.; Heger, G.","The structures of C-(Ce2 O3+d), Ce7 O12 and Ce11 O20","Journal of Solid State Chemistry","1999","147","","485","500","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521459","5.5939","","5.5939","","5.5939","","90","","90","","90","","175.043","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","","- Ce O1.66 -","- Ce O1.66 -","- Ce4 O6.64 -","4","0.0208333","","Kuemmerle, E.A.; Heger, G.","The structures of C-(Ce2 O3+d), Ce7 O12 and Ce11 O20","Journal of Solid State Chemistry","1999","147","","485","500","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521460","6.757","","10.26","","6.732","","90.04","","99.8","","96.22","","457.103","","","","","","","","","","","","","2","P -1","-P 1","2","","","","- Ce11 O20 -","- Ce11 O20 -","- Ce11 O20 -","1","0.5","","Kuemmerle, E.A.; Heger, G.","The structures of C-(Ce2 O3+d), Ce7 O12 and Ce11 O20","Journal of Solid State Chemistry","1999","147","","485","500","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521461","3.9104","","3.9104","","11.6839","","90","","90","","90","","178.661","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","(Ba1.5 La0.5) La Cu3 O7.035","","- Ba1.5 Cu3 La1.5 O7.035 -","- Ba1.5 Cu3 La1.5 O7.035 -","- Ba1.5 Cu3 La1.5 O7.035 -","1","0.0625","","Kulkarni, R. G.; Subbarao, M. V.","X-ray structural studies of the superconducting La~3.5-x-y~Nd~y~Ca~2x~Ba~3.5-x~Cu~7~O~z~","Superconductor Science and Technology","1999","12","3","172","176","10.1088/0953-2048/12/3/012","","","","","","","","","","","","","","","","","","","","","has coordinates","206901","2020-10-21","18:00:00",""
"1521462","3.9034","","3.9034","","11.67","","90","","90","","90","","177.81","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Ba1.46 La0.54) (La0.87 Nd0.04 Ca0.09) Cu3 O7.04","","- Ba1.46 Ca0.09 Cu3 La1.41 Nd0.04 O7.04 -","- Ba1.46 Ca0.09 Cu3 La1.41 Nd0.04 O7.04 -","- Ba1.46 Ca0.09 Cu3 La1.41 Nd0.04 O7.04 -","1","0.0625","","Kulkarni, R. G.; Subbarao, M. V.","X-ray structural studies of the superconducting La~3.5-x-y~Nd~y~Ca~2x~Ba~3.5-x~Cu~7~O~z~","Superconductor Science and Technology","1999","12","3","172","176","10.1088/0953-2048/12/3/012","","","","","","","","","","","","","","","","","","","","","has coordinates","206901","2020-10-21","18:00:00",""
"1521463","3.8941","","3.8941","","11.6589","","90","","90","","90","","176.796","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Ba1.41 La0.59) (La0.74 Nd0.09 Ca0.17) Cu3 O7.053","","- Ba1.41 Ca0.17 Cu3 La1.33 Nd0.09 O7.053 -","- Ba1.41 Ca0.17 Cu3 La1.33 Nd0.09 O7.053 -","- Ba1.41 Ca0.17 Cu3 La1.33 Nd0.09 O7.053 -","1","0.0625","","Kulkarni, R. G.; Subbarao, M. V.","X-ray structural studies of the superconducting La~3.5-x-y~Nd~y~Ca~2x~Ba~3.5-x~Cu~7~O~z~","Superconductor Science and Technology","1999","12","3","172","176","10.1088/0953-2048/12/3/012","","","","","","","","","","","","","","","","","","","","","has coordinates","206901","2020-10-21","18:00:00",""
"1521464","3.8866","","3.8866","","11.6511","","90","","90","","90","","175.998","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Ba1.37 La0.60 Ca0.03) (La0.65 Nd0.13 Ca0.22) Cu3 O7.069","","- Ba1.37 Ca0.25 Cu3 La1.25 Nd0.13 O7.069 -","- Ba1.37 Ca0.25 Cu3 La1.25 Nd0.13 O7.069 -","- Ba1.37 Ca0.25 Cu3 La1.25 Nd0.13 O7.069 -","1","0.0625","","Kulkarni, R. G.; Subbarao, M. V.","X-ray structural studies of the superconducting La~3.5-x-y~Nd~y~Ca~2x~Ba~3.5-x~Cu~7~O~z~","Superconductor Science and Technology","1999","12","3","172","176","10.1088/0953-2048/12/3/012","","","","","","","","","","","","","","","","","","","","","has coordinates","206901","2020-10-21","18:00:00",""
"1521465","3.8734","","3.8734","","11.6232","","90","","90","","90","","174.386","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Ba1.33 La0.64 Ca0.03) (La0.52 Nd0.17 Ca0.31) Cu3 O7.078","","- Ba1.33 Ca0.34 Cu3 La1.16 Nd0.17 O7.078 -","- Ba1.33 Ca0.34 Cu3 La1.16 Nd0.17 O7.078 -","- Ba1.33 Ca0.34 Cu3 La1.16 Nd0.17 O7.078 -","1","0.0625","","Kulkarni, R. G.; Subbarao, M. V.","X-ray structural studies of the superconducting La~3.5-x-y~Nd~y~Ca~2x~Ba~3.5-x~Cu~7~O~z~","Superconductor Science and Technology","1999","12","3","172","176","10.1088/0953-2048/12/3/012","","","","","","","","","","","","","","","","","","","","","has coordinates","206901","2020-10-21","18:00:00",""
"1521466","3.866","","3.866","","11.6222","","90","","90","","90","","173.705","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Ba1.29 La0.64 Ca0.07) (La0.43 Nd0.21 Ca0.36) Cu3 O7.083","","- Ba1.29 Ca0.43 Cu3 La1.07 Nd0.21 O7.083 -","- Ba1.29 Ca0.43 Cu3 La1.07 Nd0.21 O7.083 -","- Ba1.29 Ca0.43 Cu3 La1.07 Nd0.21 O7.083 -","1","0.0625","","Kulkarni, R. G.; Subbarao, M. V.","X-ray structural studies of the superconducting La~3.5-x-y~Nd~y~Ca~2x~Ba~3.5-x~Cu~7~O~z~","Superconductor Science and Technology","1999","12","3","172","176","10.1088/0953-2048/12/3/012","","","","","","","","","","","","","","","","","","","","","has coordinates","206901","2020-10-21","18:00:00",""
"1521467","3.8615","","3.8615","","11.6124","","90","","90","","90","","173.155","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Ba1.24 La0.59 Ca0.17) (La0.40 Nd0.26 Ca0.34) Cu3 O7.085","","- Ba1.24 Ca0.51 Cu3 La0.99 Nd0.26 O7.085 -","- Ba1.24 Ca0.51 Cu3 La0.99 Nd0.26 O7.085 -","- Ba1.24 Ca0.51 Cu3 La0.99 Nd0.26 O7.085 -","1","0.0625","","Kulkarni, R. G.; Subbarao, M. V.","X-ray structural studies of the superconducting La~3.5-x-y~Nd~y~Ca~2x~Ba~3.5-x~Cu~7~O~z~","Superconductor Science and Technology","1999","12","3","172","176","10.1088/0953-2048/12/3/012","","","","","","","","","","","","","","","","","","","","","has coordinates","206901","2020-10-21","18:00:00",""
"1521468","5.054","","11.904","","5.839","","90","","90","","90","","351.291","","","","","","","","","","","","","3","P b c m","-P 2c 2b","57","","Ca (Nb2 O4)","","- Ca Nb2 O4 -","- Ca Nb2 O4 -","- Ca4 Nb8 O16 -","4","0.5","","Kumada, N.; Kinomiura, N.","Preparation and crystal structure of a new reduced calcium niobium oxide: Ca Nb2 O4","Journal of Solid State Chemistry","1999","147","","671","675","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521469","3.869","","3.869","","15.163","","90","","90","","120","","196.568","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Dy2 O2 (C O3)","","- C Dy2 O5 -","- C0.999 Dy2 O4.999 -","- C1.998 Dy4 O9.998 -","2","0.0833333","","Kutlu, I.; Meyer, G.","Basische Carbonate des Dysprosiums: Dy2 O2 (C O3) und Dy (O H) (C O3)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","402","406","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521470","12.01","","12.01","","9.718","","90","","90","","120","","1213.93","","","","","","","","","","","","","4","P -6","P -6","174","","Dy (O H) (C O3)","","- C H Dy O4 -","- C Dy O4 -","- C18 Dy18 O72 -","18","3","","Kutlu, I.; Meyer, G.","Basische Carbonate des Dysprosiums: Dy2 O2 (C O3) und Dy (O H) (C O3)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","402","406","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521473","3.963","","3.963","","35.3","","90","","90","","120","","480.124","","","","","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","Sn4.008 P2.92","","- P2.92 Sn4.008 -","- P2.92 Sn4.008 -","- P8.76 Sn12.024 -","3","0.0833333","","Kuz'ma, Yu.B.; Chikhrii, S.I.; Davydov, V.N.","Refined crystal structure of Sn4 P3","Neorganicheskie Materialy","1999","35","","17","18","","","","","","","","","","","","","","","","","","","","","","has coordinates","141684","2020-10-21","18:00:00",""
"1521479","4.01","","4.01","","4.01","","90","","90","","90","","64.481","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Pb ((Fe Nb) O6)0.5","","- Fe0.5 Nb0.5 O3 Pb -","- Fe0.5 Nb0.5 O3 Pb1.0002 -","- Fe0.5 Nb0.5 O3 Pb1.0002 -","1","0.0208333","","Lampis, N.; Sciau, P.; Geddo Lehmann, A.","Rietveld refinements of the paraelectric and ferroelectric structures of Pb Fe0.5 Nb0.5 O3","Journal of Physics: Condensed Matter","1999","11","","3489","3500","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521480","5.674","","5.663","","4.013","","90","","89.84","","90","","128.945","","","","","","","","","","","","","4","C 1 m 1","C -2y","8","","Pb (Fe0.5 Nb0.5) O3","","- Fe0.5 Nb0.5 O3 Pb -","- Fe0.5 Nb0.5 O3 Pb -","- Fe Nb O6 Pb2 -","2","0.5","","Lampis, N.; Geddo Lehmann, A.; Sciau, P.","Rietveld refinements of the paraelectric and ferroelectric structures of Pb Fe0.5 Nb0.5 O3","Journal of Physics: Condensed Matter","1999","11","","3489","3500","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521484","13.707","","14.466","","9.366","","90","","133.64","","90","","1343.99","","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","Na2 Rb C60","","- C60 Na2 Rb -","- C60 Na2 Rb -","- C120 Na4 Rb2 -","2","0.5","","Lappas, A.; Brown, C.M.; Kordatos, K.; Prassides, K.; Tanigaki, K.; Suard, E.","Neutron diffraction study of the polymeric structure of Na2 Rb C60","Journal of Physics: Condensed Matter","1999","11","","371","381","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521485","14.0163","","14.0163","","14.0163","","90","","90","","90","","2753.6","","","","","","","","","","","","","2","P a -3","-P 2ac 2ab 3","205","","Na2 Rb C60","","- C60 Rb -","- C60 Rb -","- C240 Rb4 -","4","0.166667","","Lappas, A.; Brown, C.M.; Prassides, K.; Kordatos, K.; Tanigaki, K.; Suard, E.","Neutron diffraction study of the polymeric structure of Na2 Rb C60","Journal of Physics: Condensed Matter","1999","11","","371","381","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521487","9.1189","","9.1189","","9.1189","","90","","90","","90","","758.276","","","","","","","","","","","","","4","P -4 3 n","P -4n 2 3","218","","Ag6 (Al Si O4)6","","- Ag6 Al6 O24 Si6 -","- Ag6 Al6 O24 Si6 -","- Ag6 Al6 O24 Si6 -","1","0.0416667","","Latturner, S.E.; Sachleben, J.; Iversen, B.B.; Hanson, J.C.; Stucky, G.D.","Covalent guest-framework interactions in heavy metal sodalites: structure and properties of thallium and silver sodalite","J. Phys. Chem. B","1999","103","","7135","7144","","","","","","","","","","","","","","","","","","","","","","has coordinates","141698","2020-10-21","18:00:00",""
"1521488","8.9653","","8.9653","","8.9653","","90","","90","","90","","720.6","","","","","","","","","","","","","4","P -4 3 n","P -4n 2 3","218","","Tl6 (Al Si O4)6","","- Al6 O24 Si6 Tl6 -","- Al6 O24 Si6 Tl6 -","- Al6 O24 Si6 Tl6 -","1","0.0416667","","Latturner, S.E.; Sachleben, J.; Iversen, B.B.; Stucky, G.D.; Hanson, J.C.","Covalent guest-framework interactions in heavy metal sodalites: structure and properties of thallium and silver sodalite","J. Phys. Chem. B","1999","103","","7135","7144","","","","","","","","","","","","","","","","","","","","","","has coordinates","141699","2020-10-21","18:00:00",""
"1521510","5.4283","","10.7274","","19.9805","","90","","90","","90","","1163.49","","","","","","","","","","","","","5","I b a m","-I 2 2c","72","","Y2 Sr Cu0.6 Co1.4 O6.5","","- Co1.4 Cu0.6 O6.5 Sr Y2 -","- Co1.4 Cu0.6 O6.5 Sr Y2 -","- Co11.2 Cu4.8 O52 Sr8 Y16 -","8","0.5","","Li, R.-K.; Kremer, R.; Maier, J.","The structure and weak ferromagnetism of the double layered cuprocobaltate : Y2 Sr Cu0.6 Co1.4 O6.5","Journal of Solid State Chemistry","1999","146","","488","493","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521514","3.883","","3.883","","9.3547","","90","","90","","90","","141.047","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Hg0.752 Mo0.252 Ba2 Cu O4.584","","- Ba2 Cu Hg0.752 Mo0.252 O4.584 -","- Ba2 Cu Hg0.752 Mo0.252 O4.584 -","- Ba2 Cu Hg0.752 Mo0.252 O4.584 -","1","0.0625","","Licci, F.; Marezio, M.; Bougerol-Chaillout, C.; Santoro, A.; Huang, Q.; Masini, R.","Synthesis, structure and superconductivity of Hg0.75 Mo0.25 Ba2 Cu O4+d","Physica C (Amsterdam)","1999","325","","41","48","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521515","8.26988","","8.26988","","22.3573","","90","","90","","120","","1324.18","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","La0.333 Ti2 (P O4)3","","- La0.333 O12 P3 Ti2 -","- La0.3335 O12 P3 Ti2 -","- La2.001 O72 P18 Ti12 -","6","0.333333","","Lightfoot, P.; Jorgensen, J.D.; Woodcock, D.A.; Short, S.","Low thermal expansion materials: a comparison of the structural behaviour of La0.33 Ti2 (P O4)3, Sr0.5 Ti2 (P O4)3 and Na Ti2 (P O4)3","International Journal of Inorganic Materials","1999","1","","53","60","","","","","","","","","","","","","","","","","","","","","","has coordinates","141727","2020-10-21","18:00:00",""
"1521518","10.64","","10.64","","10.64","","90","","90","","90","","1204.55","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","K8 (H4 Nb4 W8 O36 (O2)4) (H2 O)18","","- K7.9998 Nb3.996 O44 W8.004 -","- K7.9998 Nb3.996 O44 W8.004 -","- K7.9998 Nb3.996 O44 W8.004 -","1","0.0208333","","Lin, B.-F.; Xie, G.-Y.; Zhu, S.-S.; Chen, J.; Hu, C.-H.","Preparation and structure determination of potassium peroxyniobatungstate","Wuji Huaxue Xuebao","1999","15","","78","82","","","","","","","","","","","","","","","","","","","","","","has coordinates","141730","2020-10-21","18:00:00",""
"1521519","12.49687","","12.49687","","11.24558","","90","","90","","90","","1756.24","","","","","","","","","","","","","3","I 41","I 4bw","80","","Bi34.16 W5.84 O67.68","","- Bi34.16 O67.68 W5.84 -","- Bi34.16 O67.68 W5.84 -","- Bi34.16 O67.68 W5.84 -","1","0.125","","Ling, C.D.","Structural relationships among bismuth-rich phases in the (Bi2 O3)-(Nb2 O5), (Bi2 O3)-(Ta2 O5), (Bi2 O3-Mo O3), and (Bi2 O3)-(W O3) systems","Journal of Solid State Chemistry","1999","148","","380","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","141731","2020-10-21","18:00:00",""
"1521520","16.31799","","16.31799","","38.54199","","90","","90","","90","","10262.8","","","","","","","","","","","","","2","I -4 m 2","I -4 -2","119","","Bi2.938 Nb O7","","- Bi2.9375 Nb -","- Bi2.9375 Nb -","- Bi94 Nb32 -","32","2","","Ling, C.D.","Structural relationships among bismuth-rich phases in the (Bi2 O3)-(Nb2 O5), (Bi2 O3)-(Ta2 O5), (Bi2 O3-Mo O3), and (Bi2 O3)-(W O3) systems","Journal of Solid State Chemistry","1999","148","","380","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521524","15.198","","6.3943","","7.0218","","90","","98.057","","90","","675.647","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Sm2 S Cl4","","- Cl4 S Sm2 -","- Cl4 S Sm2 -","- Cl16 S4 Sm8 -","4","0.5","","Lissner, F.; Schleid, T.","Sm2 S Cl4: ein Sulfidchlorid des dreiwertigen Samariums mit anti-(Si S2)-analogen Ketten (1/infinite)((S Sm4/2)(4+))","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1507","1511","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521525","6.6469","","11.525","","6.9548","","90","","108.78","","90","","504.412","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Na1.912 Zr1.088 S3","","- Na1.912 S3 Zr1.088 -","- Na1.9125 S3 Zr1.0875 -","- Na7.65 S12 Zr4.35 -","4","0.5","","Lissner, F.; Schleid, T.","Na2 Zr S3 : ein ternaeres Sulfid des Zirconiums mit aufgefuellter (Al Cl3)-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","195","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","141737","2020-10-21","18:00:00",""
"1521526","5.86295","","11.74014","","8.20686","","90","","90","","90","","564.893","","","","","","","","","","","","","4","P n n m","-P 2 2n","58","","Pb (Zr0.97 Ti0.03) O3","","- O3 Pb Ti0.03 Zr0.97 -","- O3 Pb Ti0.03 Zr0.97 -","- O24 Pb8 Ti0.24 Zr7.76 -","8","1","","Liu, H.-C.; Toraya, H.","Ab initio structural study on Nb-doped Pb (Zr0.97 Ti0.03) O3 ceramic material by synchrotron X-ray diffraction","Japanese Journal of Applied Physics, Part 1","1999","38","","104","107","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521527","4.08763","","4.08763","","4.06843","","90","","90","","90","","67.978","","","","","","","","","","","","","5","P 4 m m","P 4 -2","99","","Pb0.987 (Zr0.945 Ti0.029 Nb0.026) O3","","- Nb0.026 O3 Pb0.987 Ti0.029 Zr0.945 -","- Nb0.026 O3 Pb0.987 Ti0.029 Zr0.945 -","- Nb0.026 O3 Pb0.987 Ti0.029 Zr0.945 -","1","0.125","","Liu, H.-C.; Toraya, H.","Study on a new tetragonal phase of Nb-doped lead titanate zirconateby synchrotron X-ray powder diffraction","Journal of Physics and Chemistry of Solids","1999","60","","729","735","","","","","","","","","","","","","","","","","","","","","","has coordinates","141739","2020-10-21","18:00:00",""
"1521528","11.379","","13.632","","16.271","","78.2","","71.2","","71.62","","2252.48","","","","","","","","","","","","","5","P -1","-P 1","2","","H8 (P4 W14 O58 Na4 (H2 O)20) (H2 O)16","","- H80 Na4 O94 P4 W14 -","- Na4 O93.999 P4 W14 -","- Na4 O93.999 P4 W14 -","1","0.5","","Liu, Z.-R.; Xu, L.; Wang, L.; Wang, E.-B.; Xing, Y.; Lin, Y.-H.; Jia, H.-Q.","Synthesis, crystal structure and properties of H8 (P4 W14 O58 Na4 (H2 O)20) (H2 O)16","Gaodeng Xuexiao Huaxue Xuebao","1999","20","","1842","1846","","","","","","","","","","","","","","","","","","","","","","has coordinates","141740","2020-10-21","18:00:00",""
"1521530","11.2966","","3.6145","","4.6841","","90","","90","","90","","191.259","","","","","","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","Na V2 O5","","- Na O5 V2 -","- Na O5 V2 -","- Na2 O10 V4 -","2","0.25","","Loa, I.; Syassen, K.; Kremer, R.K.; Schwarz, U.; Hanfland, M.","Structural properties of Na V2 O5 under high pressure","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","6945","6948","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521531","11.2525","","3.6512","","3.8506","","90","","90","","90","","158.202","","","","","","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","Na V2 O5","","- Na O5 V2 -","- Na O5 V2 -","- Na2 O10 V4 -","2","0.25","","Loa, I.; Kremer, R.K.; Syassen, K.; Hanfland, M.; Schwarz, U.","Structural properties of Na V2 O5 under high pressure","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","6945","6948","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521532","5.2885","","5.2885","","7.8626","","90","","90","","90","","219.903","","","","","","","","","","","","","2","P 4/n c c :2","-P 4a 2ac","130","","W O3","","- O3 W -","- O3 W -","- O12 W4 -","4","0.25","","Locherer, K.R.; Swainson, I.P.; Salje, E.K.H.","Transition to a new tetragonal phase of W O3 : crystal structure and distortion parameters","Journal of Physics: Condensed Matter","1999","11","","4143","4156","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521533","5.3031","","5.3031","","3.9348","","90","","90","","90","","110.658","","","","","","","","","","","","","2","P 4/n m m :2","-P 4a 2a","129","","W O3","","- O3 W -","- O3 W -","- O6 W2 -","2","0.125","","Locherer, K.R.; Swainson, I.P.; Salje, E.K.H.","Transition to a new tetragonal phase of W O3 : crystal structure and distortion parameters","Journal of Physics: Condensed Matter","1999","11","","4143","4156","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521534","5.558","","5.558","","3.745","","90","","90","","90","","115.688","","","","","","","","","","","","","2","P 4/n m m :2","-P 4a 2a","129","","W O3","","- O3 W -","- O3 W -","- O6 W2 -","2","0.125","","Locherer, K.R.; Salje, E.K.H.","The refinement of a tetragonal phase of W O3 using a novel PSD high temperature X-ray powder diffractometer","Phase Transition","1999","69","","85","93","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521538","3.4552","","3.4552","","25.1495","","90","","90","","120","","260.02","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","Ta Se2","","- Se2 Ta -","- Se2 Ta -","- Se8 Ta4 -","4","0.166667","","Luedecke, J.; van Smaalen, S.; de Boer, J.L.; Spijkerman, A.; Wiegers, G.A.","Commensurately modulated structure of 4Hb-(Ta Se2) determined by X-ray crystal structure refinement","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","6063","6071","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521539","12.4579","","12.4579","","25.1495","","90","","90","","120","","3380.26","","","","","","","","","","","","","2","P 63/m","-P 6c","176","","Ta Se2","","- Se2 Ta -","- Se2 Ta -","- Se104 Ta52 -","52","4.33333","","Luedecke, J.; van Smaalen, S.; Wiegers, G.A.; de Boer, J.L.; Spijkerman, A.","Commensurately modulated structure of 4Hb-(Ta Se2) determined by X-ray crystal structure refinement","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","59","","6063","6071","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521540","11.17","","11.319","","3.992","","90","","90","","90","","504.721","","","","","","","","","","","","","2","P b n m","-P 2c 2ab","62","","","","- Bi2 S3 -","- Bi2 S3 -","- Bi8 S12 -","4","0.5","","Lukaszewicz, K.; Stepen'-Damm, Yu.; Grigas, J.; Pietraszko, A.; Kajokas, A.","Crystal structure, thermal expansion, dielectric permittivity and phase transitions of Bi2 S3","Polish Journal of Chemistry","1999","73","","541","546","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521541","12.406","","12.406","","10.411","","90","","90","","90","","1602.34","","","","","","","","","","","","","5","P 42/m b c","-P 4c 2ab","135","","Na3.12 Al2 (P O4)2 F3","","- Al2 F3 Na3.12 O8 P2 -","- Al2 F3 Na3.12 O8 P2 -","- Al16 F24 Na24.96 O64 P16 -","8","0.5","","le Meins, J.M.; Crosnier-Lopez, M.P.; Courbion, G.; Hemon-Ribaud, A.","Phase transitions in the Na3 M2 (P O4)2 F3 family (M = Al(3+), V(3+), Cr(3+), Fe(3+), Ga(3+)) : synthesis, thermal, structural and magnetic studies","Journal of Solid State Chemistry","1999","148","","260","277","","","","","","","","","","","","","","","","","","","","","","has coordinates","141753","2020-10-21","18:00:00",""
"1521542","12.382","","12.382","","10.387","","90","","90","","90","","1592.47","","","","","","","","","","","","","5","P 42/m b c","-P 4c 2ab","135","","Na3.296 Al2 (P O4)2 F3","","- Al2 F3 Na3.296 O8 P2 -","- Al2 F3 Na3.296 O8 P2 -","- Al16 F24 Na26.368 O64 P16 -","8","0.5","","le Meins, J.M.; Crosnier-Lopez, M.P.; Hemon-Ribaud, A.; Courbion, G.","Phase transitions in the Na3 M2 (P O4)2 F3 family (M = Al(3+), V(3+), Cr(3+), Fe(3+), Ga(3+)) : synthesis, thermal, structural and magnetic studies","Journal of Solid State Chemistry","1999","148","","260","277","","","","","","","","","","","","","","","","","","","","","","has coordinates","141754","2020-10-21","18:00:00",""
"1521543","9.047","","9.047","","10.705","","90","","90","","90","","876.185","","","","","","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","Na3 V2 (P O4)2 F3","","- F3 Na3 O8 P2 V2 -","- F3 Na3 O8 P2 V2 -","- F12 Na12 O32 P8 V8 -","4","0.25","","le Meins, J.M.; Crosnier-Lopez, M.P.; Hemon-Ribaud, A.; Courbion, G.","Phase transitions in the Na3 M2 (P O4)2 F3 family (M = Al(3+), V(3+), Cr(3+), Fe(3+), Ga(3+)) : synthesis, thermal, structural and magnetic studies","Journal of Solid State Chemistry","1999","148","","260","277","","","","","","","","","","","","","","","","","","","","","","has coordinates","141755","2020-10-21","18:00:00",""
"1521544","12.756","","12.803","","10.602","","90","","90","","90","","1731.47","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","Na3 Fe2 (P O4)2 F3","","- F3 Fe2 Na3 O8 P2 -","- F3 Fe2 Na3 O8 P2 -","- F24 Fe16 Na24 O64 P16 -","8","1","","le Meins, J.M.; Crosnier-Lopez, M.P.; Hemon-Ribaud, A.; Courbion, G.","Phase transitions in the Na3 M2 (P O4)2 F3 family (M = Al(3+), V(3+), Cr(3+), Fe(3+), Ga(3+)) : synthesis, thermal, structural and magnetic studies","Journal of Solid State Chemistry","1999","148","","260","277","","","","","","","","","","","","","","","","","","","","","","has coordinates","141756","2020-10-21","18:00:00",""
"1521545","4.017","","4.017","","7.179","","90","","90","","90","","115.842","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Mn0.95 Ti0.05) Si","","- Gd Mn0.95 Si Ti0.05 -","- Gd Mn0.95 Si Ti0.05 -","- Gd2 Mn1.9 Si2 Ti0.1 -","2","0.125","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521546","4.016","","4.016","","7.227","","90","","90","","90","","116.559","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Mn0.85 Ti0.15) Si","","- Gd Mn0.85 Si Ti0.15 -","- Gd Mn0.85 Si Ti0.15 -","- Gd2 Mn1.7 Si2 Ti0.3 -","2","0.125","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521547","4.015","","4.015","","7.262","","90","","90","","90","","117.065","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Mn0.75 Ti0.25) Si","","- Gd Mn0.75 Si Ti0.25 -","- Gd Mn0.75 Si Ti0.25 -","- Gd2 Mn1.5 Si2 Ti0.5 -","2","0.125","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521548","4.013","","4.013","","7.288","","90","","90","","90","","117.367","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Mn0.7 Ti0.3) Si","","- Gd Mn0.7 Si Ti0.3 -","- Gd Mn0.7 Si Ti0.3 -","- Gd2 Mn1.4 Si2 Ti0.6 -","2","0.125","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521549","4.017","","4.017","","7.327","","90","","90","","90","","118.231","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Mn0.6 Ti0.4) Si","","- Gd Mn0.6 Si Ti0.4 -","- Gd Mn0.6 Si Ti0.4 -","- Gd2 Mn1.2 Si2 Ti0.8 -","2","0.125","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521550","8.489","","8.489","","6.359","","90","","90","","120","","396.856","","","","","","","","","","","","","4","P 63/m c m","-P 6c 2","193","","Gd (Mn0.6 Ti0.4) Si","","- Gd Mn0.6 Si Ti0.4 -","- Gd Mn0.6 Si Ti0.4 -","- Gd6 Mn3.6 Si6 Ti2.4 -","6","0.25","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521551","4.022","","4.022","","7.336","","90","","90","","90","","118.671","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Mn0.5 Ti0.5) Si","","- Gd Mn0.5 Si Ti0.5 -","- Gd Mn0.5 Si Ti0.5 -","- Gd2 Mn Si2 Ti -","2","0.125","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521552","8.491","","8.491","","6.385","","90","","90","","120","","398.666","","","","","","","","","","","","","4","P 63/m c m","-P 6c 2","193","","Gd (Mn0.5 Ti0.5) Si","","- Gd Mn0.5 Si Ti0.5 -","- Gd Mn0.5 Si Ti0.5 -","- Gd6 Mn3 Si6 Ti3 -","6","0.25","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521553","4.028","","4.028","","7.392","","90","","90","","90","","119.934","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Mn0.4 Ti0.6) Si","","- Gd Mn0.4 Si Ti0.6 -","- Gd Mn0.4 Si Ti0.6 -","- Gd2 Mn0.8 Si2 Ti1.2 -","2","0.125","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521554","8.498","","8.498","","6.415","","90","","90","","120","","401.2","","","","","","","","","","","","","4","P 63/m c m","-P 6c 2","193","","Gd (Mn0.4 Ti0.6) Si","","- Gd Mn0.4 Si Ti0.6 -","- Gd Mn0.4 Si Ti0.6 -","- Gd6 Mn2.4 Si6 Ti3.6 -","6","0.25","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521555","8.508","","8.508","","6.418","","90","","90","","120","","402.333","","","","","","","","","","","","","4","P 63/m c m","-P 6c 2","193","","Gd (Mn0.333 Ti0.667) Si","","- Gd Mn0.333 Si Ti0.667 -","- Gd Mn0.333333 Si Ti0.666667 -","- Gd6 Mn2 Si6 Ti4 -","6","0.25","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521556","8.507","","8.507","","6.409","","90","","90","","120","","401.674","","","","","","","","","","","","","4","P 63/m c m","-P 6c 2","193","","Gd (Mn0.3 Ti0.7) Si","","- Gd Mn0.3 Si Ti0.7 -","- Gd Mn0.3 Si Ti0.7 -","- Gd6 Mn1.8 Si6 Ti4.2 -","6","0.25","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521557","4.038","","4.038","","7.631","","90","","90","","90","","124.427","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","Gd (Mn0.1 Ti0.9) Si","","- Gd Mn0.1 Si Ti0.9 -","- Gd Mn0.1 Si Ti0.9 -","- Gd2 Mn0.2 Si2 Ti1.8 -","2","0.125","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521558","8.471","","8.471","","6.398","","90","","90","","120","","397.598","","","","","","","","","","","","","4","P 63/m c m","-P 6c 2","193","","Gd (Mn0.1 Ti0.9) Si","","- Gd Mn0.1 Si Ti0.9 -","- Gd Mn0.1 Si Ti0.9 -","- Gd6 Mn0.6 Si6 Ti5.4 -","6","0.25","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521559","4.046","","4.046","","7.64","","90","","90","","90","","125.068","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Gd Ti Si","","- Gd Si Ti -","- Gd Si Ti -","- Gd2 Si2 Ti2 -","2","0.125","","Morozkin, A.V.","Quarternary Gd3 Ti2 Mn Si3 compound in the Gd Mn1-x Tix Si (x=0,. ..1) section of Gd - Mn- Ti- Si system at 1073 K","Journal of Alloys Compd.","1999","292","","162","165","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521635","7.0832","","7.0832","","10.8948","","90","","90","","120","","473.379","","","","","","","","","","","","","4","P -6 2 c","P -6c -2c","190","","La3 F3 (Si3 O9)","","- F3 La3 O9 Si3 -","- F3 La3 O9 Si3 -","- F6 La6 O18 Si6 -","2","0.166667","","Mueller-Bunz, H.; Schleid, T.","La3 F3 (Si3 O9): das erste Fluoridsilicat aus dem ternaeren System La F3 / La2 O3 / Si O2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1377","1383","","","","","","","","","","","","","","","","","","","","","","has coordinates","141848","2020-10-21","18:00:00",""
"1521636","8.9964","","6.8328","","6.6503","","90","","105.952","","90","","393.056","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Er2 O (Si O4)","","- Er2 O5 Si -","- Er2 O5 Si -","- Er8 O20 Si4 -","4","1","","Mueller-Bunz, H.; Schleid, T.","Ueber die Oxidsilicate M2 O (Si O4) der schweren Lanthanoide (M = Dy - Lu) im A-Typ","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","613","618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521637","9.0017","","6.7874","","6.6271","","90","","105.436","","90","","390.298","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Tm2 O (Si O4)","","- O5 Si Tm2 -","- O5 Si Tm2 -","- O20 Si4 Tm8 -","4","1","","Mueller-Bunz, H.; Schleid, T.","Ueber die Oxidsilicate M2 O (Si O4) der schweren Lanthanoide (M = Dy - Lu) im A-Typ","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","613","618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521638","8.987","","6.706","","6.5951","","90","","104.18","","90","","385.355","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Lu2 O (Si O4)","","- Lu2 O5 Si -","- Lu2 O5 Si -","- Lu8 O20 Si4 -","4","1","","Mueller-Bunz, H.; Schleid, T.","Ueber die Oxidsilicate M2 O (Si O4) der schweren Lanthanoide (M = Dy - Lu) im A-Typ","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","613","618","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521641","10.884","","10.884","","10.884","","90","","90","","90","","1289.33","","","","","","","","","","","","","7","F m -3 m","-F 4 2 3","225","","Cd (Cr0.333 Ir0.333 (C N)4) (H2 O)4.333","","- C4 H8.666 Cd Cr0.333 Ir0.333 N4 O4.333 -","- C4.002 Cd Cr0.333 Ir0.333 N4.002 O4.333 -","- C16.008 Cd4 Cr1.332 Ir1.332 N16.008 O17.332 -","4","0.0208333","","Mullica, D.F.; Farmer, J.M.; Kautz, J.A.","X-ray crystallographic investigations and characterizations of three mixed anionic hexacyano complexes","Journal of Coordination Chemistry","1999","48","","449","457","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521642","10.396","","10.396","","10.396","","90","","90","","90","","1123.57","","","","","","","","","","","","","6","F m -3 m","-F 4 2 3","225","","Co (Co0.333 Ir0.333 (C N)4) (H2 O)4.333","","- C4 H8.666 Co1.333 Ir0.333 N4 O4.333 -","- C4.002 Co1.333 Ir0.333 N4.002 O4.333 -","- C16.008 Co5.332 Ir1.332 N16.008 O17.332 -","4","0.0208333","","Mullica, D.F.; Farmer, J.M.; Kautz, J.A.","X-ray crystallographic investigations and characterizations of three mixed anionic hexacyano complexes","Journal of Coordination Chemistry","1999","48","","449","457","","","","","","","","","","","","","","","","","","","","","","has coordinates","141855","2020-10-21","18:00:00",""
"1521643","10.455","","10.455","","10.455","","90","","90","","90","","1142.81","","","","","","","","","","","","","7","F m -3 m","-F 4 2 3","225","","Pd (Cr0.333 Ir0.333 (C N)4) (H2 O)4.333","","- C4 H8.666 Cr0.333 Ir0.333 N4 O4.333 Pd -","- C4.002 Cr0.333 Ir0.333 N4.002 O4.333 Pd -","- C16.008 Cr1.332 Ir1.332 N16.008 O17.332 Pd4 -","4","0.0208333","","Mullica, D.F.; Farmer, J.M.; Kautz, J.A.","X-ray crystallographic investigations and characterizations of three mixed anionic hexacyano complexes","Journal of Coordination Chemistry","1999","48","","449","457","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521644","8.684","","5.23","","8.84","","90","","93.21","","90","","400.859","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Cs Nb (P O4)2","","- Cs Nb O8 P2 -","- Cs Nb O8 P2 -","- Cs2 Nb2 O16 P4 -","2","0.25","","Murashova, E.V.; Chudinova, N.N.","Synthesis and crystal structure of Cs Nb (P O4)2","Kristallografiya","1999","44","","1024","1026","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521645","7.238","","11.27","","5.217","","90","","107.84","","90","","405.1","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Bi Co P O5","","- Bi Co O5 P -","- Bi Co O5 P -","- Bi4 Co4 O20 P4 -","4","1","","Nadir, S.; Swinnea, J.S.; Steinfink, H.","Crystal structure and physical properties of Bi Co P O5","Journal of Solid State Chemistry","1999","148","","295","301","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521646","7.5115","","10.6775","","7.4468","","90","","90","","90","","597.263","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(N H4) Ca Cl3","","- Ca Cl3 H4 N -","- Ca Cl3 H4 N -","- Ca4 Cl12 H16 N4 -","4","0.5","","Naegele, A.; Meyer, H.J.; Glaser, J.; Gibson, K.","N H4 Ca Cl3, die reaktive Zwischenstufe in einer Synthese von Ca Cl2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1940","1943","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521647","12.813","","7.397","","11.625","","90","","100.575","","90","","1083.08","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ho2 (Mn0.6 Nb1.4) O7","","- Ho2 Mn0.6 Nb1.4 O7 -","- Ho2 Mn0.6 Nb1.4 O7 -","- Ho16 Mn4.8 Nb11.2 O56 -","8","1","","Nakano, H.; Kishigami, A.; Hisa, M.; Kamegashira, N.","Microstructural investigation of a new complex oxide Ho2 Mn2/3 Nb4/3 O7 with a pyrochlore-related structure","Materials Research Bulletin","1999","34","","2075","2084","","","","","","","","","","","","","","","","","","","","","","has coordinates","141860","2020-10-21","18:00:00",""
"1521648","8.33801","","8.33801","","8.33801","","90","","90","","90","","579.679","","","","","","","","","","","","","4","F d -3 m :1","F 4d 2 3 -1d","227","","Li (Li0.2 Cr0.4 Ti1.4) O4","","- Cr0.4 Li1.2 O4 Ti1.4 -","- Cr0.4 Li1.2 O4 Ti1.4 -","- Cr3.2 Li9.6 O32 Ti11.2 -","8","0.0416667","","Nakayama, M.; Ikuta, H.; Ishida, Y.; Wakihara, M.","Mixed conduction for the spinel type (1 - x)(Li4/3 Ti5/3 O4) - x(Li Cr Ti O4) system","Solid State Ionics","1999","117","","265","271","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521649","8.31905","","8.31905","","8.31905","","90","","90","","90","","575.733","","","","","","","","","","","","","4","F d -3 m :1","F 4d 2 3 -1d","227","","Li (Li0.067 Cr0.8 Ti1.133) O4","","- Cr0.8 Li1.067 O4 Ti1.133 -","- Cr0.8 Li1.066 O4 Ti1.134 -","- Cr6.4 Li8.528 O32 Ti9.072 -","8","0.0416667","","Nakayama, M.; Ishida, Y.; Ikuta, H.; Wakihara, M.","Mixed conduction for the spinel type (1 - x)(Li4/3 Ti5/3 O4) - x(Li Cr Ti O4) system","Solid State Ionics","1999","117","","265","271","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521650","7.2228","","7.2228","","7.2228","","90","","90","","90","","376.805","","","","","","","","","","","","","3","I m -3","-I 2 2 3","204","","U Fe4 P12","","- Fe4 P12 U -","- Fe4 P12 U -","- Fe8 P24 U2 -","2","0.0416667","","Nakotte, H.; Maple, M.B.; Dilley, N.R.; Torikachvili, M.S.; Majkrzak, C.F.; Bordallo, H.N.; Schultz, A.J.; Christianson, A.; Chang, S.; Shirane, G.","Structural and magnetic properties of the Kondo insulator U Fe4 P12","Physik (Berlin)","1999","259","","280","282","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521651","5.346","","5.346","","13.218","","90","","90","","90","","377.767","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.894 Sr0.106) (Cu O4)","","- Cu La1.894 O4 Sr0.106 -","- Cu La1.894 O4 Sr0.106 -","- Cu2 La3.788 O8 Sr0.212 -","2","0.0625","","Napoletano, M.; Gallardo Amores, J.M.; Magnone, E.; Busca, G.; Ferretti, M.","Skeletal infrared spectra and structural properties of La2-x Srx Cu O4 and La2-x Bax Cu O4 cuprate powders in the 0 < x < 0.125 region","Physica C (Amsterdam)","1999","319","","229","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521652","5.35","","13.154","","5.398","","90","","90","","90","","379.878","","","","","","","","","","","","","4","C m c a","-C 2ac 2","64","","(La1.978 Sr0.022) (Cu O4)","","- Cu La1.978 O4 Sr0.022 -","- Cu La1.978 O4 Sr0.022 -","- Cu4 La7.912 O16 Sr0.088 -","4","","","Napoletano, M.; Gallardo Amores, J.M.; Ferretti, M.; Busca, G.; Magnone, E.","Skeletal infrared spectra and structural properties of La2-x Srx Cu O4 and La2-x Bax Cu O4 cuprate powders in the 0 < x < 0.125 region","Physica C (Amsterdam)","1999","319","","229","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521653","5.351","","5.351","","13.26","","90","","90","","90","","379.676","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(La1.87 Ba0.13) (Cu O4)","","- Ba0.13 Cu La1.87 O4 -","- Ba0.13 Cu La1.87 O4 -","- Ba0.26 Cu2 La3.74 O8 -","2","0.0625","","Napoletano, M.; Magnone, E.; Gallardo Amores, J.M.; Busca, G.; Ferretti, M.","Skeletal infrared spectra and structural properties of La2-x Srx Cu O4 and La2-x Bax Cu O4 cuprate powders in the 0 < x < 0.125 region","Physica C (Amsterdam)","1999","319","","229","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521669","10.611","","18.37","","13.271","","90","","90","","90","","2586.84","","","","","","","","","","","","","8","I m m a","-I 2b 2","74","","Cs2 Co (S8 (Re (C N))6) (H2 O)2","","- C6 H4 Co Cs2 N6 O2 Re6 S8 -","- C6 Co Cs2 N6 O2 Re6 S8 -","- C24 Co4 Cs8 N24 O8 Re24 S32 -","4","0.25","","Naumov, N.G.; Virovets, A.V.; Artemkina, S.B.; Mironov, Yu.I.; Fedorov, V.E.","Synthesis and crystal structure of new layered cluster cyanides Cs2 M (Re6 S8 (C N)6) . 2(H2 O) (M = Mn(2+), Fe(2+), Co(2+), Cd(2+)): size control over framework dimension","Ukrains'kii Khimicheskii Zhurnal (Russian Edition)","1999","65","","21","27","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521672","4.038","","4.038","","19.942","","90","","90","","120","","281.6","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Pr Zn3 P3","","- P3 Pr Zn3 -","- P3 Pr Zn3 -","- P6 Pr2 Zn6 -","2","0.0833333","","Nientiedt, A.T.; Jeitschko, W.","The series of rare earth zinc phosphides R Zn3 P3 (R = Y, La - Nd, Sm, Gd - Er) and the corresponding cadmium compound Pr Cd3 P3","Journal of Solid State Chemistry","1999","146","","478","483","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521673","4.265","","4.265","","20.897","","90","","90","","120","","329.195","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Pr Cd3 P3","","- Cd3 P3 Pr -","- Cd3 P3 Pr -","- Cd6 P6 Pr2 -","2","0.0833333","","Nientiedt, A.T.; Jeitschko, W.","The series of rare earth zinc phosphides R Zn3 P3 (R = Y, La - Nd, Sm, Gd - Er) and the corresponding cadmium compound Pr Cd3 P3","Journal of Solid State Chemistry","1999","146","","478","483","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521678","10.201","","10.201","","9.996","","90","","90","","90","","1040.19","","","","","","","","","","","","","2","P 41","P 4w","76","","","","- B5 H9 -","- B5 H9 -","- B40 H72 -","8","2","","Nordman, C.E.","The crystal structure of B5 H9 below the 136.7 K phase transition","Journal of Molecular Structure","1999","485","","299","303","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521681","11.287","","3.621","","4.598","","90","","90","","90","","187.921","","","","","","","","","","","","","3","P m m n :1","P 2 2ab -1ab","59","","Na (V2 O5)","","- Na O5 V2 -","- Na O5 V2 -","- Na2 O10 V4 -","2","0.25","","Ohwada, K.; Nakao, H.; Fujii, Y.; Isobe, M.; Ueda, Y.","Structural aspects of Na V2 O5 under high pressure","Journal of the Physical Society of Japan","1999","68","","3286","3291","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521684","10.74","","10.74","","10.74","","90","","90","","90","","1238.83","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Cd0.967 Ga0.022) Cr2 Se4","","- Cd0.967 Cr2 Ga0.022 Se4 -","- Cd0.967 Cr2 Ga0.022 Se4 -","- Cd7.736 Cr16 Ga0.176 Se32 -","8","0.0416667","","Okonska-Kozlowska, I.; Malicka, E.; Nagel, R.; Lutz, H.D.","Growth of Mx Ga2/3(1-x) Cr2 Se4 (M = Cd, Zn) single crystals by chemical vapour transport and their crystal structure","Journal of Alloys Compd.","1999","292","","90","95","","","","","","","","","","","","","","","","","","","","","","has coordinates","141897","2020-10-21","18:00:00",""
"1521691","5.3958","","5.3958","","3.8442","","90","","90","","90","","111.923","","","","","","","","","","","","","3","P 4/m b m","-P 4 2ab","127","","Ce B2 C2","","- C2 B2 Ce -","- C2 B2 Ce -","- C4 B4 Ce2 -","2","0.125","","Onimaru, T.; Onodera, H.; Yamauchi, H.; Yamaguchi, Y.; Ohoyama, K.","Neutron powder diffraction on Ce(11) B2 C2 and Nd(11) B2 C2: a new model for the tetragonal crystal structure","Journal of the Physical Society of Japan","1999","68","","2287","2291","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521692","5.3814","","5.3814","","3.7657","","90","","90","","90","","109.053","","","","","","","","","","","","","3","P 4/m b m","-P 4 2ab","127","","Nd B2 C2","","- C2 B2 Nd -","- C2 B2 Nd -","- C4 B4 Nd2 -","2","0.125","","Onimaru, T.; Yamaguchi, Y.; Onodera, H.; Ohoyama, K.; Yamauchi, H.","Neutron powder diffraction on Ce(11) B2 C2 and Nd(11) B2 C2: a new model for the tetragonal crystal structure","Journal of the Physical Society of Japan","1999","68","","2287","2291","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521695","14.301","","3.598","","5.204","","90","","90","","90","","267.772","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Cd (V O3)","","- Cd O3 V -","- Cd O3 V -","- Cd4 O12 V4 -","4","0.5","","Onoda, M.; Nishiguchi, N.","S=1/2 zigzag-chain structure and ferromagnetism of Cd V O3","Journal of Physics: Condensed Matter","1999","11","","749","757","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521696","11.328","","3.6","","4.881","","90","","90","","90","","199.051","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","(Ca0.95 Na0.05) (V2 O5)","","- Ca0.95 Na0.05 O5 V2 -","- Ca0.95 Na0.05 O5 V2 -","- Ca1.9 Na0.1 O10 V4 -","2","0.25","","Onoda, M.; Kagami, T.","Crystal structures and electronic properties in the crossover region between the spin-gap system Ca V2 O5 and the linear-chain system Na V2 O5","Journal of Physics: Condensed Matter","1999","11","","3475","3488","","","","","","","","","","","","","","","","","","","","","","has coordinates","141909","2020-10-21","18:00:00",""
"1521697","11.294","","3.606","","4.806","","90","","90","","90","","195.73","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","(Ca0.17 Na0.83) (V2 O5)","","- Ca0.17 Na0.83 O5 V2 -","- Ca0.17 Na0.83 O5 V2 -","- Ca0.34 Na1.66 O10 V4 -","2","0.25","","Onoda, M.; Kagami, T.","Crystal structures and electronic properties in the crossover region between the spin-gap system Ca V2 O5 and the linear-chain system Na V2 O5","Journal of Physics: Condensed Matter","1999","11","","3475","3488","","","","","","","","","","","","","","","","","","","","","","has coordinates","141910","2020-10-21","18:00:00",""
"1521698","7.3164","","7.3164","","11.7679","","90","","90","","120","","545.537","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Cu8 Ge Se6 -","- Cu8.001 Ge Se6 -","- Cu16.002 Ge2 Se12 -","2","0.166667","","Onoda, M.; Ishii, M.; Pattison, P.; Shibata, K.; Yamamoto, A.; Chapuis, G.","Superspace-group approach to the phase transition of Cu8 Ge Se6","Journal of Solid State Chemistry","1999","146","","355","362","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521702","8.544","","12.998","","7.181","","90","","116.16","","90","","715.796","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","K (Al Si3 O8)","","- Al K O8 Si3 -","- Al K O8 Si3 -","- Al4 K4 O32 Si12 -","4","0.5","","Organova, N.I.; Nasdekin, V.V.; Rozhdestvenskaya, I.V.; Marsii, I.M.; Ivanova, T.I.; Zakharov, N.D.; Borisovskii, S.B.","Structures of the K- and Na-components of two-phase feldspar from Primor'e","Kristallografiya","1999","44","","829","834","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521703","8.544","","12.998","","7.181","","90","","116.16","","90","","715.796","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","K0.95 (Al Si3 O8)","","- Al K0.95 O8 Si3 -","- Al K0.95 O8 Si3 -","- Al4 K3.8 O32 Si12 -","4","","","Organova, N.I.; Zakharov, N.D.; Rozhdestvenskaya, I.V.; Ivanova, T.I.; Marsii, I.M.; Borisovskii, S.B.; Nasdekin, V.V.","Structures of the K- and Na-components of two-phase feldspar from Primor'e","Kristallografiya","1999","44","","829","834","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521704","8.126","","12.996","","7.164","","90","","116.65","","90","","676.183","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Na (Al Si3 O8)","","- Al Na O8 Si3 -","- Al Na O8 Si3 -","- Al4 Na4 O32 Si12 -","4","0.5","","Organova, N.I.; Marsii, I.M.; Zakharov, N.D.; Ivanova, T.I.; Rozhdestvenskaya, I.V.; Borisovskii, S.B.; Nasdekin, V.V.","Structures of the K- and Na-components of two-phase feldspar from Primor'e","Kristallografiya","1999","44","","829","834","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521705","3.9217","","3.9217","","18.22539","","90","","90","","90","","280.302","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","(Cu2 S2) (Sr2 Cu O2)","","- Cu3 O2 S2 Sr2 -","- Cu3 O2 S2 Sr2 -","- Cu6 O4 S4 Sr4 -","2","0.0625","","Otzschi, K.; Ogino, H.; Kishio, K.; Shimoyama, J.-I.","New candidates for superconductors; a series of layered oxysulfides (Cu2 S2) (Srn+1 Mn O3n-1)","Journal of Low Temperature Physics","1999","117","","729","733","","","","","","","","","","","","","","","","","","","","","","has coordinates","141919","2020-10-21","18:00:00",""
"1521706","3.9248","","3.9248","","18.12019","","90","","90","","90","","279.124","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Cu2 S2) (Sr2 Ni O2)","","- Cu2 Ni O2 S2 Sr2 -","- Cu2 Ni O2 S2 Sr2 -","- Cu4 Ni2 O4 S4 Sr4 -","2","0.0625","","Otzschi, K.; Ogino, H.; Shimoyama, J.-I.; Kishio, K.","New candidates for superconductors; a series of layered oxysulfides (Cu2 S2) (Srn+1 Mn O3n-1)","Journal of Low Temperature Physics","1999","117","","729","733","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521707","4.0758","","4.0758","","25.985","","90","","90","","90","","431.667","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","(Cu2 S2) (Sr3 Sc2 O5)","","- Cu2 O5 S2 Sc2 Sr3 -","- Cu2 O5 S2 Sc2 Sr3 -","- Cu4 O10 S4 Sc4 Sr6 -","2","0.0625","","Otzschi, K.; Shimoyama, J.-I.; Ogino, H.; Kishio, K.","New candidates for superconductors; a series of layered oxysulfides (Cu2 S2) (Srn+1 Mn O3n-1)","Journal of Low Temperature Physics","1999","117","","729","733","","","","","","","","","","","","","","","","","","","","","","has coordinates","141921","2020-10-21","18:00:00",""
"1521708","4.97342","","4.97342","","13.6895","","90","","90","","120","","293.244","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","(Cr0.7 V0.3)2 O3","","- Cr1.4 O3 V0.6 -","- Cr1.4 O3 V0.6 -","- Cr8.4 O18 V3.6 -","6","0.166667","","Oyama, T.; Ishii, T.; Takeuchi, K.; Iimura, Y.","Synthesis of (Crx V1-x)2 O3 fine particles by a laser-induced vapor-phase reaction and their crystal structure","Journal of Materials Science","1999","34","","439","444","","","","","","","","","","","","","","","","","","","","","","has coordinates","141922","2020-10-21","18:00:00",""
"1521709","4.99532","","4.99532","","13.8748","","90","","90","","120","","299.836","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","(Cr0.15 V0.85)2 O3","","- Cr0.3 O3 V1.7 -","- Cr0.3 O3 V1.7 -","- Cr1.8 O18 V10.2 -","6","0.166667","","Oyama, T.; Takeuchi, K.; Iimura, Y.; Ishii, T.","Synthesis of (Crx V1-x)2 O3 fine particles by a laser-induced vapor-phase reaction and their crystal structure","Journal of Materials Science","1999","34","","439","444","","","","","","","","","","","","","","","","","","","","","","has coordinates","141923","2020-10-21","18:00:00",""
"1521718","9.90705","","9.90705","","9.90705","","90","","90","","90","","972.373","","","","","","","","","","","","","4","F -4 3 m","F -4 2 3","216","","Fe0.5 Cu0.5 Cr2 S4","","- Cr2 Cu0.5 Fe0.5 S4 -","- Cr2 Cu0.5 Fe0.5 S4 -","- Cr16 Cu4 Fe4 S32 -","8","0.0833333","","Palmer, H.M.; Greaves, C.","Structure and properties of some thiospinels","High Temperature Superconductor and Novel Inorganic Materials","1999","62","","251","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","141932","2020-10-21","18:00:00",""
"1521719","5.5586","","5.555","","7.8155","","90","","90","","90","","241.327","","","","","","","","","","","","","5","I m m m","-I 2 2","71","","La Ba Fe Cu O5.5","","- Ba Cu Fe La O5.5 -","- Ba Cu Fe La O5.5 -","- Ba2 Cu2 Fe2 La2 O11 -","2","0.125","","Pardo, H.; Negreira, C.A.; Ortiz, W.A.; Toby, B.; Suescun, L.; Araujo-Moreira, F.M.; Mombru, A.W.; Quagliata, E.; Prassides, K.","A new structure in the RE Ba Cu Fe O5+d series: La Ba Cu Fe O5+d. Structure and magnetic properties in the La1-x Prx Ba Cu Fe O5+d system","Physica C (Amsterdam)","1999","313","","105","114","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521720","3.9233","","3.9233","","3.9233","","90","","90","","90","","60.389","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","(La0.5 Ba0.5) (Fe0.5 Cu0.5) O2.67","","- Ba0.5 Cu0.5 Fe0.5 La0.5 O2.67 -","- Ba0.5 Cu0.5 Fe0.5 La0.5 O2.67 -","- Ba0.5 Cu0.5 Fe0.5 La0.5 O2.67 -","1","0.0208333","","Pardo, H.; Toby, B.; Araujo-Moreira, F.M.; Ortiz, W.A.; Suescun, L.; Quagliata, E.; Prassides, K.; Negreira, C.A.; Mombru, A.W.","A new structure in the RE Ba Cu Fe O5+d series: La Ba Cu Fe O5+d. Structure and magnetic properties in the La1-x Prx Ba Cu Fe O5+d system","Physica C (Amsterdam)","1999","313","","105","114","","","","","","","","","","","","","","","","","","","","","","has coordinates","141934","2020-10-21","18:00:00",""
"1521728","5.40361","","5.46152","","7.69288","","90","","90.034","","90","","227.032","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Na2 (Sn Te O6)","","- Na2 O6 Sn Te -","- Na2 O6 Sn Te -","- Na4 O12 Sn2 Te2 -","2","0.5","","Park, J.-H.; Lubomirsky, I.; Woodward, P.M.; Parise, J.B.; Stafsudd, O.","Synthesis, structure and dielectric properties of Na2 Sn Te O6","Materials Research Society Symposia Proceedings","1999","547","","139","144","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521730","5.2723","","5.3026","","24.006","","90","","90","","90.59","","671.098","","","","","","","","","","","","","4","P 1 1 21","P 2c","4","","Bi Sr3 Co O5.8","","- Bi Co O5.8 Sr3 -","- Bi Co O5.8 Sr3 -","- Bi4 Co4 O23.2 Sr12 -","4","2","","Pelloquin, D.; Hervieu, M.; Masset, A.C.; Maignan, A.; Michel, C.; Raveau, B.","A strontium-rich 2201-type cobaltite with a nonmodulated structure: Bi1-x Sr3+x Co O6-d","Journal of Solid State Chemistry","1999","148","","108","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521738","11.755","","13.0493","","16.289","","77.13","","82.92","","89.65","","2416.71","","","","","","","","","","","","","5","P -1","-P 1","2","","K7 Na3 (H2 W12 O42) (H2 O)6","","- H14 K7 Na3 O48 W12 -","- K7 Na3 O48 W12 -","- K14 Na6 O96 W24 -","2","1","","Peng, J.; Liu, J.; Wang, E.-B.; Jia, H.-Q.; Xin, M.-H.; Lin, Y.-H.; Xing, Y.","Crystal structure of mixed sodium-potassium paradodecatungstate 6-hydrate","Jiegon Huaxue","1999","18","","239","244","","","","","","","","","","","","","","","","","","","","","","has coordinates","141952","2020-10-21","18:00:00",""
"1521748","9.9619","","5.5578","","12.9555","","90","","105.169","","90","","692.305","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","K2 Zr (Ge2 O7)","","- Ge2 K2 O7 Zr -","- Ge2 K2 O7 Zr -","- Ge8 K8 O28 Zr4 -","4","0.5","","Pertierra, P.; Salvado, M.A.; Garcia-Granda, S.; Clearfield, A.; Trabajo, C.; Bortun, A.I.; Garcia, J.R.","Synthesis, characterization and X-ray powder structure of K2 Zr Ge2 O7","Journal of Solid State Chemistry","1999","148","","41","49","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521752","7.638","","11.862","","6.701","","92.4","","94.23","","105.65","","581.816","","","","","","","","","","","","","6","P -1","-P 1","2","","(Mn4.51 Ca0.21 Fe0.10 Mg0.17) (Si5 O15)","","- Ca0.21 Fe0.1 Mg0.17 Mn4.51 O15 Si5 -","- Ca0.214 Fe0.103 Mg0.172 Mn4.511 O15 Si5 -","- Ca0.428 Fe0.206 Mg0.344 Mn9.022 O30 Si10 -","2","1","","Pertlik, F.; Zahiri, R.","Rhodonite with a low calcium content: crystal structure determination and crystal chemical calculations","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","1999","130","","257","265","","","","","","","","","","","","","","","","","","","","","","has coordinates","141966","2020-10-21","18:00:00",""
"1521754","7.3905","","4.088","","10.0209","","90","","90","","90","","302.755","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Pb (O D) Br","","- Br D O Pb -","- Br D O Pb -","- Br4 D4 O4 Pb4 -","4","0.5","","Peter, S.; Parise, J.B.; Smith, R.I.; Lutz, H.D.","High-pressure neutron diffraction studies on laurionite-type Pb (O D) Br","Journal of Physics and Chemistry of Solids","1999","60","","1859","1863","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521757","7.3502","","7.3502","","10.3873","","90","","90","","120","","485.995","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","(Cu Cl) (Cu2 (Te S3))","","- Cl Cu3 S3 Te -","- Cl1.001 Cu3 S3 Te -","- Cl3.003 Cu9 S9 Te3 -","3","0.166667","","Pfitzner, A.; Reiser, S.; Nilges, T.; Kockelmann, W.","Composite copper chalcogenide halides: neutron powder diffraction of Cu Cl Cu2 Te S3 and electrical properties of Cu Cl Cu2 Te S3, (Cu I)2 Cu3 Sb S3, and (Cu I)3 Cu2 Te S3","Journal of Solid State Chemistry","1999","147","","170","176","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521759","25.08","","25.08","","25.08","","90","","90","","90","","15775.5","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","Na0.99 Ba46.32 Si98.37 Al93.63 O384 (D2 O)51.296","","- Al93.63 Ba46.32 D102.592 Na0.99 O435.296 Si98.37 -","- Al93.6384 Ba46.32 D102.586 Na0.992 O435.296 Si98.3616 -","- Al93.6384 Ba46.32 D102.586 Na0.992 O435.296 Si98.3616 -","1","0.00520833","","Pichon, C.; Methivier, A.; Simonot-Grange, M.H.; Baerlocher, C.","Location of water and xylene molecules adsorbed on prehydrated zeolite BaX. A low-temperature neutron powder diffraction study","J. Phys. Chem. B","1999","103","","10197","10203","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521761","25.15","","25.15","","25.15","","90","","90","","90","","15907.9","","","","","","","","","","","","","7","F d -3 m :2","-F 4vw 2vw 3","227","","Na1.50 Ba43.31 Si103.88 Al88.12 O384 (D2 O)53.76 (C8 D10)26.304","","- C210.432 Al88.12 Ba43.31 D370.56 Na1.5 O437.76 Si103.88 -","- C210.432 Al88.128 Ba43.312 D370.56 Na1.504 O437.76 Si103.872 -","- C210.432 Al88.128 Ba43.312 D370.56 Na1.504 O437.76 Si103.872 -","1","0.00520833","","Pichon, C.; Methivier, A.; Baerlocher, C.; Simonot-Grange, M.H.","Location of water and xylene molecules adsorbed on prehydrated zeolite BaX. A low-temperature neutron powder diffraction study","J. Phys. Chem. B","1999","103","","10197","10203","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521763","25.12","","25.12","","25.12","","90","","90","","90","","15851.1","","","","","","","","","","","","","7","F d -3 m :2","-F 4vw 2vw 3","227","","Na1.09 Ba43.62 Si103.67 Al88.33 O384 (D2 O)48.32 (C8 D10)21.696","","- C173.568 Al88.33 Ba43.62 D313.6 Na1.09 O432.32 Si103.67 -","- C173.568 Al88.3392 Ba43.616 D313.594 Na1.088 O432.32 Si103.661 -","- C173.568 Al88.3392 Ba43.616 D313.594 Na1.088 O432.32 Si103.661 -","1","0.00520833","","Pichon, C.; Methivier, A.; Simonot-Grange, M.H.; Baerlocher, C.","Location of water and xylene molecules adsorbed on prehydrated zeolite BaX. A low-temperature neutron powder diffraction study","J. Phys. Chem. B","1999","103","","10197","10203","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521764","20.133","","5.6006","","9.4344","","89.625","","105.583","","89.509","","1024.61","","","","","","","","","","","","","3","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","Pb8 (Fe Fe2 F24)","","- F24 Fe3 Pb8 -","- F24 Fe3 Pb8 -","- F48 Fe6 Pb16 -","2","","","Pierrard, A.; Gredin, P.; Dupont, N.; de Kozak, A.; Bouree-Vigneron, F.; Rosenman, I.; Andre, G.","Magnetic structure and properties of Pb8 Fe(II) Fe(III)2 F24 : a 1-D ferrimagnetic chain compound exhibiting a spin-flop transition","Journal of Alloys Compd.","1999","291","","44","51","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521766","3.3505","","3.3505","","57.863","","90","","90","","120","","562.537","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","(In0.58 Y0.42) (Zn0.83 In0.17)6 O8","","- In1.6 O8 Y0.42 Zn4.98 -","- In1.6 O8 Y0.42 Zn4.98 -","- In4.8 O24 Y1.26 Zn14.94 -","3","0.0833333","","Pitschke, W.; Koumoto, K.","Powder diffraction data and Rietveld refinement for Y-doped (Zn O)5In2 O3","Powder Diffraction","1999","14","","213","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","141980","2020-10-21","18:00:00",""
"1521768","8.4224","","8.4224","","8.4224","","90","","90","","90","","597.458","","","","","","","","","","","","","4","F d -3 m :1","F 4d 2 3 -1d","227","","Cu0.41 Cu0.24 H1.1 Cr2 O4","","- Cr2 Cu0.65 H1.1 O4 -","- Cr2 Cu0.65 H1.1 O4 -","- Cr16 Cu5.2 H8.8 O32 -","8","0.0416667","","Plyasova, L.M.; Krieger, T.A.; Balagurov, A.M.; Molina, I.Yu.; Davydova, L.P.; Yurieva, T.M.","Neutron diffraction study of the structure of reduced copper chromite","Poverkhnostnye Fizika, Khimiya, Mekhanika","1999","1999","","31","34","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521769","17.328","","17.328","","17.328","","90","","90","","90","","5202.9","","","","","","","","","","","","","6","I a -3","-I 2b 2c 3","206","","K4 (S6.508 Te1.492 (Re (C N))6)","","- C6 K4 N6 Re6 S6.508 Te1.492 -","- C6 K4 N6 Re6 S6.508 Te1.492 -","- C48 K32 N48 Re48 S52.064 Te11.936 -","8","0.166667","","Podberezskaya, N.V.; Virovets, A.V.; Kozeeva, L.P.; Mironov, Yu.V.; Naumov, N.G.; Fedorov, V.E.","Statistical disordering of chalcogen atoms in the cluster fragments of K4 (Re6 (mue3-S)8-y (mue3-Te)y (C N)6)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1999","40","","530","535","","","","","","","","","","","","","","","","","","","","","","has coordinates","141983","2020-10-21","18:00:00",""
"1521770","17.278","","17.278","","17.278","","90","","90","","90","","5157.99","","","","","","","","","","","","","6","I a -3","-I 2b 2c 3","206","","K4 (S6.874 Te1.126 (Re (C N))6)","","- C6 K4 N6 Re6 S6.874 Te1.126 -","- C6 K4 N6 Re6 S6.874 Te1.126 -","- C48 K32 N48 Re48 S54.992 Te9.008 -","8","0.166667","","Podberezskaya, N.V.; Mironov, Yu.V.; Virovets, A.V.; Fedorov, V.E.; Kozeeva, L.P.; Naumov, N.G.","Statistical disordering of chalcogen atoms in the cluster fragments of K4 (Re6 (mue3-S)8-y (mue3-Te)y (C N)6)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1999","40","","530","535","","","","","","","","","","","","","","","","","","","","","","has coordinates","141984","2020-10-21","18:00:00",""
"1521773","5.8693","","3.41244","","11.055","","90","","91.544","","90","","221.336","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","(Ni0.25 Cr2.75) S4","","- Cr2.75 Ni0.25 S4 -","- Cr2.751 Ni0.249 S4 -","- Cr5.502 Ni0.498 S8 -","2","0.25","","Powell, A.V.; Colgan, D.C.; Ritter, C.","Magnetic structure and spin reorientation in the ternary sulfides, Nix Cr3-x S4 (x = 1/4, 1/2, 3/4)","Journal of Solid State Chemistry","1999","143","","163","173","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521774","5.891","","3.41377","","11.101","","90","","91.67","","90","","223.152","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","(Ni0.5 Cr2.5) S4","","- Cr2.5 Ni0.5 S4 -","- Cr2.5 Ni0.5 S4 -","- Cr5 Ni S8 -","2","0.25","","Powell, A.V.; Colgan, D.C.; Ritter, C.","Magnetic structure and spin reorientation in the ternary sulfides, Nix Cr3-x S4 (x = 1/4, 1/2, 3/4)","Journal of Solid State Chemistry","1999","143","","163","173","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521780","6.574","","6.649","","6.465","","116.38","","92.58","","95.35","","250.872","","","","","","","","","","","","","4","P -1","-P 1","2","","Y2 (Si O4) (C O3)","","- C O7 Si Y2 -","- C O7 Si Y2 -","- C2 O14 Si2 Y4 -","2","1","","Pushcharovskii, D.Yu.; Zubkova, N.V.; Arakcheeva, A.V.; Voloshin, A.V.; Lubman, G.U.","The discovery of iimorite, Y2 (Si O4) (C O3) in Russia: its crystal structure, composition and morphology","Kristallografiya","1999","44","","458","464","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521813","3.8551","","3.8551","","12.3056","","90","","90","","90","","182.883","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Eu2 (V O4)","","- Eu2 O4 V -","- Eu2 O4 V -","- Eu4 O8 V2 -","2","0.0625","","Ramanujachary, K.V.; Khalid, S.; Sunstrom, J.E.; Herber, R.H.; Fawcett, I.; Shuk, P.; Greenblatt, M.; Croft, M.; Nowik, I.","Magnetic and electrical properties of Eu2 V O4","Materials Research Bulletin","1999","34","","803","816","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521814","21.75099","","13.73","","14.218","","90","","90","","90","","4246.08","","","","","","","","","","","","","6","P c 21 n","P -2n -2ac","33","","(Al32 P32 O128) (((C3 H7)4 N) (O H))4","","- C48 H64 Al32 N4 O132 P32 -","- C48 H64 Al32 N4 O132 P32 -","- C48 H64 Al32 N4 O132 P32 -","1","0.25","","Ramaswamy, V.; McCusker, L.B.; Baerlocher, C.","Rietveld refinement of the pure aluminophosphate (Al P O4)-40","Microporous and Mesoporous Materials","1999","31","","1","8","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521815","3.9092","","3.9092","","3.9092","","90","","90","","90","","59.74","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","(Sr0.96 Ca0.04) Ti O3","","- Ca0.04 O3 Sr0.96 Ti -","- Ca0.04 O3 Sr0.96 Ti -","- Ca0.04 O3 Sr0.96 Ti -","1","0.0208333","","Ranjan, R.; Pandey, D.; Paranjpe, S.K.; Krishna, P.S.R.; Siruguri, V.","Novel structural features and phase transition behaviour of (Sr1-x Cax) Ti O3 : I. Neutron diffraction study","Journal of Physics: Condensed Matter","1999","11","","2233","2246","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521816","5.552","","5.546","","7.836","","90","","90","","90","","241.281","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Sr0.88 Ca0.12) Ti O3","","- Ca0.12 O3 Sr0.88 Ti -","- Ca0.122 O3 Sr0.88 Ti -","- Ca0.488 O12 Sr3.52 Ti4 -","4","0.5","","Ranjan, R.; Pandey, D.; Siruguri, V.; Krishna, P.S.R.; Paranjpe, S.K.","Novel structural features and phase transition behaviour of (Sr1-x Cax) Ti O3 : I. Neutron diffraction study","Journal of Physics: Condensed Matter","1999","11","","2233","2246","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521817","5.525","","5.522","","7.7763","","90","","90","","90","","237.248","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Sr0.75 Ca0.25) Ti O3","","- Ca0.25 O3 Sr0.75 Ti -","- Ca0.245 O3 Sr0.75 Ti -","- Ca0.98 O12 Sr3 Ti4 -","4","0.5","","Ranjan, R.; Pandey, D.; Siruguri, V.; Krishna, P.S.R.; Paranjpe, S.K.","Novel structural features and phase transition behaviour of (Sr1-x Cax) Ti O3 : I. Neutron diffraction study","Journal of Physics: Condensed Matter","1999","11","","2233","2246","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521818","5.498","","5.491","","7.753","","90","","90","","90","","234.059","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","(Sr0.5 Ca0.5) Ti O3","","- Ca0.5 O3 Sr0.5 Ti -","- Ca0.494 O2.99 Sr0.499 Ti -","- Ca1.976 O11.96 Sr1.996 Ti4 -","4","0.5","","Ranjan, R.; Pandey, D.; Paranjpe, S.K.; Siruguri, V.; Krishna, P.S.R.","Novel structural features and phase transition behaviour of (Sr1-x Cax) Ti O3 : I. Neutron diffraction study","Journal of Physics: Condensed Matter","1999","11","","2233","2246","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521819","5.5263","","5.5263","","13.3499","","90","","90","","120","","353.084","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","La0.9 Na0.1 Mn O3","","- La0.9 Mn Na0.1 O3 -","- La0.9 Mn Na0.1 O3 -","- La5.4 Mn6 Na0.6 O18 -","6","0.166667","","Rao, G.-H.; Baerner, K.; Sun, J.R.; Hamad, N.","Crystal structure and magnetoresistance of Na-doped La Mn O3","Journal of Physics: Condensed Matter","1999","11","","1523","1528","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521821","14.255","","14.255","","30.17","","90","","90","","120","","5309.34","","","","","","","","","","","","","13","R 3 m :H","R 3 -2""","160","","Ca6 Zr3 (Si1.2 Mn0.22 Nb0.58) (Fe2.11 Ti0.05 Zr0.05 Hf0.05) (Na10.57 Ca3.15 Ce0.08) (Si24 O72) O1.71 (O H)2.44 Cl0.21 (H2 O)3.05","","- Ca9.15 Ce0.08 Cl0.21 Fe2.11 H8.54 Hf0.05 Mn0.22 Na10.57 Nb0.58 O79.2 Si25.2 Ti0.05 Zr3.05 -","- Ca9.15 Ce0.081 Cl0.21 Fe2.109 Hf0.0501 Mn0.223 Na10.569 Nb0.58 O79.2 Si25.197 Ti0.0501 Zr3.0501 -","- Ca27.45 Ce0.243 Cl0.63 Fe6.327 Hf0.1503 Mn0.669 Na31.707 Nb1.74 O237.6 Si75.591 Ti0.1503 Zr9.1503 -","3","0.166667","","Rastsvetaeva, R.K.; Ekimenkova, I.A.; Pekov, I.V.","Crystal structure of a new Ca-rich analog of eudialyte","Doklady Akad. Nauk","1999","368","","636","638","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521823","11.081","","10.559","","17.265","","90","","90","","127.68","","1598.77","","","","","","","","","","","","","5","P 1 1 21/a","-P 2ac","14","","K2 Ba2 (V10 O28) (H2 O)8","","- Ba2 H16 K2 O36 V10 -","- Ba2 K2 O36 V10 -","- Ba4 K4 O72 V20 -","2","0.5","","Rastsvetaeva, R.K.","Crystal structure of new potasium-barium decavanadate","Kristallografiya","1999","44","","1027","1028","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521824","14.182","","14.182","","30.37","","90","","90","","120","","5289.94","","","","","","","","","","","","","16","R 3 :H","R 3","146","","Na16 K0.1 Ca2.10 Mn3.6 Sr0.45 Fe0.15 Ce1.15 Zr3.30 Hf0.05 Ti0.10 Nb0.40 Si25.6 O74.54 (O H)0.82 F0.28 Cl0.17 (H2 O)1.75","","- Ca2.1 Ce1.15 Cl0.17 F0.28 Fe0.15 H4.32 Hf0.05 K0.1 Mn3.6 Na16 Nb0.4 O77.11 Si25.6 Sr0.45 Ti0.1 Zr3.3 -","- Ca2.1 Ce1.149 Cl0.17 F0.28 Fe0.15 Hf0.051 K0.099 Mn3.6 Na16.002 Nb0.4 O77.11 Si25.6 Sr0.45 Ti0.099 Zr3.3 -","- Ca6.3 Ce3.447 Cl0.51 F0.84 Fe0.45 Hf0.153 K0.297 Mn10.8 Na48.006 Nb1.2 O231.33 Si76.8 Sr1.35 Ti0.297 Zr9.9 -","3","0.333333","","Rastsvetaeva, R.K.; Khomyakov, A.P.; Nekrasov, Yu.V.","Crystal structure of a novel analog of eudialyte with R3 symmetry","Kristallografiya","1999","44","","824","828","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521825","5.5748","","5.5748","","7.5127","","90","","90","","90","","233.483","","","","","","","","","","","","","5","P 4 b m","P 4 -2ab","100","","La Ba Cu O2.25 (B O3)0.75","","- B0.75 Ba Cu La O4.5 -","- B0.75 Ba Cu La O4.5 -","- B1.5 Ba2 Cu2 La2 O9 -","2","0.25","","Reading, J.; Weller, M.T.","Powder neutron diffraction structural analysis of the lanthanide barium copper oxyborates, Ln Ba Cu O2 B O3 (Ln = La, Pr and Nd)","Physica C (Amsterdam)","1999","328","","31","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521828","11.616","","3.3203","","5.6613","","90","","111.603","","90","","203.011","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Ho2 Mo2 C3","","- C3 Ho2 Mo2 -","- C3 Ho2 Mo2 -","- C6 Ho4 Mo4 -","2","0.25","","Reehuis, M.; Gerdes, M.H.; Ouladdiaf, B.; Jeitschko, W.; Stuesser, N.","Crystal and magnetic structures of the ternary carbides Ho2 Mo2 C3 and Er2 Mo2 C3","Journal of Magnetism and Magnetic Materials","1999","195","","657","666","","","","","","","","","","","","","","","","","","","","","","has coordinates","142044","2020-10-21","18:00:00",""
"1521829","11.559","","3.3088","","5.6372","","90","","111.28","","90","","200.902","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Er2 Mo2 C3","","- C3 Er2 Mo2 -","- C3 Er2 Mo2 -","- C6 Er4 Mo4 -","2","0.25","","Reehuis, M.; Gerdes, M.H.; Jeitschko, W.; Ouladdiaf, B.; Stuesser, N.","Crystal and magnetic structures of the ternary carbides Ho2 Mo2 C3 and Er2 Mo2 C3","Journal of Magnetism and Magnetic Materials","1999","195","","657","666","","","","","","","","","","","","","","","","","","","","","","has coordinates","142045","2020-10-21","18:00:00",""
"1521830","27.3569","","27.3569","","10.33","","90","","90","","90","","7730.97","","","","","","","","","","","","","3","P -4 21 m","P -4 2ab","113","","Ta83.03 V13.97 Te60","","- Ta83.03 Te60 V13.97 -","- Ta83.032 Te60 V13.968 -","- Ta166.064 Te120 V27.936 -","2","0.25","","Reich, C.; Conrad, M.; Krumreich, F.; Harbrecht, B.","The dodecagonal quasicrystalline telluride (Ta, V)1.6 Te and its crystalline approximant (Ta, V)97 Te60","Materials Research Society Symposia Proceedings","1999","553","","83","94","","","","","","","","","","","","","","","","","","","","","","has coordinates","142046","2020-10-21","18:00:00",""
"1521831","11.588","","4.579","","5.059","","90","","97.746","","90","","265.988","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","Fe5 C2","","- C2 Fe5 -","- C2 Fe5 -","- C8 Fe20 -","4","0.5","","Retief, J.J.","Powder diffraction data and Rietveld refinement of Haegg-carbide, chi-(Fe5 C2)","Powder Diffraction","1999","14","","130","132","","","","","","","","","","","","","","","","","","","","","","has coordinates","142047","2020-10-21","18:00:00",""
"1521833","5.6172","","5.6172","","5.185","","90","","90","","120","","141.683","","","","","","","","","","","","","2","P 63 2 2","P 6c 2c","182","","Zr3 O","","- O Zr3 -","- O Zr3 -","- O2 Zr6 -","2","0.166667","","Riabov, A.B.; Yartys', V.A.; Wiesinger, G.; Hauback, B.C.; Guegan, P.W.; Harris, I.R.","Hydrogenation behaviour, neutron diffraction studies and microstructural characterisation of boron oxide-doped Zr V alloys","Journal of Alloys Compd.","1999","293","","93","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521834","3.043","","3.043","","3.043","","90","","90","","90","","28.178","","","","","","","","","","","","","2","I m -3 m","-I 4 2 3","229","","V O0.03","","- O0.03 V -","- O0.03 V -","- O0.06 V2 -","2","0.0208333","","Riabov, A.B.; Guegan, P.W.; Yartys', V.A.; Wiesinger, G.; Hauback, B.C.; Harris, I.R.","Hydrogenation behaviour, neutron diffraction studies and microstructural characterisation of boron oxide-doped Zr V alloys","Journal of Alloys Compd.","1999","293","","93","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521838","15.6187","","7.7103","","10.9841","","90","","96.97","","90","","1312.98","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ce3 (Si S4)2 Cl","","- Ce3 Cl S8 Si2 -","- Ce3 Cl S8 Si2 -","- Ce12 Cl4 S32 Si8 -","4","0.5","","Riccardi, R.; Macaudiere, P.; Gout, D.; Gauthier, G.; Guillen, F.; Garcia, A.; Jobic, S.; Fouassier, C.; Brec, R.; Huguenin, D.","Structural investigation and luminescence properties of the Ce3 (Si S4)2 X (X = Cl, Br, I) family and the La3-x Cex (Si S4)2 I (0<x<1) solid solution","Journal of Solid State Chemistry","1999","147","","259","268","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521839","16.057","","7.8916","","10.9116","","90","","97.939","","90","","1369.42","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(La2 Ce) (Si S4)2 I","","- Ce I La2 S8 Si2 -","- Ce0.999 I La2.001 S8 Si2 -","- Ce3.996 I4 La8.004 S32 Si8 -","4","0.5","","Riccardi, R.; Gout, D.; Gauthier, G.; Garcia, A.; Guillen, F.; Macaudiere, P.; Jobic, S.; Huguenin, D.; Fouassier, C.; Brec, R.","Structural investigation and luminescence properties of the Ce3 (SiS4)2 X (X = Cl, Br, I) family and the La3-x Cex (Si S4)2 I (0<x<1) solid solution","Journal of Solid State Chemistry","1999","147","","259","268","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521840","16.08","","7.9054","","10.924","","90","","97.955","","90","","1375.28","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(La2.8 Ce0.2) (Si S4)2 I","","- Ce0.2 I La2.8 S8 Si2 -","- Ce0.201 I La2.799 S8 Si2 -","- Ce0.804 I4 La11.196 S32 Si8 -","4","0.5","","Riccardi, R.; Brec, R.; Gout, D.; Guillen, F.; Jobic, S.; Garcia, A.; Gauthier, G.; Macaudiere, P.; Fouassier, C.; Huguenin, D.","Structural investigation and luminescence properties of the Ce3 (SiS4)2 X (X = Cl, Br, I) family and the La3-x Cex (Si S4)2 I (0<x<1) solid solution","Journal of Solid State Chemistry","1999","147","","259","268","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521841","16.09029","","7.9084","","10.927","","90","","97.952","","90","","1377.07","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(La2.99 Ce0.01) (Si S4)2 I","","- Ce0.01 I La2.99 S8 Si2 -","- Ce0.0099 I La2.9901 S8 Si2 -","- Ce0.0396 I4 La11.9604 S32 Si8 -","4","0.5","","Riccardi, R.; Macaudiere, P.; Gout, D.; Guillen, F.; Brec, R.; Gauthier, G.; Garcia, A.; Huguenin, D.; Jobic, S.; Fouassier, C.","Structural investigation and luminescence properties of the Ce3 (SiS4)2 X (X = Cl, Br, I) family and the La3-x Cex (Si S4)2 I (0<x<1) solid solution","Journal of Solid State Chemistry","1999","147","","259","268","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521842","9.849","","8.031","","9.915","","99.089","","97.91","","89.381","","766.987","","","","","","","","","","","","","5","P -1","-P 1","2","","(Fe2 (H2 O)2) ((O3 P) (C H2) (P O3 H))2 (H2 O)2","","- C2 H14 Fe2 O16 P4 -","- C2 Fe2 O16 P4 -","- C4 Fe4 O32 P8 -","2","1","","Riou-Cavellec, M.; Serre, C.; Greneche, J.M.; Robino, J.; Nogues, M.; Ferey, G.","Hydrothermal synthesis, powder structural determination, and magnetic study of the novel hydrated iron diphosphonate (Fe2 (H2 O)2 (O3 P - C H2 - P O3 H)2) (H2 O)2 or MIL-13","Journal of Solid State Chemistry","1999","147","","122","131","","","","","","","","","","","","","","","","","","","","","","has coordinates","142058","2020-10-21","18:00:00",""
"1521848","12.3563","","12.3563","","12.3563","","90","","90","","90","","1886.54","","","","","","","","","","","","","3","I a -3 d","-I 4bd 2c 3","230","","Y3 Fe5 O12","","- Fe5 O12 Y3 -","- Fe5 O12 Y3 -","- Fe40 O96 Y24 -","8","0.0833333","","Rodic, D.; Mitric, M.; Tellgren, R.; Rundloef, H.; Kremenovic, A.","True magnetic structure of the ferrimagnetic garnet Y3 Fe5 O12 and magnetic moments of iron ions","Journal of Magnetism and Magnetic Materials","1999","191","","137","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","142064","2020-10-21","18:00:00",""
"1521849","17.484","","17.484","","10.69","","90","","90","","120","","2830.02","","","","","","","","","","","","","3","R -3 :H","-R 3","148","","Y3 Fe5 O12","","- Fe5 O12 Y3 -","- Fe5 O12 Y3 -","- Fe60 O144 Y36 -","12","0.666667","","Rodic, D.; Mitric, M.; Tellgren, R.; Rundloef, H.; Kremenovic, A.","True magnetic structure of the ferrimagnetic garnet Y3 Fe5 O12 and magnetic moments of iron ions","Journal of Magnetism and Magnetic Materials","1999","191","","137","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","142065","2020-10-21","18:00:00",""
"1521850","5.468","","5.468","","13.215","","90","","90","","120","","342.18","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","La (Ni0.9 Ti0.1) O3","","- La Ni0.9 O3 Ti0.1 -","- La Ni0.9 O3 Ti0.1 -","- La6 Ni5.4 O18 Ti0.6 -","6","0.166667","","Rodriguez, E.; Alvarez, I.; Lopez, M.L.; Veiga, M.L.; Pico, C.","Structural, electronic and magnetic characterization of the perovskite La Ni1-x Tix O3 (0<x<1/2)","Journal of Solid State Chemistry","1999","148","","479","486","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521851","5.517","","5.551","","7.856","","90","","90","","90","","240.589","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La (Ni0.5 Ti0.5) O3","","- La Ni0.5 O3 Ti0.5 -","- La Ni0.5 O3 Ti0.5 -","- La4 Ni2 O12 Ti2 -","4","0.5","","Rodriguez, E.; Alvarez, I.; Veiga, M.L.; Lopez, M.L.; Pico, C.","Structural, electronic and magnetic characterization of the perovskite La Ni1-x Tix O3 (0<x<1/2)","Journal of Solid State Chemistry","1999","148","","479","486","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521852","5.174","","5.174","","8.491","","90","","90","","120","","196.853","","","","","","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","(Hf0.702 Ti0.298) (Ni1.355 V0.645) D2.175","","- D2.175 Hf0.702 Ni1.355 Ti0.298 V0.645 -","- D2.1735 Hf0.7025 Ni1.355 Ti0.2975 V0.645 -","- D8.694 Hf2.81 Ni5.42 Ti1.19 V2.58 -","4","0.166667","","Roennebro, E.; Noreus, D.; Sakai, T.; Tsukahara, M.","Neutron diffraction study of the new hexagonal Laves phase (Hf, Ti) (Ni, V)2 and its deuteride","Journal of Alloys Compd.","1999","293","","169","173","","","","","","","","","","","","","","","","","","","","","","has coordinates","142068","2020-10-21","18:00:00",""
"1521857","7.6292","","7.6292","","10.8502","","90","","90","","90","","631.533","","","","","","","","","","","","","3","I 4","I 4","79","","U3 Al1.7 Si3.3","","- Al1.7 Si3.3 U3 -","- Al1.7 Si3.3 U3 -","- Al6.8 Si13.2 U12 -","4","0.5","","Rogl, P.; Andre, G.; Noel, H.; Bouree, F.","Magnetic structures of U3 M2 (M')3, M= Al, Ga; M'= Si, Ge: a neutron powder diffraction study","Journal of Magnetism and Magnetic Materials","1999","191","","291","300","","","","","","","","","","","","","","","","","","","","","","has coordinates","142073","2020-10-21","18:00:00",""
"1521858","7.6426","","7.6426","","10.8379","","90","","90","","90","","633.035","","","","","","","","","","","","","3","I 4","I 4","79","","U3 Ga1.92 Si3.08","","- Ga1.92 Si3.08 U3 -","- Ga1.92 Si3.08 U3 -","- Ga7.68 Si12.32 U12 -","4","0.5","","Rogl, P.; Noel, H.; Andre, G.; Bouree, F.","Magnetic structures of U3 M2 (M')3, M= Al, Ga; M' = Si, Ge: a neutron powder diffraction study","Journal of Magnetism and Magnetic Materials","1999","191","","291","300","","","","","","","","","","","","","","","","","","","","","","has coordinates","142074","2020-10-21","18:00:00",""
"1521859","7.749","","7.749","","11.0365","","90","","90","","90","","662.709","","","","","","","","","","","","","3","I 4","I 4","79","","U3 Al2.06 Ge2.94","","- Al2.06 Ge2.94 U3 -","- Al2.06 Ge2.94 U3 -","- Al8.24 Ge11.76 U12 -","4","0.5","","Rogl, P.; Andre, G.; Bouree, F.; Noel, H.","Magnetic structures of U3 M2 (M')3, M= Al, Ga; M' = Si, Ge: a neutron powder diffraction study","Journal of Magnetism and Magnetic Materials","1999","191","","291","300","","","","","","","","","","","","","","","","","","","","","","has coordinates","142075","2020-10-21","18:00:00",""
"1521861","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.; Pervukhina, N.V.; Magarill, S.A.; Borisov, S.V.; Vasil'ev, V.I.","Crystal structure of kuznetsovite Hg3 (As O4) Cl","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1999","40","","324","330","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521862","5.446","","5.446","","9.866","","90","","90","","90","","292.615","","","","","","","","","","","","","4","A b m 2","A 2 -2b","39","","(Ga (N H3)) F3","","- F3 Ga H3 N -","- F3 Ga H3 N -","- F12 Ga4 H12 N4 -","4","","","Roos, M.; Meyer, G.","Zwei Galliumfluorid-Ammoniakate: Ga (N H3) F3 und Ga (N H3)2 F3","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1129","1134","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521863","7","","7.247","","3.931","","90","","90","","90","","199.416","","","","","","","","","","","","","4","I m m m","-I 2 2","71","","(Ga (N H3)2) F3","","- F3 Ga H6 N2 -","- F3 Ga H6 N2 -","- F6 Ga2 H12 N4 -","2","0.125","","Roos, M.; Meyer, G.","Zwei Galliumfluorid-Ammoniakate: Ga (N H3) F3 und Ga (N H3)2 F3","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1129","1134","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521868","13.065","","20.654","","11.431","","90","","90","","90","","3084.59","","","","","","","","","","","","","3","P c c m","-P 2 2c","49","","","","- Ba2 Cu2.893 O6 -","- Ba2 Cu2.89333 O6 -","- Ba36 Cu52.08 O108 -","18","2.25","","Rozhdestvenskaya, I.V.; Ivanova, T.I.; Frank-Kamenetskaya, O.V.","Crystal structure of the superconducting infinite-chain cuprate Ba2 Cu2.89 O6-y","Physica C (Amsterdam)","1999","311","","239","245","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521869","6.052","","5.936","","8.512","","90","","90","","90","","305.791","","","","","","","","","","","","","3","P n a 21","P 2c -2n","33","","La Y O3","","- La O3 Y -","- La O3 Y -","- La4 O12 Y4 -","4","1","","Ruiz-Trejo, E.; Islam, M.S.; Kilner, J.A.","Atomistic simulation of defects and ion migration in La Y O3","Solid State Ionics","1999","123","","121","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521870","3.8825","","3.8825","","7.8079","","90","","90","","90","","117.695","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","(La1.12 Li0.62) (Ti2 O6)","","- La1.12 Li0.62 O6 Ti2 -","- La1.111 Li0.62 O6 Ti2 -","- La1.111 Li0.62 O6 Ti2 -","1","0.0625","","Ruiz, A.I.; Lopez, M.L.; Veiga, M.L.; Pico, C.","Structural refinement by neutron diffraction of La1.12 Li0.62 Ti2 O6","Journal of Solid State Chemistry","1999","148","","329","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","142086","2020-10-21","18:00:00",""
"1521871","3.652","","4.8312","","5.4344","","90","","90","","90","","95.882","","","","","","","","","","","","","2","I m m m","-I 2 2","71","","Li2 C2","","- C2 Li2 -","- C2 Li2 -","- C4 Li4 -","2","0.125","","Ruschewitz, U.; Poettgen, R.","Structural phase transition in Li2 C2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1599","1603","","","","","","","","","","","","","","","","","","","","","","has coordinates","142087","2020-10-21","18:00:00",""
"1521872","5.965","","5.965","","5.965","","90","","90","","90","","212.242","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Li2 C2","","- C2 Li2 -","- C2 Li2 -","- C4 Li4 -","2","0.0104167","","Ruschewitz, U.; Poettgen, R.","Structural phase transition in Li2 C2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1599","1603","","","","","","","","","","","","","","","","","","","","","","has coordinates","142088","2020-10-21","18:00:00",""
"1521883","17.668","","17.881","","7.413","","90.26","","116.48","","89.61","","2096.18","","","","","","","","","","","","","7","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","(N H4)2.24 Na0.78 Ca3.54 (Al6.52 Si29.48 O72) (H2 O)21.4","","- Al6.52 Ca3.54 H51.76 N2.24 Na0.78 O93.4 Si29.48 -","- Al6.52 Ca3.54 N2.24 Na0.78 O93.4 Si29.48 -","- Al6.52 Ca3.54 N2.24 Na0.78 O93.4 Si29.48 -","1","","","Sani, A.; Ciambelli, P.; Vezzalini, G.; Rapacciuolo, M.T.","Crystal structure of hydrated and partially (N H4)-exchanged heulandite","Microporous and Mesoporous Materials","1999","31","","263","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521886","5.579","","5.615","","7.898","","90","","90.01","","90","","247.413","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La2 Mg (Rh O6)","","- La2 Mg O6 Rh -","- La2 Mg O6 Rh -","- La4 Mg2 O12 Rh2 -","2","0.5","","Schinzer, C.; Demazeau, G.","Structure and properties of new perovskites La2 M Rh O6 (M = Mg,Zn)","Journal of Materials Science","1999","34","","251","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521887","5.584","","5.659","","7.914","","90","","90","","90","","250.081","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La2 Zn (Rh O6)","","- La2 O6 Rh Zn -","- La2 O6 Rh Zn -","- La4 O12 Rh2 Zn2 -","2","0.5","","Schinzer, C.; Demazeau, G.","Structure and properties of new perovskites La2 M Rh O6 (M = Mg,Zn)","Journal of Materials Science","1999","34","","251","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521889","7.5323","","4.0967","","15.7276","","90","","90","","90","","485.316","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Ce2 S3 -","- Ce2 S3 -","- Ce8 S12 -","4","0.5","","Schleid, T.; Lauxmann, P.","Roentgenstrukturanalysen an Einkristallen von Ce2 S3 im Aund C-Typ","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1053","1055","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521890","4.0438","","4.0438","","7.0041","","90","","90","","90","","114.533","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","La F S","","- F La S -","- F La S -","- F2 La2 S2 -","2","0.125","","Schleid, T.","Drei Formen von Selten-Erd(III)-Fluoridsulfiden: A-(La F S), B-(Y F S) und C-(Lu F S)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1700","1706","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521891","4.0513","","4.0513","","16.67","","90","","90","","120","","236.949","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Y F S","","- F S Y -","- F S Y -","- F4 S4 Y4 -","4","0.166667","","Schleid, T.","Drei Formen von Selten-Erd(III)-Fluoridsulfiden: A-(La F S), B-(Y FS) und C-(Lu F S)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1700","1706","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521892","3.9746","","3.9746","","24.629","","90","","90","","120","","336.949","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Lu F S","","- F Lu S -","- F Lu S -","- F6 Lu6 S6 -","6","0.166667","","Schleid, T.","Drei Formen von Selten-Erd(III)-Fluoridsulfiden: A-(La F S), B-(Y FS) und C-(Lu F S)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1700","1706","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521893","10.437","","6.5892","","6.549","","90","","90","","90","","450.384","","","","","","","","","","","","","2","P n a m","-P 2c 2n","62","","","","- Li P5 -","- Li P5 -","- Li4 P20 -","4","0.5","","Schmedt auf der Guenne, J.; Eckert, H.; Kaczmarek, S.; van Wuellen, L.; Paschke, D.; Foecker, A.J.; Jeitschko, W.","Solid state NMR connectivity studies in dipolarly coupled inorganic networks: crystal structure and site assignments for the lithium polyphosphide Li P5","Journal of Solid State Chemistry","1999","147","","341","349","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521898","6.432","","11.093","","6.398","","90","","109.8","","90","","429.511","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Li3 In Cl6","","- Cl6 In Li3 -","- Cl6 In1.015 Li3 -","- Cl12 In2.03 Li6 -","2","0.25","","Schmidt, M.O.; Wickleder, M.S.; Meyer, G.","Ternaere Halogenide vom Typ A3 M X6. VIII. Zur Kristallstruktur von Li3 In Cl6","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","539","540","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521899","3.8896","","3.8896","","9.554","","90","","90","","90","","144.542","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Bi2 Er O4 I","","- Bi2 Er I O4 -","- Bi2 Er I O4 -","- Bi2 Er I O4 -","1","0.0625","","Schmidt, M.; Oppermann, H.","Synthese und Kristallstruktur von Bi2 Er O4 I","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","544","546","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521900","12.5883","","10.6263","","8.2241","","90","","126.24","","90","","887.294","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- Ce F4 -","- Ce F4 -","- Ce12 F48 -","12","1.5","","Schmidt, R.; Mueller, B.G.","Einkristalluntersuchungen an Au (Au F4)2 und Ce F4, zwei unerwarteten Nebenprodukten","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","605","608","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521901","4.629","","4.629","","8.121","","90","","90","","90","","174.014","","","","","","","","","","","","","3","P 4/n m m :1","P 4ab 2ab -1ab","129","","","","- K Mn Sb -","- K Mn Sb -","- K2 Mn2 Sb2 -","2","0.125","","Schucht, F.; Bronger, W.; Mueller, R.; Jung, W.; Dascoulidou, A.; Mueller, P.; Schuster, H.U.","Die magnetischen Eigenschaften der Alkalimetall-Manganpnictide K Mn P, Rb Mn P, Cs Mn P, Rb Mn As, K Mn Sb, K Mn Bi","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","31","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521902","4.2352","","4.2352","","7.6174","","90","","90","","90","","136.633","","","","","","","","","","","","","3","P 4/n m m :1","P 4ab 2ab -1ab","129","","","","- K Mn P -","- K Mn P -","- K2 Mn2 P2 -","2","0.125","","Schucht, F.; Dascoulidou, A.; Schuster, H.U.; Bronger, W.; Mueller, R.; Jung, W.; Mueller, P.","Die magnetischen Eigenschaften der Alkalimetall-Manganpnictide K Mn P, Rb Mn P, Cs Mn P, Rb Mn As, K Mn Sb, K Mn Bi","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","31","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521903","4.266","","4.266","","7.955","","90","","90","","90","","144.771","","","","","","","","","","","","","3","P 4/n m m :1","P 4ab 2ab -1ab","129","","Rb Mn P","","- Mn P Rb -","- Mn P Rb -","- Mn2 P2 Rb2 -","2","0.125","","Schucht, F.; Dascoulidou, A.; Mueller, R.; Jung, W.; Bronger, W.; Schuster, H.U.; Mueller, P.","Die magnetischen Eigenschaften der Alkalimetall-Manganpnictide K Mn P, Rb Mn P, Cs Mn P, Rb Mn As, K Mn Sb, K Mn Bi","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","31","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521904","4.4","","4.4","","8.064","","90","","90","","90","","156.119","","","","","","","","","","","","","3","P 4/n m m :1","P 4ab 2ab -1ab","129","","Rb Mn As","","- As Mn Rb -","- As Mn Rb -","- As2 Mn2 Rb2 -","2","0.125","","Schucht, F.; Dascoulidou, A.; Mueller, R.; Jung, W.; Mueller, P.; Schuster, H.U.; Bronger, W.","Die magnetischen Eigenschaften der Alkalimetall-Manganpnictide K Mn P, Rb Mn P, Cs Mn P, Rb Mn As, K Mn Sb, K Mn Bi","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","31","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521905","4.28","","4.28","","8.737","","90","","90","","90","","160.048","","","","","","","","","","","","","3","P 4/n m m :1","P 4ab 2ab -1ab","129","","","","- Cs Mn P -","- Cs Mn P -","- Cs2 Mn2 P2 -","2","0.125","","Schucht, F.; Dascoulidou, A.; Schuster, H.U.; Jung, W.; Mueller, R.; Bronger, W.; Mueller, P.","Die magnetischen Eigenschaften der Alkalimetall-Manganpnictide K Mn P, Rb Mn P, Cs Mn P, Rb Mn As, K Mn Sb, K Mn Bi","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","31","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1521906","13.724","","10.579","","8.499","","90","","90","","90","","1233.94","","","","","","","","","","","","","3","I b a m","-I 2 2c","72","","Cs2 (Pd2 Cl6)","","- Cl6 Cs2 Pd2 -","- Cl6 Cs2 Pd2 -","- Cl24 Cs8 Pd8 -","4","0.25","","Schuepp, B.; Keller, H.L.","Cs Pd Cl3 - eine Verbindung mit (Pd2 Cl6)-Baugruppen und anorganischem Kation","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1944","1950","","","","","","","","","","","","","","","","","","","","","","has coordinates","142123","2020-10-21","18:00:00",""
"1521907","15.956","","15.956","","14.146","","90","","90","","90","","3601.49","","","","","","","","","","","","","3","I -4 2 d","I -4 2bw","122","","Tl4 Pd3 Cl10","","- Cl10 Pd3 Tl4 -","- Cl10 Pd3 Tl4 -","- Cl80 Pd24 Tl32 -","8","0.5","","Schuepp, B.; Keller, H.L.","Tl4 Pd3 Cl10 - eine Verbindung mit neuartiger ((Pd Cl2 Cl2/2)4)(4-) Baugruppe","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","241","246","","","","","","","","","","","","","","","","","","","","","","has coordinates","142124","2020-10-21","18:00:00",""
"1521908","7.163","","7.163","","4.282","","90","","90","","90","","219.703","","","","","","","","","","","","","3","P 4/m m m","-P 4 2","123","","Tl2 (Pd Cl4)","","- Cl4 Pd Tl2 -","- Cl4 Pd Tl2 -","- Cl4 Pd Tl2 -","1","0.0625","","Schuepp, B.; Keller, H.L.","Darstellung und Kristallstruktur von Tl2 Pd Cl4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","379","381","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521910","7.745","","6.61","","7.306","","90","","90","","90","","374.027","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Cu In O (P O4)","","- Cu In O5 P -","- Cu In O5 P -","- Cu4 In4 O20 P4 -","4","0.5","","Schwunck, H.M.; Jung, W.; Moser, P.","Das Kupfer(II) - indium - oxidphosphat Cu In O P O4 mit alpha-(Fe2 O P O4)-Struktur, dargestellt durch die Oxidation einer Cu / In / P - Legierung in Sauerstoffstrom","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","407","410","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521911","8.694","","9.248","","16.649","","90","","90","","90","","1338.61","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Tl Cu2 (P2 O7)","","- Cu2 O7 P2 Tl -","- Cu2 O7 P2 Tl -","- Cu16 O56 P16 Tl8 -","8","1","","Schwunck, H.M.; Moser, P.; Jung, W.","Tl Cu(I) Cu(II) P2 O7 mit Kupfer in gemischter Valenz - ein Zwischenprodukt bei der Oxidation einer Tl / Cu / P Legierung mit Sauerstoff","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","463","466","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521912","3.8568","","3.8568","","7.7305","","90","","90","","90","","114.99","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Sr0.5 Nd Ti2 O6","","- Nd O6 Sr0.5 Ti2 -","- Nd0.9999 O6 Sr0.4999 Ti2 -","- Nd0.9999 O6 Sr0.4999 Ti2 -","1","0.125","","Seong, K.P.; Park, H.S.; Shin, J.Y.; Kim, H.S.; Choi, J.H.; Moon, J.H.","A study on the crystal structure of Sr Nd2 Ti4 O12","Yoop Hakoechi (Journal of the Korean Ceramic Society)","1999","36","","1139","1142","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521913","3.5892","","3.5892","","29.7219","","90","","90","","120","","331.591","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Na0.288 Hf N Cl","","- Cl Hf N Na0.288 -","- Cl Hf N Na0.288 -","- Cl6 Hf6 N6 Na1.728 -","6","0.166667","","Shamoto, S.; Kajitani, T.; Iizawa, K.; Yamada, M.; Ohoyama, K.; Yamaguchi, Y.","Structural study on novel two-dimensional superconductor Nax Hf N Cl","Journal of Physics and Chemistry of Solids","1999","60","","1431","1433","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521914","3.8147","","3.8147","","3.8246","","90","","90","","90","","55.655","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","(Tl0.5 Na0.5) (Ti O3)","","- Na0.5 O3 Ti Tl0.5 -","- Na0.5 O3 Ti Tl0.5 -","- Na0.5 O3 Ti Tl0.5 -","1","0.125","","Shan, Y.J.; Inaguma, Y.; Miyata, M.; Kobashi, K.; Nakamura, T.; Itoh, M.","New perovskite oxide (Tl1/2 Na1/2) Ti O3","Materials Research Society Symposia Proceedings","1999","547","","105","114","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521915","17.22699","","17.22699","","19.3064","","90","","90","","120","","4961.93","","","","","","","","","","","","","6","R -3 m :H","-R 3 2""","166","","(K6.066 (Al6.3 Si83.7 O180)) ((C H2)12 O6)3","","- C36 H72 Al6.3 K6.066 O198 Si83.7 -","- C36 H18 Al6.3 K6.066 O198 Si83.7 -","- C36 H18 Al6.3 K6.066 O198 Si83.7 -","1","0.0277778","","Shantz, D.F.; Burton, A.; Lobo, R.F.","Synthesis, structure solution, and characterization of the aluminosilicate MCM-61: the first aluminosilicate clathrate with 18-membered rings","Microporous and Mesoporous Materials","1999","31","","61","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","142132","2020-10-21","18:00:00",""
"1521920","3.3259","","3.3259","","10.6741","","90","","90","","90","","118.073","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Sc2 B C2","","- C2 B Sc2 -","- C2 B Sc2 -","- C4 B2 Sc4 -","2","0.0625","","Shi, Y.; Leithe-Jasper, A.; Tanaka, T.","New ternary compounds Sc3 B0.75 C3, Sc2 B1.1 C3.2, Sc B15 C1.60 and subsolidus phase relations in the Sc - B - C system at 1700 C","Journal of Solid State Chemistry","1999","148","","250","259","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521921","23.71","","23.71","","6.703","","90","","90","","120","","3263.34","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Sc98 B54 C157","","- C157 B54 Sc98 -","- C157.005 B53.9946 Sc98 -","- C157.005 B53.9946 Sc98 -","1","0.0833333","","Shi, Y.; Tanaka, T.; Leithe-Jasper, A.; Bando, Y.; Bourgeois, L.","Sc2 B1.1 C3.2, a new rare-earth boron carbide with graphite-like layers","Journal of Solid State Chemistry","1999","148","","442","449","","","","","","","","","","","","","","","","","","","","","","has coordinates","142138","2020-10-21","18:00:00",""
"1521922","23.063","","10.689","","2.944","","90","","90","","76.4","","705.407","","","","","","","","","","","","","4","B 1 1 2/m","-B 2","12","","Na5.42 (Mg0.7 Ti7.3) O18","","- Mg0.7 Na5.42 O18 Ti7.3 -","- Mg0.7 Na5.42 O18 Ti7.3 -","- Mg1.4 Na10.84 O36 Ti14.6 -","2","0.25","","Shilov, G.V.; Atovmyan, L.O.; Volochaev, V.A.; Nalbadyan, V.B.","Crystal structure and ionic conductivity of a new sodium magnesium titanium oxide","Kristallografiya","1999","44","","1029","1033","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521923","5.52237","","5.52408","","25.0264","","90","","90","","90","","763.456","","","","","","","","","","","","","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","","Shimakawa, Y.; Nakagawa, Y.; Kubo, Y.; Kamiyama, T.; Asano, H.","Crystal structures of Sr Bi2 Ta2 O9 and Sr0.8 Bi2.2 Ta2 O9 ferroelectric materials","Materials Research Society Symposia Proceedings","1999","541","","523","528","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521925","5.6004","","5.6414","","7.9346","","90","","89.982","","90","","250.687","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","La (Mg0.598 Nb0.402) O3","","- La Mg0.598 Nb0.402 O3 -","- La Mg0.5983 Nb0.4017 O3 -","- La4 Mg2.3932 Nb1.6068 O12 -","4","1","","Shin, D.M.; Cho, B.J.; Nahm, S.; Paik, J.H.; Kim, K.Y.; Byun Jae Dong","Crystal structure of La (Mg2/3 Nb1/3) O3 ceramics","Yoop Hakoechi (Journal of the Korean Ceramic Society)","1999","36","","848","852","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521928","11.864","","11.864","","13.87","","90","","90","","90","","1952.27","","","","","","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","Sm4 S3 (Si2 O7)","","- O7 S3 Si2 Sm4 -","- O7 S3 Si2 Sm4 -","- O56 S24 Si16 Sm32 -","8","0.25","","Sieke, C.; Schleid, T.","Sm4 S3 (Si2 O7) und Na Sm9 S2 (Si O4)6 : zwei Sulfidsilicate mit dreiwertigem Samarium","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","131","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","142145","2020-10-21","18:00:00",""
"1521929","9.7532","","9.7532","","6.7646","","90","","90","","120","","557.272","","","","","","","","","","","","","5","P 63/m","-P 6c","176","","Na Sm9 S2 (Si O4)6","","- Na O24 S2 Si6 Sm9 -","- Na0.976 O24 S2 Si6 Sm9.024 -","- Na0.976 O24 S2 Si6 Sm9.024 -","1","0.0833333","","Sieke, C.; Schleid, T.","Sm4 S3 (Si2 O7) und Na Sm9 S2 (Si O4)6 : zwei Sulfidsilicate mit dreiwertigem Samarium","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","131","136","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521930","7.0174","","18.008","","6.2663","","90","","90","","90","","791.868","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Sm3 Cl (Si O4)2","","- Cl O8 Si2 Sm3 -","- Cl O8 Si2 Sm3 -","- Cl4 O32 Si8 Sm12 -","4","0.5","","Sieke, C.; Schleid, T.","Sm3 Cl (Si O4)2 : ein chlorarmes Chloridorthosilicat des Samariums","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","377","378","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521935","3.88481","","3.88481","","11.7336","","90","","90","","90","","177.081","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O7.02","","- Ba1.5 Ca0.5 Cu3 La O7.02 -","- Ba1.5 Ca0.5 Cu3 La O7.02 -","- Ba1.5 Ca0.5 Cu3 La O7.02 -","1","0.0625","","Skakle, J.M.S.; West, A.R.","Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od","Physica C (Amsterdam)","1999","321","","12","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521936","3.88537","","3.88537","","11.77323","","90","","90","","90","","177.73","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O6.64","","- Ba1.5 Ca0.5 Cu3 La O6.64 -","- Ba1.5 Ca0.5 Cu3 La O6.64 -","- Ba1.5 Ca0.5 Cu3 La O6.64 -","1","0.0625","","Skakle, J.M.S.; West, A.R.","Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od","Physica C (Amsterdam)","1999","321","","12","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521937","3.88743","","3.88743","","11.7895","","90","","90","","90","","178.164","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O6.5","","- Ba1.5 Ca0.5 Cu3 La O6.5 -","- Ba1.5 Ca0.5 Cu3 La O6.5 -","- Ba1.5 Ca0.5 Cu3 La O6.5 -","1","0.0625","","Skakle, J.M.S.; West, A.R.","Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od","Physica C (Amsterdam)","1999","321","","12","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521938","3.8911","","3.8911","","11.78198","","90","","90","","90","","178.387","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O6.54","","- Ba1.5 Ca0.5 Cu3 La O6.54 -","- Ba1.5 Ca0.5 Cu3 La O6.54 -","- Ba1.5 Ca0.5 Cu3 La O6.54 -","1","0.0625","","Skakle, J.M.S.; West, A.R.","Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od","Physica C (Amsterdam)","1999","321","","12","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521939","3.8915","","3.8915","","11.7419","","90","","90","","90","","177.817","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O7.06","","- Ba1.5 Ca0.5 Cu3 La O7.06 -","- Ba1.5 Ca0.5 Cu3 La O7.06 -","- Ba1.5 Ca0.5 Cu3 La O7.06 -","1","0.0625","","Skakle, J.M.S.; West, A.R.","Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od","Physica C (Amsterdam)","1999","321","","12","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521940","3.89548","","3.89548","","11.765","","90","","90","","90","","178.531","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O6.98","","- Ba1.5 Ca0.5 Cu3 La O6.98 -","- Ba1.5 Ca0.5 Cu3 La O6.98 -","- Ba1.5 Ca0.5 Cu3 La O6.98 -","1","0.0625","","Skakle, J.M.S.; West, A.R.","Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od","Physica C (Amsterdam)","1999","321","","12","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521941","3.90003","","3.90003","","11.7944","","90","","90","","90","","179.396","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O6.9","","- Ba1.5 Ca0.5 Cu3 La O6.9 -","- Ba1.5 Ca0.5 Cu3 La O6.9 -","- Ba1.5 Ca0.5 Cu3 La O6.9 -","1","0.0625","","Skakle, J.M.S.; West, A.R.","Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od","Physica C (Amsterdam)","1999","321","","12","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521942","3.90868","","3.90868","","11.8406","","90","","90","","90","","180.898","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O6.72","","- Ba1.5 Ca0.5 Cu3 La O6.72 -","- Ba1.5 Ca0.5 Cu3 La O6.72 -","- Ba1.5 Ca0.5 Cu3 La O6.72 -","1","0.0625","","Skakle, J.M.S.; West, A.R.","Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od","Physica C (Amsterdam)","1999","321","","12","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521943","3.92008","","3.92008","","11.9138","","90","","90","","90","","183.08","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O6.46","","- Ba1.5 Ca0.5 Cu3 La O6.46 -","- Ba1.5 Ca0.5 Cu3 La O6.46 -","- Ba1.5 Ca0.5 Cu3 La O6.46 -","1","0.0625","","Skakle, J.M.S.; West, A.R.","Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od","Physica C (Amsterdam)","1999","321","","12","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521944","3.92562","","3.92562","","11.9553","","90","","90","","90","","184.237","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O6.32","","- Ba1.5 Ca0.5 Cu3 La O6.32 -","- Ba1.5 Ca0.5 Cu3 La O6.316 -","- Ba1.5 Ca0.5 Cu3 La O6.316 -","1","0.0625","","Skakle, J.M.S.; West, A.R.","Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od","Physica C (Amsterdam)","1999","321","","12","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521945","3.93474","","3.93474","","11.989","","90","","90","","90","","185.616","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","(La0.5 Ba1.5) (La0.5 Ca0.5) Cu3 O6.18","","- Ba1.5 Ca0.5 Cu3 La O6.18 -","- Ba1.5 Ca0.5 Cu3 La O6.18 -","- Ba1.5 Ca0.5 Cu3 La O6.18 -","1","0.0625","","Skakle, J.M.S.; West, A.R.","Crystal structure - Tc correlations in La Ba1.5 Ca0.5 Cu3 Od","Physica C (Amsterdam)","1999","321","","12","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521948","7.6855","","5.4347","","5.4243","","90","","90.221","","90","","226.563","","","","","","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","La0.83 (La0.07 Ti0.465 Al0.465) O2.9","","- Al0.465 La0.9 O2.9 Ti0.465 -","- Al0.465 La0.901 O2.9 Ti0.465 -","- Al1.86 La3.604 O11.6 Ti1.86 -","4","0.5","","Slater, P.R.; Irvine, J.T.S.","Synthesis and structure of a new perovskite phase in the La Ti - Al - O system","Journal of Solid State Chemistry","1999","146","","437","438","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1521949","15.335","","15.335","","18.564","","90","","90","","120","","3780.68","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","Rb3 ((Re6 S2 (S4.86 Br1.14)) Br6)","","- Br7.14 Rb3 Re6 S6.86 -","- Br7.14 Rb3 Re6 S6.86 -","- Br42.84 Rb18 Re36 S41.16 -","6","0.166667","","Slougui, A.; Perrin, A.; Sergent, M.","Trinegative (Re6 S7 Br7)(3-) anionic cluster unit synthesized via direct high-temperature route in the quaternary system M - Re - S -Br (M=alkaline) and its tetrahydrate Rb3 (Re 6 S7 Br7) . 4(H2 O)","Journal of Solid State Chemistry","1999","147","","358","365","","","","","","","","","","","","","","","","","","","","","","has coordinates","142166","2020-10-21","18:00:00",""
"1521950","9.54","","9.62","","17.72","","82.7","","82.1","","64.2","","1446.12","","","","","","","","","","","","","6","P -1","-P 1","2","","Rb3 ((Re Br)6 S7 Br) (H2 O)4","","- Br7 H8 O4 Rb3 Re6 S7 -","- Br6.97 O4 Rb3 Re6 S7.03 -","- Br13.94 O8 Rb6 Re12 S14.06 -","2","1","","Slougui, A.; Sergent, M.; Perrin, A.","Trinegative (Re6 S7 Br7)(3-) anionic cluster unit synthesized via direct high-temperature route in the quaternary system M - Re - S - Br (M=alkaline) and its tetrahydrate Rb3 (Re6 S7 Br7) . 4(H2 O)","Journal of Solid State Chemistry","1999","147","","358","365","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521952","5.276","","8.768","","9.122","","90","","90","","90","","421.983","","","","","","","","","","","","","5","P 21 n b","P -2bc 2a","33","","Li (N H4) (S O4)","","- H4 Li N O4 S -","- H4 Li N O4 S -","- H16 Li4 N4 O16 S4 -","4","1","","Solans, X.; Mata, J.; Calvet, M.T.; Font-Bardia, M.","X-ray structural characterization, Raman and thermal analysis of Li N H4 S O4 above room temperature","Journal of Physics: Condensed Matter","1999","11","","8995","9007","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521953","5.1421","","5.1421","","8.634","","90","","90","","120","","197.708","","","","","","","","","","","","","4","P 63","P 6c","173","","K Li (S O4)","","- K Li O4 S -","- K Li O4 S -","- K2 Li2 O8 S2 -","2","0.333333","","Solans, X.; Calvet, M.T.; Bocanegra, E.H.; Martinez-Sarrion, M.L.; Mestres, L.; Bakkali, A.; Herraiz, M.; Mata, J.","Thermal analysis and X-ray diffraction study on Li K S O4: a new phase transition","Journal of Solid State Chemistry","1999","148","","316","324","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521954","5.114","","8.857","","8.63","","90","","90","","90","","390.893","","","","","","","","","","","","","4","C m c 21","C 2c -2","36","","K Li (S O4)","","- K Li O4 S -","- K Li O4 S -","- K4 Li4 O16 S4 -","4","0.5","","Solans, X.; Calvet, M.T.; Bocanegra, E.H.; Mestres, L.; Bakkali, A.; Martinez-Sarrion, M.L.; Mata, J.; Herraiz, M.","Thermal analysis and X-ray diffraction study on Li K S O4: a new phase transition","Journal of Solid State Chemistry","1999","148","","316","324","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521962","5.577","","15.346","","5.5414","","90","","90","","90","","474.259","","","","","","","","","","","","","4","A b a 2","A 2 -2ab","41","","Bi2 (V0.8 Ge0.2) O5.4","","- Bi2 Ge0.2 O5.4 V0.8 -","- Bi2 Ge0.2 O5.4 V0.8 -","- Bi8 Ge0.8 O21.6 V3.2 -","4","","","Sooryanarayana, K.; Guru Row, T.N.; Varma, K.B.R.","Structural phase transitions in Bi2 V1-x Gex Co5.5-x/2 (x = 0.2, 0.4 and 0.6) single crystals: X-ray crystallographic study","Materials Research Bulletin","1999","34","","425","432","","","","","","","","","","","","","","","","","","","","","","has coordinates","142179","2020-10-21","18:00:00",""
"1521963","3.917","","3.917","","15.354","","90","","90","","90","","235.575","","","","","","","","","","","","","4","I 4 m m","I 4 -2","107","","Bi2 (V0.6 Ge0.4) O5.3","","- Bi2 Ge0.4 O5.3 V0.6 -","- Bi2 Ge0.4 O5.3 V0.6 -","- Bi4 Ge0.8 O10.6 V1.2 -","2","0.125","","Sooryanarayana, K.; Guru Row, T.N.; Varma, K.B.R.","Structural phase transitions in Bi2 V1-x Gex Co5.5-x/2 (x = 0.2, 0.4 and 0.6) single crystals: X-ray crystallographic study","Materials Research Bulletin","1999","34","","425","432","","","","","","","","","","","","","","","","","","","","","","has coordinates","142180","2020-10-21","18:00:00",""
"1521964","5.495","","5.516","","15.416","","90","","90","","90","","467.265","","","","","","","","","","","","","4","F m m 2","F 2 -2","42","","Bi2 (V0.4 Ge0.6) O5.2","","- Bi2 Ge0.6 O5.2 V0.4 -","- Bi2 Ge0.6 O5.2 V0.4 -","- Bi8 Ge2.4 O20.8 V1.6 -","4","0.25","","Sooryanarayana, K.; Guru Row, T.N.; Varma, K.B.R.","Structural phase transitions in Bi2 V1-x Gex Co5.5-x/2 (x = 0.2, 0.4 and 0.6) single crystals: X-ray crystallographic study","Materials Research Bulletin","1999","34","","425","432","","","","","","","","","","","","","","","","","","","","","","has coordinates","142181","2020-10-21","18:00:00",""
"1521965","15.727","","5.883","","10.178","","90","","101.66","","90","","922.256","","","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","(N H4)3 H (S O4)2","","- H13 N3 O8 S2 -","- H13 N3 O8 S2 -","- H52 N12 O32 S8 -","4","1","","Sooryanarayana, K.; Guru Row, T.N.; Robinson, W.T.","Phase transitions in triammonium hydrogen disulphate: crystal structure of an intermediate stable phase at -90 C","Phase Transition","1999","69","","429","438","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521969","13.987","","10.241","","18.151","","90","","110.94","","90","","2428.25","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Rb2 (Fe (C N)5 N O) (H2 O)","","- C5 H2 Fe N6 O2 Rb2 -","- C5 H2 Fe N6 O2 Rb2 -","- C40 H16 Fe8 N48 O16 Rb16 -","8","1","","Soria, D. B.; Piro, O. E.; Castellano, E. E.; Aymonino, P. J.","Crystal and molecular structure determination, TGA, DTA, and infrared and Raman spectra of rubidium nitroprusside monohydrate, Rb~2~[Fe(CN)~5~NO] . (H~2~O)","Journal of Chemical Crystallography","1999","29","1","75","80","10.1023/A:1009575415668","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521970","5.404","","5.404","","8.821","","90","","90","","120","","223.09","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Zr Co V D3.3","","- Co D3.3 V Zr -","- Co1.0005 D3.2985 V0.9995 Zr -","- Co4.002 D13.194 V3.998 Zr4 -","4","0.166667","","Soubeyroux, J.L.; Fruchart, D.; Biris, A.S.","Structural studies of Laves phases Zr Co (V1-x Crx) with 0<x<1 and their hydrides","Journal of Alloys Compd.","1999","293","","88","92","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521971","5.376","","5.376","","8.788","","90","","90","","120","","219.958","","","","","","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","Zr Co V0.732 Cr0.268 D3.36","","- Co Cr0.268 D3.36 V0.732 Zr -","- Co Cr0.268 D3.36 V0.732 Zr -","- Co4 Cr1.072 D13.44 V2.928 Zr4 -","4","0.166667","","Soubeyroux, J.L.; Fruchart, D.; Biris, A.S.","Structural studies of Laves phases Zr Co (V1-x Crx) with 0<x<1 and their hydrides","Journal of Alloys Compd.","1999","293","","88","92","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521972","5.347","","5.347","","8.745","","90","","90","","120","","216.526","","","","","","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","Zr Co V0.478 Cr0.522 D3.42","","- Co Cr0.522 D3.42 V0.478 Zr -","- Co Cr0.5215 D3.42 V0.4785 Zr -","- Co4 Cr2.086 D13.68 V1.914 Zr4 -","4","0.166667","","Soubeyroux, J.L.; Fruchart, D.; Biris, A.S.","Structural studies of Laves phases Zr Co (V1-x Crx) with 0<x<1 and their hydrides","Journal of Alloys Compd.","1999","293","","88","92","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521973","5.33","","5.33","","8.719","","90","","90","","120","","214.512","","","","","","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","Zr Co V0.268 Cr0.732 D3.28","","- Co Cr0.732 D3.28 V0.268 Zr -","- Co Cr0.7325 D3.2775 V0.2675 Zr -","- Co4 Cr2.93 D13.11 V1.07 Zr4 -","4","0.166667","","Soubeyroux, J.L.; Biris, A.S.; Fruchart, D.","Structural studies of Laves phases Zr Co (V1-x Crx) with 0<x<1 and their hydrides","Journal of Alloys Compd.","1999","293","","88","92","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521974","5.316","","5.316","","8.694","","90","","90","","120","","212.775","","","","","","","","","","","","","5","P 63/m m c","-P 6c 2c","194","","Zr Co V0.088 Cr0.912 D2.90","","- Co Cr0.912 D2.9 V0.088 Zr -","- Co Cr0.912 D2.901 V0.088 Zr -","- Co4 Cr3.648 D11.604 V0.352 Zr4 -","4","0.166667","","Soubeyroux, J.L.; Biris, A.S.; Fruchart, D.","Structural studies of Laves phases Zr Co (V1-x Crx) with 0<x<1 and their hydrides","Journal of Alloys Compd.","1999","293","","88","92","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521975","6.801","","17.52089","","7.7387","","90","","94.373","","90","","919.456","","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","(Sr0.67 Ba0.33) (Al2 Si6 O16) (H2 O)4.558","","- Al2 Ba0.33 H9.116 O20.558 Si6 Sr0.67 -","- Al2 Ba0.334 O20.558 Si6 Sr0.678 -","- Al4 Ba0.668 O41.116 Si12 Sr1.356 -","2","0.5","","Stahl, K.; Hanson, J.C.","Multiple cation sites in dehydrated brewsterite. An in-situ X-ray synchrotron powder diffraction study","Microporous and Mesoporous Materials","1999","32","","147","158","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521976","6.8293","","17.31569","","7.6719","","90","","94.591","","90","","904.322","","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","(Sr0.67 Ba0.33) (Al2 Si6 O16) (H2 O)2.84","","- Al2 Ba0.33 H5.68 O18.84 Si6 Sr0.67 -","- Al2 Ba0.326 O18.838 Si6 Sr0.661 -","- Al4 Ba0.652 O37.676 Si12 Sr1.322 -","2","0.5","","Stahl, K.; Hanson, J.C.","Multiple cation sites in dehydrated brewsterite. An in-situ X-ray synchrotron powder diffraction study","Microporous and Mesoporous Materials","1999","32","","147","158","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521977","6.8311","","17.1698","","7.6617","","90","","94.686","","90","","895.626","","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","(Sr0.67 Ba0.33) (Al2 Si6 O16) (H2 O)2.146","","- Al2 Ba0.33 H4.292 O18.146 Si6 Sr0.67 -","- Al2 Ba0.327 O18.146 Si6 Sr0.661 -","- Al4 Ba0.654 O36.292 Si12 Sr1.322 -","2","0.5","","Stahl, K.; Hanson, J.C.","Multiple cation sites in dehydrated brewsterite. An in-situ X-ray synchrotron powder diffraction study","Microporous and Mesoporous Materials","1999","32","","147","158","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521978","6.791","","16.806","","7.639","","90","","94.69","","90","","868.916","","","","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","(Sr0.67 Ba0.33) (Al2 Si6 O16) (H2 O)1.036","","- Al2 Ba0.33 H2.072 O17.036 Si6 Sr0.67 -","- Al2 Ba0.324 O17.036 Si6 Sr0.66 -","- Al4 Ba0.648 O34.072 Si12 Sr1.32 -","2","0.5","","Stahl, K.; Hanson, J.C.","Multiple cation sites in dehydrated brewsterite. An in-situ X-ray synchrotron powder diffraction study","Microporous and Mesoporous Materials","1999","32","","147","158","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521979","7.959","","6.534","","8.501","","90","","93.97","","90","","441.026","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Na2 Zn (O H)4","","- H4 Na2 O4 Zn -","- H4 Na2 O4 Zn -","- H16 Na8 O16 Zn4 -","4","1","","Stahl, R.; Niewa, R.; Jacobs, H.","Synthese und Kristallstruktur von Na2 Zn (O H)4","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","48","50","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:07",""
"1521980","12.421","","11.568","","10.516","","90","","118.71","","90","","1325.24","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Cs11 (W N2.5 O1.5)2 (N3)2","","- Cs11 N11 O3 W2 -","- Cs11 N11 O3 W2 -","- Cs22 N22 O6 W4 -","2","0.25","","Stegen, H.; Jacobs, H.","Synthese und Struktur von Cs11 ((W N2.5 O1.5)2) (N3)2, ein Caesiumoxonitridomonowolframat(VI)-azid","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1093","1096","","","","","","","","","","","","","","","","","","","","","","has coordinates","142197","2020-10-21","18:00:00",""
"1521990","8.0041","","13.8767","","8.5163","","90","","108.495","","90","","897.055","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","K2 (U Te3)","","- K2 Te3 U -","- K2 Te3 U -","- K8 Te12 U4 -","4","0.5","","Stoewe, K.; Appel-Colbus, S.","Die Synthese und Kristallstruktur von K2 U Te3","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1647","1651","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521991","3.914","","3.914","","11.76","","90","","90","","90","","180.156","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Ba1.4 La0.6) (La0.71 Y0.086 Ca0.172) Cu3 O7.16","","- Ba1.4 Ca0.172 Cu3 La1.31 O7.16 Y0.086 -","- Ba1.4 Ca0.172 Cu3 La1.31 O7.16 Y0.086 -","- Ba1.4 Ca0.172 Cu3 La1.31 O7.16 Y0.086 -","1","0.0625","","Subbarao, M.V.; Rajagopal, H.; Sequeira, A.; Kulkarni, R.G.","Structural studies of the superconducting La3.5-x-y Yy Ca2x Ba3.5-xCu7 Oz system","Physica C (Amsterdam)","1999","319","","181","188","","","","","","","","","","","","","","","","","","","","","","has coordinates","142209","2020-10-21","18:00:00",""
"1521992","3.899","","3.899","","11.732","","90","","90","","90","","178.352","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Ba1.32 La0.68) (La0.45 Y0.172 Ca0.344) Cu3 O7.18","","- Ba1.32 Ca0.344 Cu3 La1.13 O7.18 Y0.172 -","- Ba1.32 Ca0.344 Cu3 La1.13 O7.18 Y0.172 -","- Ba1.32 Ca0.344 Cu3 La1.13 O7.18 Y0.172 -","1","0.0625","","Subbarao, M.V.; Kulkarni, R.G.; Rajagopal, H.; Sequeira, A.","Structural studies of the superconducting La3.5-x-y Yy Ca2x Ba3.5-xCu7 Oz system","Physica C (Amsterdam)","1999","319","","181","188","","","","","","","","","","","","","","","","","","","","","","has coordinates","142210","2020-10-21","18:00:00",""
"1521993","3.861","","3.861","","11.642","","90","","90","","90","","173.551","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Ba1.28 La0.72) (La0.39 Y0.20 Ca0.40) Cu3 O7.14","","- Ba1.28 Ca0.4 Cu3 La1.11 O7.14 Y0.2 -","- Ba1.28 Ca0.4 Cu3 La1.11 O7.14 Y0.2 -","- Ba1.28 Ca0.4 Cu3 La1.11 O7.14 Y0.2 -","1","0.0625","","Subbarao, M.V.; Rajagopal, H.; Sequeira, A.; Kulkarni, R.G.","Structural studies of the superconducting La3.5-x-y Yy Ca2x Ba3.5-xCu7 Oz system","Physica C (Amsterdam)","1999","319","","181","188","","","","","","","","","","","","","","","","","","","","","","has coordinates","142211","2020-10-21","18:00:00",""
"1521994","3.883","","3.883","","11.677","","90","","90","","90","","176.062","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","(Ba1.2 La0.8) (La0.1 Y0.3 Ca0.6) Cu3 O7.11","","- Ba1.2 Ca0.6 Cu3 La0.9 O7.11 Y0.3 -","- Ba1.2 Ca0.6 Cu3 La0.9 O7.11 Y0.3 -","- Ba1.2 Ca0.6 Cu3 La0.9 O7.11 Y0.3 -","1","0.0625","","Subbarao, M.V.; Rajagopal, H.; Kulkarni, R.G.; Sequeira, A.","Structural studies of the superconducting La3.5-x-y Yy Ca2x Ba3.5-x Cu7 Oz system","Physica C (Amsterdam)","1999","319","","181","188","","","","","","","","","","","","","","","","","","","","","","has coordinates","142212","2020-10-21","18:00:00",""
"1521995","3.85","","3.906","","11.734","","90","","90","","90","","176.457","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Sm Ba2 Cu3 O7","","- Ba2 Cu3 O7 Sm -","- Ba2 Cu3 O7 Sm -","- Ba2 Cu3 O7 Sm -","1","0.125","","Suematsu, H.; Akao, T.; Kawano, M.; Onda, T.; Yamauchi, H.; Ogiwara, H.; Karppinen, M.; Hayakawa, M.","Peak effect in critical current density induced by oxygen non-stoichiometry in cation stoichiometric Sm Ba2 Cu3 O7-d superconductor","Physica C (Amsterdam)","1999","324","","161","171","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521996","3.8532","","3.906","","11.732","","90","","90","","90","","176.574","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Sm Ba1.94 Cu3 O7","","- Ba1.94 Cu3 O7 Sm -","- Ba1.9408 Cu3 O7 Sm -","- Ba1.9408 Cu3 O7 Sm -","1","0.125","","Suematsu, H.; Ogiwara, H.; Kawano, M.; Akao, T.; Onda, T.; Yamauchi, H.; Hayakawa, M.; Karppinen, M.","Peak effect in critical current density induced by oxygen non-stoichiometry in cation stoichiometric Sm Ba2 Cu3 O7-d superconductor","Physica C (Amsterdam)","1999","324","","161","171","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521997","3.8727","","3.8727","","18.91159","","90","","90","","90","","283.632","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Rb Ca2 Na (Nb4 O13)","","- Ca2 Na Nb4 O13 Rb -","- Ca2.001 Na0.999 Nb4 O13 Rb -","- Ca2.001 Na0.999 Nb4 O13 Rb -","1","0.0625","","Sugimoto, W.; Ohkawa, H.; Naito, M.; Kuroda, K.; Sugahara, Y.","Synthesis and structures of reduced niobates with four perovskite-like layers and their semiconducting properties","Journal of Solid State Chemistry","1999","148","","508","512","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521998","3.8716","","3.8716","","19.00919","","90","","90","","90","","284.934","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","Rb Ca2 Na0.8 Sr0.2 (Nb4 O13)","","- Ca2 Na0.8 Nb4 O13 Rb Sr0.2 -","- Ca2.001 Na0.801 Nb4 O13 Rb Sr0.201 -","- Ca2.001 Na0.801 Nb4 O13 Rb Sr0.201 -","1","0.0625","","Sugimoto, W.; Ohkawa, H.; Sugahara, Y.; Naito, M.; Kuroda, K.","Synthesis and structures of reduced niobates with four perovskite-like layers and their semiconducting properties","Journal of Solid State Chemistry","1999","148","","508","512","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521999","3.8704","","3.8704","","19.107","","90","","90","","90","","286.223","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","Rb Ca2 Na0.6 Sr0.4 (Nb4 O13)","","- Ca2 Na0.6 Nb4 O13 Rb Sr0.4 -","- Ca2.001 Na0.6 Nb4 O13 Rb Sr0.399 -","- Ca2.001 Na0.6 Nb4 O13 Rb Sr0.399 -","1","0.0625","","Sugimoto, W.; Naito, M.; Ohkawa, H.; Kuroda, K.; Sugahara, Y.","Synthesis and structures of reduced niobates with four perovskite-like layers and their semiconducting properties","Journal of Solid State Chemistry","1999","148","","508","512","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522001","11.316","","12.763","","19.49","","90","","90","","90","","2814.86","","","","","","","","","","","","","7","F 2 2 2","F 2 2","22","","(Ca5.96 Sr3.54 Bi0.3 Y0.1 Pb0.1) Cu17 O29","","- Bi0.3 Ca5.96 Cu17 O29 Pb0.1 Sr3.54 Y0.1 -","- Bi0.3 Ca5.9598 Cu17 O29 Pb0.0996 Sr3.54 Y0.1 -","- Bi1.2 Ca23.8392 Cu68 O116 Pb0.3984 Sr14.16 Y0.4 -","4","0.25","","Szymczak, R.; Shvanskaya, L.; Szymczak, H.; Mosiniewicz-Szablewska, E.; Baran, M.; Babonas, G.J.; Maltsev, V.; Leonyuk, L.","Magnetic and superconducting properties of doped (Sr, Ca)10 Cu17 O29 - type crystals","Physica C (Amsterdam)","1999","311","","187","196","","","","","","","","","","","","","","","","","","","","","","has coordinates","142220","2020-10-21","18:00:00",""
"1522002","5.4839","","7.7698","","5.5188","","90","","90","","90","","235.149","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","La (Cr0.8 Mn0.2) O3","","- Cr0.8 La Mn0.2 O3 -","- Cr0.8 La Mn0.2 O3 -","- Cr3.2 La4 Mn0.8 O12 -","4","0.5","","Taguchi, H.; Matsu-ura, S.-I.; Nagao, M.; Kido, H.","Electrical properties of perovskite-type La (Cr1-x Mnx) O3+d","Physik (Berlin)","1999","270","","325","331","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522003","5.4626","","5.4626","","5.4626","","60.62","","60.62","","60.62","","116.875","","","","","","","","","","","","","4","R -3 c :R","-P 3* 2n","167","","La0.956 (Cr0.191 Mn0.765) O3","","- Cr0.191 La0.956 Mn0.765 O3 -","- Cr0.191 La0.956 Mn0.765 O3 -","- Cr0.382 La1.912 Mn1.53 O6 -","2","0.166667","","Taguchi, H.; Matsu-ura, S.-I.; Kido, H.; Nagao, M.","Electrical properties of perovskite-type La (Cr1-x Mnx) O3+d","Physik (Berlin)","1999","270","","325","331","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1522004","5.4679","","5.4679","","5.4679","","60.57","","60.57","","60.57","","117.085","","","","","","","","","","","","","3","R -3 c :R","-P 3* 2n","167","","","","- La0.951 Mn0.951 O3 -","- La0.951 Mn0.951 O3 -","- La1.902 Mn1.902 O6 -","2","0.166667","","Taguchi, H.; Matsu-ura, S.-I.; Kido, H.; Nagao, M.","Electrical properties of perovskite-type La (Cr1-x Mnx) O3+d","Physik (Berlin)","1999","270","","325","331","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522006","8.2","","8.2","","5.123","","90","","90","","120","","298.32","","","","","","","","","","","","","4","P 3 2 1","P 3 2""","150","","La3 (Mo0.25 Ga0.75) Ga5 O14","","- Ga5.75 La3 Mo0.25 O14 -","- Ga5.75 La3 Mo0.25 O14 -","- Ga5.75 La3 Mo0.25 O14 -","1","0.166667","","Takeda, H.; Fukuda, T.; Sato, J.; Kato, T.; Morikoshi, H.; Shimamura, K.","Synthesis and structure of La3 (M1/3 Ga2/3) Ga5 O14 (M = Mo(6+) and W(6+)) crystals","Materials Letters","1999","41","","104","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","142225","2020-10-21","18:00:00",""
"1522007","8.208","","8.208","","5.126","","90","","90","","120","","299.078","","","","","","","","","","","","","4","P 3 2 1","P 3 2""","150","","La3 (W0.256 Ga0.744) Ga5 O14","","- Ga5.744 La3 O14 W0.256 -","- Ga5.744 La3 O14 W0.256 -","- Ga5.744 La3 O14 W0.256 -","1","0.166667","","Takeda, H.; Shimamura, K.; Morikoshi, H.; Sato, J.; Kato, T.; Fukuda, T.","Synthesis and structure of La3 (M1/3 Ga2/3) Ga5 O14 (M = Mo(6+) andW(6+)) crystals","Materials Letters","1999","41","","104","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","142226","2020-10-21","18:00:00",""
"1522010","3.8378","","3.8378","","19.53999","","90","","90","","90","","287.799","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","(La1.6 Sr0.4) (Ca0.65 Pr0.35) Cu2 O6","","- Ca0.65 Cu2 La1.6 O6 Pr0.35 Sr0.4 -","- Ca0.65 Cu2 La1.6 O6 Pr0.35 Sr0.4 -","- Ca1.3 Cu4 La3.2 O12 Pr0.7 Sr0.8 -","2","0.0625","","Tao, F.; Zhao, B.-J.; Zhu, S.-F.; Xu, J.-H.; Zhou, X.-J.; Che, G.-C.","Phase relation and crystal structure of M-substituted La212 type compounds (M = Pr, Ag)","Journal of the Sichuan University (Natural Science Edition)","1999","36","","1057","1067","","","","","","","","","","","","","","","","","","","","","","has coordinates","142229","2020-10-21","18:00:00",""
"1522023","10.474","","10.474","","10.474","","90","","90","","90","","1149.05","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","Zn0.95 (Ga0.03 Cr1.93) Se4","","- Cr1.93 Ga0.03 Se4 Zn0.95 -","- Cr1.93 Ga0.03 Se4 Zn0.95 -","- Cr15.44 Ga0.24 Se32 Zn7.6 -","8","0.0416667","","Okonska-Kozlowska, I.; Malicka, E.; Waskowska, A.; Mydlarz, T.","Distribution of metal ions and magnetic properties in spinel system Zn1-x Ga2x/3 Cr2 Se4","Journal of Solid State Chemistry","1999","148","","215","219","","","","","","","","","","","","","","","","","","","","","","has coordinates","142242","2020-10-21","18:00:00",""
"1522024","3.8585","","3.8585","","34.377","","90","","90","","90","","511.806","","","","","","","","","","","","","6","P 4/m m m","-P 4 2","123","","Hg1.44 Re0.5 Ba4 Ca5 Cu7 O20","","- Ba4 Ca5 Cu7 Hg1.44 O20 Re0.5 -","- Ba4 Ca5 Cu7 Hg1.442 O20 Re0.5 -","- Ba4 Ca5 Cu7 Hg1.442 O20 Re0.5 -","1","0.0625","","Schwer, H.; Molinski, R.; Angst, M.; Kopnin, E.M.; Karpinski, J.","Single crystal of the 1223/1234 intergrowth phase Hg1.44 Re0.5 Ba4 Ca5 Cu7 O20 : structure and properties","Physica C (Amsterdam)","1999","311","","49","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","142243","2020-10-21","18:00:00",""
"1522025","4.8754","","2.8141","","5.582","","90","","125.836","","90","","62.087","","","","","","","","","","","","","2","C 1 2/m 1","-C 2y","12","","","","- Ni O2 -","- Ni O2 -","- Ni2 O4 -","2","0.25","","Tarascon, J.M.; Vaughan, G.; Anne, M.; Seguin, L.; Chabre, Y.; Strobel, P.; Amatucci, G.","In situ structural and electrochemical study of Ni1-x Cox O2 metastable oxides prepared by soft chemistry","Journal of Solid State Chemistry","1999","147","","410","420","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522026","2.8048","","2.8048","","4.2509","","90","","90","","120","","28.961","","","","","","","","","","","","","2","P -3 m 1","-P 3 2""","164","","","","- Co O1.92 -","- Co O1.92 -","- Co O1.92 -","1","0.0833333","","Tarascon, J.M.; Seguin, L.; Vaughan, G.; Anne, M.; Chabre, Y.; Strobel, P.; Amatucci, G.","In situ structural and electrochemical study of Ni1-x Cox O2 metastable oxides prepared by soft chemistry","Journal of Solid State Chemistry","1999","147","","410","420","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522027","2.8208","","2.8208","","4.2403","","90","","90","","120","","29.219","","","","","","","","","","","","","2","P -3 m 1","-P 3 2""","164","","","","- Co O2 -","- Co O2 -","- Co O2 -","1","0.0833333","","Tarascon, J.M.; Vaughan, G.; Anne, M.; Chabre, Y.; Seguin, L.; Strobel, P.; Amatucci, G.","In situ structural and electrochemical study of Ni1-x Cox O2 metastable oxides prepared by soft chemistry","Journal of Solid State Chemistry","1999","147","","410","420","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522028","11.956","","5.642","","14.18","","90","","114.09","","90","","873.215","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","La4 Mn3 Ge2 (Ge3.2 Si0.8) O22","","- Ge5.2 La4 Mn3 O22 Si0.8 -","- Ge5.2 La4 Mn3 O22 Si0.8 -","- Ge10.4 La8 Mn6 O44 Si1.6 -","2","0.5","","Taviot-Gueho, C.; Chopinet, C.; Mozdzierz, N.; Palvadeau, P.; Rouxel, J.; Leone, P.","Synthesis and structural characterisation of La4 Mn3 Ge5.2 Si0.8 O22, a new compound with the perrierite structure","Journal of Solid State Chemistry","1999","147","","247","250","","","","","","","","","","","","","","","","","","","","","","has coordinates","142247","2020-10-21","18:00:00",""
"1522030","5.0362","","5.0362","","4.225","","90","","90","","120","","92.803","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Sm0.667 Fe5.667 N1.044","","- Fe5.667 N1.044 Sm0.667 -","- Fe5.664 N1.044 Sm0.667 -","- Fe5.664 N1.044 Sm0.667 -","1","0.0416667","","Teresiak, A.; Kubis, M.; Wolf, M.; Mattern, N.; Gruner, J.W.; Mueller, K.H.","Influence of nitrogenation on structure development and magnetic properties of mechanically alloyed and annealed Sm - Fe powders","Journal of Alloys Compd.","1999","292","","212","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","142249","2020-10-21","18:00:00",""
"1522031","8.728","","8.728","","12.674","","90","","90","","120","","836.13","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Sm1.903 Fe16.959 N2.962","","- Fe16.959 N2.962 Sm1.903 -","- Fe16.958 N2.964 Sm1.903 -","- Fe50.874 N8.892 Sm5.709 -","3","0.0833333","","Teresiak, A.; Kubis, M.; Mattern, N.; Wolf, M.; Gruner, J.W.; Mueller, K.H.","Influence of nitrogenation on structure development and magnetic properties of mechanically alloyed and annealed Sm - Fe powders","Journal of Alloys Compd.","1999","292","","212","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","142250","2020-10-21","18:00:00",""
"1522032","8.728","","8.728","","12.671","","90","","90","","120","","835.932","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Sm1.924 Fe16.874 N2.899","","- Fe16.874 N2.899 Sm1.924 -","- Fe16.874 N2.901 Sm1.924 -","- Fe50.622 N8.703 Sm5.772 -","3","0.0833333","","Teresiak, A.; Kubis, M.; Mueller, K.H.; Mattern, N.; Wolf, M.; Gruner, J.W.","Influence of nitrogenation on structure development and magnetic properties of mechanically alloyed and annealed Sm - Fe powders","Journal of Alloys Compd.","1999","292","","212","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","142251","2020-10-21","18:00:00",""
"1522033","8.732","","8.732","","12.666","","90","","90","","120","","836.368","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Sm1.924 Fe16.874 N2.874","","- Fe16.874 N2.874 Sm1.924 -","- Fe16.874 N2.874 Sm1.924 -","- Fe50.622 N8.622 Sm5.772 -","3","0.0833333","","Teresiak, A.; Kubis, M.; Mattern, N.; Gruner, J.W.; Wolf, M.; Mueller, K.H.","Influence of nitrogenation on structure development and magnetic properties of mechanically alloyed and annealed Sm - Fe powders","Journal of Alloys Compd.","1999","292","","212","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","142252","2020-10-21","18:00:00",""
"1522034","8.733","","8.733","","12.668","","90","","90","","120","","836.692","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Sm1.856 Fe16.932 N2.88","","- Fe16.932 N2.88 Sm1.856 -","- Fe16.932 N2.88 Sm1.856 -","- Fe50.796 N8.64 Sm5.568 -","3","0.0833333","","Teresiak, A.; Wolf, M.; Kubis, M.; Mattern, N.; Gruner, J.W.; Mueller, K.H.","Influence of nitrogenation on structure development and magnetic properties of mechanically alloyed and annealed Sm - Fe powders","Journal of Alloys Compd.","1999","292","","212","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","142253","2020-10-21","18:00:00",""
"1522035","5.9618","","8.3506","","5.8734","","90","","90","","90","","292.405","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Sr Tb O3","","- O3 Sr Tb -","- O3 Sr Tb -","- O12 Sr4 Tb4 -","4","0.5","","Tezuka, K.; Itoh, M.; Haga, M.; Hinatsu, Y.","Crystal and magnetic structures of SrTbO~3~ and BaTbO~3~ by powder neutron diffraction","Materials Science Forum","1999","","","578","585","10.4028/www.scientific.net/MSF.315-317.578","","","","","","","","","","","","","","","","","","","","","has coordinates","182029","2020-10-21","18:00:00",""
"1522036","10.5439","","10.5439","","10.5439","","90.05","","90.05","","90.05","","1172.2","","","","","","","","","","","","","3","R -3 m :R","-P 3* 2","166","","Ce2 Zr2 O7.98","","- Ce2 O7.98 Zr2 -","- Ce2 O7.98 Zr2 -","- Ce16 O63.84 Zr16 -","8","0.666667","","Thomson, J.B.; Armstrong, A.R.; Bruce, P.G.","An oxygen-rich pyrochlore with fluorite composition","Journal of Solid State Chemistry","1999","148","","56","62","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1522039","3.8657","","29.777","","3.852","","90","","90","","90","","443.4","","","","","","","","","","","","","4","C 2 2 2","C 2 2","21","","K Ca2 (Ta3 O10)","","- Ca2 K O10 Ta3 -","- Ca2 K O10 Ta3 -","- Ca4 K2 O20 Ta6 -","2","0.25","","Toda, K.; Takakuwa, S.; Teranishi, T.; Sakai, N.; Sato, M.","New layered perovskite compound synthesized by the soft chemistry: K Ca2 Ta3 O10","Key Engineering Materials","1999","169","","231","234","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522040","3.8789","","29.021","","3.8558","","90","","90","","90","","434.046","","","","","","","","","","","","","4","C 2 2 2","C 2 2","21","","K Ca2 (Ta3 O10)","","- Ca2 K O10 Ta3 -","- Ca2 K O10 Ta3 -","- Ca4 K2 O20 Ta6 -","2","0.25","","Toda, K.; Takakuwa, S.; Sakai, N.; Teranishi, T.; Sato, M.","New layered perovskite compound synthesized by the soft chemistry: K Ca2 Ta3 O10","Key Engineering Materials","1999","169","","231","234","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522041","3.8515","","3.8515","","28.339","","90","","90","","90","","420.382","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Li Ca2 (Ta3 O10)","","- Ca2 Li O10 Ta3 -","- Ca2 Li O10 Ta3 -","- Ca4 Li2 O20 Ta6 -","2","0.0625","","Toda, K.; Teranishi, T.; Ye, Z.-G.; Sato, M.; Hinatsu, Y.","Structural chemistry of new ion-exchangeable tantalates with layered perovskite structure: new Dion-Jacobson phase M Ca2 Ta3 O10 (M = alkali metal) and Ruddlesden-Popper phase Na2 Ca2 Ta3 O10","Materials Research Bulletin","1999","34","","971","982","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522042","3.8573","","3.8573","","15.044","","90","","90","","90","","223.836","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Rb Ca2 (Ta3 O10)","","- Ca2 O10 Rb Ta3 -","- Ca2 O10 Rb Ta3 -","- Ca2 O10 Rb Ta3 -","1","0.0625","","Toda, K.; Teranishi, T.; Ye, Z.-G.; Sato, M.; Hinatsu, Y.","Structural chemistry of new ion-exchangeable tantalates with layered perovskite structure: new Dion-Jacobson phase M Ca2 Ta3 O10(M = alkali metal) and Ruddlesden-Popper phase Na2 Ca2 Ta3 O10","Materials Research Bulletin","1999","34","","971","982","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522043","3.8659","","3.8659","","15.2538","","90","","90","","90","","227.971","","","","","","","","","","","","","4","P 4/m m m","-P 4 2","123","","Cs Ca2 (Ta3 O10)","","- Ca2 Cs O10 Ta3 -","- Ca2 Cs O10 Ta3 -","- Ca2 Cs O10 Ta3 -","1","0.0625","","Toda, K.; Ye, Z.-G.; Teranishi, T.; Hinatsu, Y.; Sato, M.","Structural chemistry of new ion-exchangeable tantalates with layered perovskite structure: new Dion-Jacobson phase M Ca2 Ta3 O10(M = alkali metal) and Ruddlesden-Popper phase Na2 Ca2 Ta3 O10","Materials Research Bulletin","1999","34","","971","982","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522051","7.846","","12.032","","8.735","","90","","111.41","","90","","767.706","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","K (H Se O4) (H2 Se O4)","","- H3 K O8 Se2 -","- H3 K O8 Se2 -","- H12 K4 O32 Se8 -","4","1","","Troyanov, S.I.; Zakharov, M.A.; Morozov, I.V.; Kemnitz, E.","Synthesis and crystal structure of hydrogen selenates K (H Se O4) (H2 Se O4) and Cs (H Se O4) (H2 Se O4)","Kristallografiya","1999","44","","607","611","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:08",""
"1522052","7.789","","12.996","","8.382","","90","","93.53","","90","","846.865","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cs (H Se O4) (H2 Se O4)","","- Cs H3 O8 Se2 -","- Cs H3 O8 Se2 -","- Cs4 H12 O32 Se8 -","4","1","","Troyanov, S.I.; Kemnitz, E.; Morozov, I.V.; Zakharov, M.A.","Synthesis and crystal structure of hydrogen selenates K (H Se O4) (H2 Se O4) and Cs (H Se O4) (H2 Se O4)","Kristallografiya","1999","44","","607","611","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522053","6.001","","6.001","","14.205","","90","","90","","120","","443.016","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Na2 (Hf (O H)6)","","- H6 Hf Na2 O6 -","- H6 Hf Na2 O6 -","- H18 Hf3 Na6 O18 -","3","0.166667","","Troyanov, S.I.; Kostrikin, A.V.; Lin'ko, I.V.; Ezhov, A.I.; Zaitsev, B.E.; Spiridonov, F.M.","Crystal structure of hydroxohafnates Na2 Hf (O H)6 and K2 Hf (O H)6","Kristallografiya","1999","44","","1054","1058","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:08",""
"1522054","13.564","","16.651","","5.754","","90","","90","","90","","1299.56","","","","","","","","","","","","","4","C m m a","-C 2a 2","67","","K2 (Hf (O H)6)","","- H6 Hf K2 O6 -","- Hf K2 O6 -","- Hf8 K16 O48 -","8","0.5","","Troyanov, S.I.; Zaitsev, B.E.; Kostrikin, A.V.; Lin'ko, I.V.; Ezhov, A.I.; Spiridonov, F.M.","Crystal structure of hydroxohafnates Na2 Hf (O H)6 and K2 Hf (O H)6","Kristallografiya","1999","44","","1054","1058","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522055","4.06","","4.06","","15.4","","90","","90","","90","","253.847","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Gd (Ti0.8 Zr0.2) Ge","","- Gd Ge Ti0.8 Zr0.2 -","- Gd Ge Ti0.8 Zr0.2 -","- Gd4 Ge4 Ti3.2 Zr0.8 -","4","0.125","","Tskhadadze, I.A.; Chernyshev, V.V.; Streletskii, A.N.; Leonov, A.V.; Seropegin, Yu.D.; Sviridov, I.A.; Telegina, I.V.; Verbetskii, V.N.; Morozkin, A.V.","Gd Ti Ge (Ce Sc Si - type structure) and Gd Ti Ge (Ce Fe Si type structure) as the coherent phases with different magnetic and hydrogenization properties","Materials Research Bulletin","1999","34","","1773","1787","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522056","4.065","","4.065","","15.454","","90","","90","","90","","255.365","","","","","","","","","","","","","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","","Tskhadadze, I.A.; Chernyshev, V.V.; Telegina, I.V.; Sviridov, I.A.; Leonov, A.V.; Streletskii, A.N.; Verbetskii, V.N.; Morozkin, A.V.; Seropegin, Yu.D.","Gd Ti Ge (Ce Sc Si - type structure) and Gd Ti Ge (Ce Fe Si type structure) as the coherent phases with different magnetic and hydrogenization properties","Materials Research Bulletin","1999","34","","1773","1787","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522057","4.069","","4.069","","7.725","","90","","90","","90","","127.901","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Gd Ti Ge","","- Gd Ge Ti -","- Gd Ge Ti -","- Gd2 Ge2 Ti2 -","2","0.125","","Tskhadadze, I.A.; Chernyshev, V.V.; Leonov, A.V.; Verbetskii, V.N.; Sviridov, I.A.; Streletskii, A.N.; Morozkin, A.V.; Telegina, I.V.; Seropegin, Yu.D.","Gd Ti Ge (Ce Sc Si - type structure) and Gd Ti Ge (Ce Fe Si type structure) as the coherent phases with different magnetic and hydrogenization properties","Materials Research Bulletin","1999","34","","1773","1787","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522063","6.10476","","16.75409","","5.97253","","90","","90","","90","","610.869","","","","","","","","","","","","","3","I b m 2","I 2 -2b","46","","","","- Ba2 In2 O5 -","- Ba2 In2 O5 -","- Ba8 In8 O20 -","4","0.5","","Uchimoto, Y.; Kinuhata, M.; Takagu, H.; Yoshida, H.; Inagaki, T.; Yao, T.","Crystal structure of metal cation-doped Ba2 In2 O5 and its oxide ion conductivity","Electrochemical Society Proceedings","1999","99","","317","326","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522064","4.19725","","4.19725","","4.19725","","90","","90","","90","","73.943","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ba (In0.75 Ga0.25) O2.5","","- Ba Ga0.25 In0.75 O2.5 -","- Ba Ga0.25 In0.75 O2.4999 -","- Ba Ga0.25 In0.75 O2.4999 -","1","0.0208333","","Uchimoto, Y.; Kinuhata, M.; Takagu, H.; Yao, T.; Yoshida, H.; Inagaki, T.","Crystal structure of metal cation-doped Ba2 In2 O5 and its oxide ion conductivity","Electrochemical Society Proceedings","1999","99","","317","326","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522066","4.17804","","4.17804","","4.17804","","90","","90","","90","","72.932","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Ba (In0.65 Ga0.35) O2.5","","- Ba Ga0.35 In0.65 O2.5 -","- Ba Ga0.35 In0.65 O2.4999 -","- Ba Ga0.35 In0.65 O2.4999 -","1","0.0208333","","Uchimoto, Y.; Kinuhata, M.; Inagaki, T.; Takagu, H.; Yao, T.; Yoshida, H.","Crystal structure of metal cation-doped Ba2 In2 O5 and its oxide ion conductivity","Electrochemical Society Proceedings","1999","99","","317","326","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522086","3.796","","3.796","","28.433","","90","","90","","90","","409.709","","","","","","","","","","","","","6","I 4/m m m","-I 4 2","139","","(Tl0.8 Hg0.7 Cu0.5) (Sr1.70 Ca0.30) (Ca0.74 Sr0.26) Cu2 O7.5","","- Ca1.04 Cu2.5 Hg0.7 O7.5 Sr1.96 Tl0.8 -","- Ca1.04 Cu2.5 Hg0.7 O7.5 Sr1.96 Tl0.8 -","- Ca2.08 Cu5 Hg1.4 O15 Sr3.92 Tl1.6 -","2","0.0625","","Valldor, M.; Bryntse, I.; Morawski, A.","Synthesis and X-ray single-crystal analysis of a 2212-type superconductor in the Tl - Hg - Sr - Ca - Cu - O system","Physica C (Amsterdam)","1999","314","","27","35","","","","","","","","","","","","","","","","","","","","","","has coordinates","142305","2020-10-21","18:00:00",""
"1522101","8.6595","","8.6595","","12.5329","","90","","90","","120","","813.894","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Ho2 Fe5 (Fe10 Ga2) C2","","- C2 Fe15 Ga2 Ho2 -","- C2.001 Fe15.026 Ga1.974 Ho2 -","- C6.003 Fe45.078 Ga5.922 Ho6 -","3","0.0833333","","Venkatesan, M.; Varadaraju, U.V.; Rama Rao, K.V.S.; Malik, S.K.; Luo, H.; Yelon, W.B.","Neutron diffraction studies on (Ho1-x Erx)2 Fe15 Ga2 Cy compounds","Journal of Applied Physics","1999","86","","3290","3294","","","","","","","","","","","","","","","","","","","","","","has coordinates","142321","2020-10-21","18:00:00",""
"1522102","8.6353","","8.6353","","12.5414","","90","","90","","120","","809.9","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Er2 Fe5 (Fe10.05 Ga1.95) C2","","- C2 Er2 Fe15.05 Ga1.95 -","- C2.001 Er2 Fe15.05 Ga1.95 -","- C6.003 Er6 Fe45.15 Ga5.85 -","3","0.0833333","","Venkatesan, M.; Varadaraju, U.V.; Rama Rao, K.V.S.; Malik, S.K.; Luo, H.; Yelon, W.B.","Neutron diffraction studies on (Ho1-x Erx)2 Fe15 Ga2 Cy compounds","Journal of Applied Physics","1999","86","","3290","3294","","","","","","","","","","","","","","","","","","","","","","has coordinates","142322","2020-10-21","18:00:00",""
"1522103","8.6572","","8.6572","","12.5396","","90","","90","","120","","813.897","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","(Ho Er) Fe5 (Fe10.08 Ga1.92) C2","","- C2 Er Fe15.08 Ga1.92 Ho -","- C2.001 Er Fe15.08 Ga1.92 Ho -","- C6.003 Er3 Fe45.24 Ga5.76 Ho3 -","3","0.0833333","","Venkatesan, M.; Rama Rao, K.V.S.; Varadaraju, U.V.; Luo, H.; Malik, S.K.; Yelon, W.B.","Neutron diffraction studies on (Ho1-x Erx)2 Fe15 Ga2 Cy compounds","Journal of Applied Physics","1999","86","","3290","3294","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522108","7.964","","7.964","","4.095","","90","","90","","120","","224.93","","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","Er4 (Ga1.355 Ge5.645)","","- Er4 Ga1.355 Ge5.645 -","- Er4 Ga1.3545 Ge5.6455 -","- Er4 Ga1.3545 Ge5.6455 -","1","0.0833333","","Venturini, G.; Verniere, A.; Malaman, B.","Evolution of the non-stoichiometry in the Er (Ge1-x Gax)2 compounds. Crystal structure of Er4 (Ge, Ga)7, a new hexagonal Al B2 derivative","Journal of Alloys Compd.","1999","291","","201","207","","","","","","","","","","","","","","","","","","","","","","has coordinates","142328","2020-10-21","18:00:00",""
"1522122","4.076","","4.076","","9.783","","90","","90","","90","","162.533","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","U Ir2 Si2","","- Ir2 Si2 U -","- Ir2 Si2 U -","- Ir4 Si4 U2 -","2","0.125","","Verniere, A.; Boucherle, J.X.; Lejay, P.; Gillon, B.","Field-induced magnetic form factor in U Ir2 Si2","Physik (Berlin)","1999","267","","41","46","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522124","10.029","","10.258","","14.152","","109.21","","106.14","","98.97","","1270.6","","","","","","","","","","","","","6","P -1","-P 1","2","","(N2 H5)2 (S (S2)3 (Mo I2)3) (H2 O)1.5","","- H13 I6 Mo3 N4 O1.5 S7 -","- I6 Mo3 N4 O1.5 S7 -","- I12 Mo6 N8 O3 S14 -","2","1","","Virovets, A.V.; Sokolov, M.N.; Kalinina, I.V.; Podberezskaya, N.V.; Fedorov, V.E.","Specific nonbonding interactions in the structure of (N2 H5)2 (Mo3 S7 I6) . 1.5(H2 O)","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1999","40","","57","61","","","","","","","","","","","","","","","","","","","","","","has coordinates","142344","2020-10-21","18:00:00",""
"1522133","8.7305","","9.1651","","5.3539","","90","","90","","90","","428.397","","","","","","","","","","","","","4","P n a 21","P 2c -2n","33","","K Zn (P O4)","","- K O4 P Zn -","- K O4 P Zn -","- K4 O16 P4 Zn4 -","4","1","","Wallez, G.; Lucas, F.; Souron, J.P.; Quarton, M.","Potassium-zinc monophosphate: an original polymorphic tridymite derivate","Materials Research Bulletin","1999","34","","1251","1261","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522134","8.7695","","5.349","","9.1817","","90","","90","","90","","430.696","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","K Zn (P O4)","","- K O4 P Zn -","- K O4 P Zn -","- K4 O16 P4 Zn4 -","4","0.5","","Wallez, G.; Lucas, F.; Souron, J.P.; Quarton, M.","Potassium-zinc monophosphate: an original polymorphic tridymite derivate","Materials Research Bulletin","1999","34","","1251","1261","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522138","4.0901","","4.0901","","20.243","","90","","90","","90","","338.643","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","La Cu1.233 As2","","- As2 Cu1.233 La -","- As2 Cu1.233 La -","- As8 Cu4.932 La4 -","4","0.125","","Wang, M.; McDonald, R.; Mar, A.","Nonstoichiometric rare-earth copper arsenides RE Cu1+x As2 (RE = La, Ce, Pr)","Journal of Solid State Chemistry","1999","147","","140","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522139","4.0265","","4.0265","","10.071","","90","","90","","90","","163.278","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Ce Cu1.1 As2","","- As2 Ce Cu1.1 -","- As2 Ce Cu1.101 -","- As4 Ce2 Cu2.202 -","2","0.125","","Wang, M.; McDonald, R.; Mar, A.","Nonstoichiometric rare-earth copper arsenides RE Cu1+x As2 (RE = La, Ce, Pr)","Journal of Solid State Chemistry","1999","147","","140","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522140","4.0086","","4.0086","","10.0496","","90","","90","","90","","161.486","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","Pr Cu1.09 As2","","- As2 Cu1.09 Pr -","- As2 Cu1.09 Pr -","- As4 Cu2.18 Pr2 -","2","0.125","","Wang, M.; Mar, A.; McDonald, R.","Nonstoichiometric rare-earth copper arsenides RE Cu1+x As2 (RE = La, Ce, Pr)","Journal of Solid State Chemistry","1999","147","","140","145","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522141","13.9557","","6.1349","","6.3528","","90","","90","","90","","543.907","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Y Cu (O H)3 (S O4)","","- Cu H3 O7 S Y -","- Cu O7 S Y -","- Cu4 O28 S4 Y4 -","4","0.5","","Wang, X.-Q.; Liu, L.-M.; Jacobson, A.J.","Synthesis and structures of yttrium-transition metal sulfates Y M (O H)3 (S O4), M = Ni, Cu","Journal of Solid State Chemistry","1999","147","","641","646","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522142","13.3347","","6.1256","","6.483","","90","","90","","90","","529.551","","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Y Ni (O H)3 (S O4)","","- H3 Ni O7 S Y -","- Ni O7 S Y -","- Ni4 O28 S4 Y4 -","4","1","","Wang, X.-Q.; Liu, L.-M.; Jacobson, A.J.","Synthesis and structures of yttrium-transition metal sulfates Y M (O H)3 (S O4), M = Ni, Cu","Journal of Solid State Chemistry","1999","147","","641","646","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522143","5.146","","5.205","","5.313","","90","","99.1","","90","","140.517","","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","Zr O2","","- O2 Zr -","- O2 Zr -","- O8 Zr4 -","4","1","","Wang, D.-N.; Guo, Y.-Q.; Liang, K.-M.; Tao, K.","Crystal structure of zirconia by Rietveld refinement","Science in China","1999","42","","80","86","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522145","4.1231","","4.1231","","13.096","","90","","90","","90","","222.631","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- La2 O2 Te -","- La2 O2 Te -","- La4 O4 Te2 -","2","0.0625","","Weber, F.A.; Schleid, T.","Ueber Oxidtelluride (M2 O2 Te) der leichten Lanthanide (M = La-Nd, Sm-Ho) im A-Typ mit anti-(Th Cr2 Si2)-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1833","1838","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522146","4.0817","","4.0817","","12.947","","90","","90","","90","","215.701","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Ce2 O2 Te -","- Ce2 O2 Te -","- Ce4 O4 Te2 -","2","0.0625","","Weber, F.A.; Schleid, T.","Ueber Oxidtelluride (M2 O2 Te) der leichten Lanthanide (M = La-Nd, Sm-Ho) im A-Typ mit anti-(Th Cr2 Si2)-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1833","1838","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522147","4.0562","","4.0562","","12.858","","90","","90","","90","","211.55","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Pr2 O2 Te","","- O2 Pr2 Te -","- O2 Pr2 Te -","- O4 Pr4 Te2 -","2","0.0625","","Weber, F.A.; Schleid, T.","Ueber Oxidtelluride (M2 O2 Te) der leichten Lanthanide (M = La-Nd, Sm-Ho) im A-Typ mit anti-(Th Cr2 Si2)-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1833","1838","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522148","4.0308","","4.0308","","12.771","","90","","90","","90","","207.495","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Nd2 O2 Te -","- Nd2 O2 Te -","- Nd4 O4 Te2 -","2","0.0625","","Weber, F.A.; Schleid, T.","Ueber Oxidtelluride (M2 O2 Te) der leichten Lanthanide (M = La-Nd, Sm-Ho) im A-Typ mit anti-(Th Cr2 Si2)-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1833","1838","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522149","3.9983","","3.9983","","12.655","","90","","90","","90","","202.308","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Sm2 O2 Te","","- O2 Sm2 Te -","- O2 Sm2 Te -","- O4 Sm4 Te2 -","2","0.0625","","Weber, F.A.; Schleid, T.","Ueber Oxidtelluride (M2 O2 Te) der leichten Lanthanide (M = La-Nd, Sm-Ho) im A-Typ mit anti-(Th Cr2 Si2)-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1833","1838","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522150","3.9756","","3.9756","","12.579","","90","","90","","90","","198.816","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Eu2 O2 Te -","- Eu2 O2 Te -","- Eu4 O4 Te2 -","2","0.0625","","Weber, F.A.; Schleid, T.","Ueber Oxidtelluride (M2 O2 Te) der leichten Lanthanide (M = La-Nd, Sm-Ho) im A-Typ mit anti-(Th Cr2 Si2)-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1833","1838","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522151","3.962","","3.962","","12.532","","90","","90","","90","","196.72","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Gd2 O2 Te -","- Gd2 O2 Te -","- Gd4 O4 Te2 -","2","0.0625","","Weber, F.A.; Schleid, T.","Ueber Oxidtelluride (M2 O2 Te) der leichten Lanthanide (M = La-Nd, Sm-Ho) im A-Typ mit anti-(Th Cr2 Si2)-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1833","1838","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522152","3.9389","","3.9389","","12.454","","90","","90","","90","","193.223","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","Tb2 O2 Te","","- O2 Tb2 Te -","- O2 Tb2 Te -","- O4 Tb4 Te2 -","2","0.0625","","Weber, F.A.; Schleid, T.","Ueber Oxidtelluride (M2 O2 Te) der leichten Lanthanide (M = La-Nd, Sm-Ho) im A-Typ mit anti-(Th Cr2 Si2)-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1833","1838","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522153","3.9234","","3.9234","","12.403","","90","","90","","90","","190.92","","","","","","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Dy2 O2 Te -","- Dy2 O2 Te -","- Dy4 O4 Te2 -","2","0.0625","","Weber, F.A.; Schleid, T.","Ueber Oxidtelluride (M2 O2 Te) der leichten Lanthanide (M = La-Nd, Sm-Ho) im A-Typ mit anti-(Th Cr2 Si2)-Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1833","1838","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522154","6.337","","7.2442","","11.2513","","90","","90","","90","","516.508","","","","","","","","","","","","","4","P b c m","-P 2c 2b","57","","Pr2 Te (Si O4)","","- O4 Pr2 Si Te -","- O4 Pr2 Si Te -","- O16 Pr8 Si4 Te4 -","4","0.5","","Weber, F.A.; Schleid, T.","Zwei Formen (A- und B-Typ) von Pr2 Te (Si O4)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","2071","2076","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522155","9.899","","6.4803","","8.7068","","90","","94.307","","90","","556.951","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Pr2 Te (Si O4)","","- O4 Pr2 Si Te -","- O4 Pr2 Si Te -","- O16 Pr8 Si4 Te4 -","4","1","","Weber, F.A.; Schleid, T.","Zwei Formen (A- und B-Typ) von Pr2 Te (Si O4)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","2071","2076","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522156","35.288","","5.418","","9.522","","90","","98.95","","90","","1798.35","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","(La2.25 Ce) Nb O6 Cl3.39","","- Ce Cl3.39 La2.25 Nb O6 -","- Ce1.001 Cl3.3907 La2.249 Nb O6 -","- Ce8.008 Cl27.1256 La17.992 Nb8 O48 -","8","1","","Weitzel, H.; Behler, B.; Gruehn, R.","Beitraege zur Untersuchung nichtstoechiometrischer Verbindungen. XLV. Neue thermische Abbauprodukte von Ln2 Ce M O6 Cl3 (M = Nb, Ta;Ln = La-Sm) - Darstellung von strukturverwandtem (La, Tb)3.5 Ta O6 Cl4-x","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","221","232","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522157","18.863","","5.454","","9.527","","90","","102.44","","90","","957.115","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","(Pr2.5 Ce) Nb O6 Cl3.737","","- Ce Cl3.737 Nb O6 Pr2.5 -","- Ce1.001 Cl3.7374 Nb O6 Pr2.499 -","- Ce4.004 Cl14.9496 Nb4 O24 Pr9.996 -","4","0.5","","Weitzel, H.; Behler, B.; Gruehn, R.","Beitraege zur Untersuchung nichtstoechiometrischer Verbindungen. XLV. Neue thermische Abbauprodukte von Ln2 Ce M O6 Cl3 (M = Nb, Ta;Ln = La-Sm) - Darstellung von strukturverwandtem (La, Tb)3.5 Ta O6 Cl4-x","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","221","232","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522165","9.2496","","9.2496","","5.7486","","90","","90","","120","","425.93","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Eu (Cl O4)3","","- Cl3 Eu O12 -","- Cl3 Eu O12 -","- Cl6 Eu2 O24 -","2","0.166667","","Wickleder, M.S.","Eu (Cl O4)3 : first single crystals of an anhydrous rare-earth perchlorate","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","11","12","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522167","9.3361","","9.3361","","5.8488","","90","","90","","120","","441.498","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Pr (Cl O4)3","","- Cl3 O12 Pr -","- Cl3 O12 Pr -","- Cl6 O24 Pr2 -","2","0.166667","","Wickleder, M.S.; Schaefer, W.","Synthesis and structure of anhydrous rare-earth perchlorates M (Cl O4)3 (M = La, Ce-Er, Y): derivatives of the U Cl3 type structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","309","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522169","9.197","","9.197","","5.597","","90","","90","","120","","409.995","","","","","","","","","","","","","3","P 63/m","-P 6c","176","","Er (Cl O4)3","","- Cl3 Er O12 -","- Cl3 Er O12 -","- Cl6 Er2 O24 -","2","0.166667","","Wickleder, M.S.; Schaefer, W.","Synthesis and structure of anhydrous rare-earth perchlorates M (Cl O4)3 (M = La, Ce-Er, Y): derivatives of the U Cl3 type structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","309","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522183","13.7571","","13.7571","","19.93619","","90","","90","","120","","3267.58","","","","","","","","","","","","","3","P -3 1 c","-P 3 2c","163","","Al24 (P O4)24","","- Al24 O96 P24 -","- Al24 O96 P24 -","- Al24 O96 P24 -","1","0.0833333","","Wilson, S.T.; Broach, R.W.; Bateman, C.A.; Blackwell, C.S.; McGuire, N.K.; Kirchner, R.M.","Synthesis, characterization and structure of SAPO-56, a member of the ABC double-six-ring family of materials with stacking sequence AABBCCBB","Microporous and Mesoporous Materials","1999","28","","125","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","142403","2020-10-21","18:00:00",""
"1522187","3.918","","4.024","","5.629","","87.57","","90.3","","90.14","","88.666","","","","","","","","","","","","","3","P -1","-P 1","2","","(Bi0.667 La1.333) O3.364","","- Bi0.667 La1.333 O3.364 -","- Bi0.666 La1.334 O3.364 -","- Bi0.666 La1.334 O3.364 -","1","0.5","","Wolcyrz, M.; Horyn, R.; Bouree, F.","Structural peculiarities of Bi La2 O4.5+d examined by X-ray and neutron powder diffraction","Journal of Physics: Condensed Matter","1999","11","","5757","5765","","","","","","","","","","","","","","","","","","","","","","has coordinates","142407","2020-10-21","18:00:00",""
"1522189","3.966","","3.966","","9.931","","90","","90","","120","","135.279","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","(Bi La2) O4.5","","- Bi La2 O4.5 -","- Bi0.999 La2.001 O4.5 -","- Bi0.999 La2.001 O4.5 -","1","0.0555556","","Wolcyrz, M.; Horyn, R.; Bouree, F.","Structural peculiarities of Bi La2 O4.5+d examined by X-ray and neutron powder diffraction","Journal of Physics: Condensed Matter","1999","11","","5757","5765","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522191","6.826","","3.987","","4.051","","90","","125.11","","90","","90.189","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","(Bi0.667 La1.333) O3","","- Bi0.667 La1.333 O3 -","- Bi0.666 La1.334 O3 -","- Bi0.666 La1.334 O3 -","1","0.125","","Wolcyrz, M.; Horyn, R.; Bouree, F.","Structural peculiarities of Bi La2 O4.5+d examined by X-ray and neutron powder diffraction","Journal of Physics: Condensed Matter","1999","11","","5757","5765","","","","","","","","","","","","","","","","","","","","","","has coordinates","142411","2020-10-21","18:00:00",""
"1522193","9.7477","","9.7477","","11.8791","","90","","90","","120","","977.504","","","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","Sr4 Pt O6","","- O6 Pt Sr4 -","- O6 Pt Sr4 -","- O36 Pt6 Sr24 -","6","0.166667","","Wong-Ng, W.; Young, R.A.; Kaduk, J.A.; Jiang, F.; Swartzendruber, L.J.; Brown, H.J.","Investigation of (Sr4-d Cad) Pt O6 using X-ray Rietveld refinement","Powder Diffraction","1999","14","","181","189","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522195","9.724","","9.724","","11.5214","","90","","90","","120","","943.465","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(Sr3.15 Ca0.85) Pt O6","","- Ca0.85 O6 Pt Sr3.15 -","- Ca0.85 O6 Pt Sr3.15 -","- Ca5.1 O36 Pt6 Sr18.9 -","6","0.166667","","Wong-Ng, W.; Swartzendruber, L.J.; Kaduk, J.A.; Brown, H.J.; Young, R.A.; Jiang, F.","Investigation of (Sr4-d Cad) Pt O6 using X-ray Rietveld refinement","Powder Diffraction","1999","14","","181","189","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522197","9.6153","","9.6153","","11.4284","","90","","90","","120","","915.044","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(Sr2.145 Ca1.855) Pt O6","","- Ca1.855 O6 Pt Sr2.145 -","- Ca1.855 O6 Pt Sr2.145 -","- Ca11.13 O36 Pt6 Sr12.87 -","6","0.166667","","Wong-Ng, W.; Kaduk, J.A.; Young, R.A.; Jiang, F.; Swartzendruber, L.J.; Brown, H.J.","Investigation of (Sr4-d Cad) Pt O6 using X-ray Rietveld refinement","Powder Diffraction","1999","14","","181","189","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522199","9.478","","9.478","","11.3301","","90","","90","","120","","881.45","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(Sr1.094 Ca2.906) Pt O6","","- Ca2.906 O6 Pt Sr1.094 -","- Ca2.906 O6 Pt Sr1.094 -","- Ca17.436 O36 Pt6 Sr6.564 -","6","0.166667","","Wong-Ng, W.; Brown, H.J.; Kaduk, J.A.; Jiang, F.; Young, R.A.; Swartzendruber, L.J.","Investigation of (Sr4-d Cad) Pt O6 using X-ray Rietveld refinement","Powder Diffraction","1999","14","","181","189","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522207","5.00795","","5.00795","","14.3422","","90","","90","","120","","311.506","","","","","","","","","","","","","4","R 3 :H","R 3","146","","Li2 (Ge Te O6)","","- Ge Li2 O6 Te -","- Ge Li2 O6 Te -","- Ge3 Li6 O18 Te3 -","3","0.333333","","Woodward, P.M.; Du, L.-S.; Sleight, A.W.; Grey, C.P.","Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6","Journal of Solid State Chemistry","1999","147","","99","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522209","5.10118","","5.10118","","15.959","","90","","90","","120","","359.648","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Na2 (Ge Te O6)","","- Ge Na2 O6 Te -","- Ge Na2 O6 Te -","- Ge3 Na6 O18 Te3 -","3","0.166667","","Woodward, P.M.; Sleight, A.W.; Du, L.-S.; Grey, C.P.","Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6","Journal of Solid State Chemistry","1999","147","","99","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522211","5.2201","","5.2201","","15.8375","","90","","90","","120","","373.745","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Na2 (Ti Te O6)","","- Na2 O6 Te Ti -","- Na2 O6 Te Ti -","- Na6 O18 Te3 Ti3 -","3","0.166667","","Woodward, P.M.; Grey, C.P.; Sleight, A.W.; Du, L.-S.","Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6","Journal of Solid State Chemistry","1999","147","","99","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522213","5.3416","","5.3416","","10.6991","","90","","90","","120","","264.375","","","","","","","","","","","","","4","P -3 1 c","-P 3 2c","163","","Na1.84 (Sn Te O6)","","- Na1.84 O6 Sn Te -","- Na1.84 O6 Sn Te -","- Na3.68 O12 Sn2 Te2 -","2","0.166667","","Woodward, P.M.; Sleight, A.W.; Du, L.-S.; Grey, C.P.","Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6","Journal of Solid State Chemistry","1999","147","","99","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522215","5.0958","","5.0958","","10.6325","","90","","90","","120","","239.106","","","","","","","","","","","","","4","P -3 1 c","-P 3 2c","163","","Na2 (Ge Te O6)","","- Ge Na2 O6 Te -","- Ge Na2 O6 Te -","- Ge2 Na4 O12 Te2 -","2","0.166667","","Woodward, P.M.; Grey, C.P.; Sleight, A.W.; Du, L.-S.","Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6","Journal of Solid State Chemistry","1999","147","","99","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522217","5.06566","","5.06566","","5.40394","","90","","90","","120","","120.092","","","","","","","","","","","","","4","P 3 1 2","P 3 2","149","","Sr (Ge Te O6)","","- Ge O6 Sr Te -","- Ge O6 Sr Te -","- Ge O6 Sr Te -","1","0.166667","","Woodward, P.M.; Sleight, A.W.; Grey, C.P.; Du, L.-S.","Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6","Journal of Solid State Chemistry","1999","147","","99","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522219","5.09496","","5.09496","","11.57963","","90","","90","","120","","260.32","","","","","","","","","","","","","4","P 3 1 2","P 3 2","149","","Ba (Ge Te O6)","","- Ba Ge O6 Te -","- Ba Ge O6 Te -","- Ba2 Ge2 O12 Te2 -","2","0.333333","","Woodward, P.M.; Sleight, A.W.; Du, L.-S.; Grey, C.P.","Structural studies and order-disorder phenomenon in a series of new quaternary tellurates of the type A(2+) M(4+) Te(6+) O6 and A(1+)2 M(4+) Te(6+) O6","Journal of Solid State Chemistry","1999","147","","99","116","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522228","3.8873","","3.8284","","11.6748","","90","","90","","90","","173.746","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.8 Nd0.2) Cu3 O7","","- Ba1.8 Cu3 Nd0.2 O7 Y -","- Ba1.8 Cu3 Nd0.2 O7 Y -","- Ba1.8 Cu3 Nd0.2 O7 Y -","1","0.125","","Wu, X.S.; Gao, J.","Structure and transport properties in calcium-doped Y Ba1.8 Nd0.2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","313","","49","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522229","3.8842","","3.8273","","11.6716","","90","","90","","90","","173.51","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.95 Ca0.05) (Ba1.8 Nd0.2) Cu3 O7","","- Ba1.8 Ca0.05 Cu3 Nd0.2 O7 Y0.95 -","- Ba1.8 Ca0.05 Cu3 Nd0.2 O7 Y0.95 -","- Ba1.8 Ca0.05 Cu3 Nd0.2 O7 Y0.95 -","1","0.125","","Wu, X.S.; Gao, J.","Structure and transport properties in calcium-doped Y Ba1.8 Nd0.2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","313","","49","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","142450","2020-10-21","18:00:00",""
"1522230","3.878","","3.8314","","11.6714","","90","","90","","90","","173.416","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.9 Ca0.1) (Ba1.8 Nd0.2) Cu3 O7","","- Ba1.8 Ca0.1 Cu3 Nd0.2 O7 Y0.9 -","- Ba1.8 Ca0.1 Cu3 Nd0.2 O7 Y0.9 -","- Ba1.8 Ca0.1 Cu3 Nd0.2 O7 Y0.9 -","1","0.125","","Wu, X.S.; Gao, J.","Structure and transport properties in calcium-doped Y Ba1.8 Nd0.2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","313","","49","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","142451","2020-10-21","18:00:00",""
"1522231","3.878","","3.8322","","11.6715","","90","","90","","90","","173.453","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.85 Ca0.15) (Ba1.8 Nd0.2) Cu3 O7","","- Ba1.8 Ca0.15 Cu3 Nd0.2 O7 Y0.85 -","- Ba1.8 Ca0.15 Cu3 Nd0.2 O7 Y0.85 -","- Ba1.8 Ca0.15 Cu3 Nd0.2 O7 Y0.85 -","1","0.125","","Wu, X.S.; Gao, J.","Structure and transport properties in calcium-doped Y Ba1.8 Nd0.2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","313","","49","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","142452","2020-10-21","18:00:00",""
"1522232","3.8817","","3.8347","","11.6668","","90","","90","","90","","173.662","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.8 Ca0.2) (Ba1.8 Nd0.2) Cu3 O7","","- Ba1.8 Ca0.2 Cu3 Nd0.2 O7 Y0.8 -","- Ba1.8 Ca0.2 Cu3 Nd0.2 O7 Y0.8 -","- Ba1.8 Ca0.2 Cu3 Nd0.2 O7 Y0.8 -","1","0.125","","Wu, X.S.; Gao, J.","Structure and transport properties in calcium-doped Y Ba1.8 Nd0.2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","313","","49","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","142453","2020-10-21","18:00:00",""
"1522233","3.8775","","3.8335","","11.6791","","90","","90","","90","","173.603","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.75 Ca0.25) (Ba1.8 Nd0.2) Cu3 O7","","- Ba1.8 Ca0.25 Cu3 Nd0.2 O7 Y0.75 -","- Ba1.8 Ca0.25 Cu3 Nd0.2 O7 Y0.75 -","- Ba1.8 Ca0.25 Cu3 Nd0.2 O7 Y0.75 -","1","0.125","","Wu, X.S.; Gao, J.","Structure and transport properties in calcium-doped Y Ba1.8 Nd0.2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","313","","49","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","142454","2020-10-21","18:00:00",""
"1522234","3.8783","","3.8349","","11.6798","","90","","90","","90","","173.712","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.6 Ca0.4) (Ba1.8 Nd0.2) Cu3 O7","","- Ba1.8 Ca0.4 Cu3 Nd0.2 O7 Y0.6 -","- Ba1.8 Ca0.4 Cu3 Nd0.2 O7 Y0.6 -","- Ba1.8 Ca0.4 Cu3 Nd0.2 O7 Y0.6 -","1","0.125","","Wu, X.S.; Gao, J.","Structure and transport properties in calcium-doped Y Ba1.8 Nd0.2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","313","","49","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","142455","2020-10-21","18:00:00",""
"1522235","3.8698","","3.8617","","11.748","","90","","90","","90","","175.562","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.5 Ca0.5) (Ba1.8 Nd0.2) Cu3 O7","","- Ba1.8 Ca0.5 Cu3 Nd0.2 O7 Y0.5 -","- Ba1.8 Ca0.5 Cu3 Nd0.2 O7 Y0.5 -","- Ba1.8 Ca0.5 Cu3 Nd0.2 O7 Y0.5 -","1","0.125","","Wu, X.S.; Gao, J.","Structure and transport properties in calcium-doped Y Ba1.8 Nd0.2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","313","","49","57","","","","","","","","","","","","","","","","","","","","","","has coordinates","142456","2020-10-21","18:00:00",""
"1522236","3.8801","","3.8264","","11.6874","","90","","90","","90","","173.521","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","(Y0.8 Ca0.2) Ba2 Cu3 O7","","- Ba2 Ca0.2 Cu3 O7 Y0.8 -","- Ba2 Ca0.2 Cu3 O7 Y0.8 -","- Ba2 Ca0.2 Cu3 O7 Y0.8 -","1","0.125","","Wu, X.S.; Gao, J.","Superconductivity and structural changes in Y0.8 Ca0.2 Ba2-x Ndx Cu3 Oy cuprates with x < 0.50","Physica C (Amsterdam)","1999","313","","79","86","","","","","","","","","","","","","","","","","","","","","","has coordinates","142457","2020-10-21","18:00:00",""
"1522237","3.8818","","3.8259","","11.6804","","90","","90","","90","","173.47","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.8 Ca0.2) (Ba1.9 Nd0.1) Cu3 O7","","- Ba1.9 Ca0.2 Cu3 Nd0.1 O7 Y0.8 -","- Ba1.9 Ca0.2 Cu3 Nd0.1 O7 Y0.8 -","- Ba1.9 Ca0.2 Cu3 Nd0.1 O7 Y0.8 -","1","0.125","","Wu, X.S.; Gao, J.","Superconductivity and structural changes in Y0.8 Ca0.2 Ba2-x Ndx Cu3 Oy cuprates with x < 0.50","Physica C (Amsterdam)","1999","313","","79","86","","","","","","","","","","","","","","","","","","","","","","has coordinates","142458","2020-10-21","18:00:00",""
"1522238","3.8803","","3.826","","11.6611","","90","","90","","90","","173.121","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.8 Ca0.14 Nd0.06) (Ba1.75 Nd0.19 Ca0.06) Cu3 O7","","- Ba1.75 Ca0.2 Cu3 Nd0.25 O7 Y0.8 -","- Ba1.75 Ca0.2 Cu3 Nd0.25 O7 Y0.8 -","- Ba1.75 Ca0.2 Cu3 Nd0.25 O7 Y0.8 -","1","0.125","","Wu, X.S.; Gao, J.","Superconductivity and structural changes in Y0.8 Ca0.2 Ba2-x Ndx Cu3 Oy cuprates with x < 0.50","Physica C (Amsterdam)","1999","313","","79","86","","","","","","","","","","","","","","","","","","","","","","has coordinates","142459","2020-10-21","18:00:00",""
"1522239","3.8668","","3.8386","","11.6381","","90","","90","","90","","172.745","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.8 Ca0.1 Nd0.1) (Ba1.6 Nd0.3 Ca0.1) Cu3 O7","","- Ba1.6 Ca0.2 Cu3 Nd0.4 O7 Y0.8 -","- Ba1.6 Ca0.2 Cu3 Nd0.4 O7 Y0.8 -","- Ba1.6 Ca0.2 Cu3 Nd0.4 O7 Y0.8 -","1","0.125","","Wu, X.S.; Gao, J.","Superconductivity and structural changes in Y0.8 Ca0.2 Ba2-x Ndx Cu3 Oy cuprates with x < 0.50","Physica C (Amsterdam)","1999","313","","79","86","","","","","","","","","","","","","","","","","","","","","","has coordinates","142460","2020-10-21","18:00:00",""
"1522240","3.8573","","3.8495","","11.6156","","90","","90","","90","","172.476","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.8 Ca0.2) (Ba1.5 Nd0.5) Cu3 O7","","- Ba1.5 Ca0.2 Cu3 Nd0.5 O7 Y0.8 -","- Ba1.5 Ca0.2 Cu3 Nd0.5 O7 Y0.8 -","- Ba1.5 Ca0.2 Cu3 Nd0.5 O7 Y0.8 -","1","0.125","","Wu, X.S.; Gao, J.","Superconductivity and structural changes in Y0.8 Ca0.2 Ba2-x Ndx Cu3 Oy cuprates with x < 0.50","Physica C (Amsterdam)","1999","313","","79","86","","","","","","","","","","","","","","","","","","","","","","has coordinates","142461","2020-10-21","18:00:00",""
"1522241","3.86436","","3.86436","","28.9881","","90","","90","","90","","432.887","","","","","","","","","","","","","7","I 4/m m m","-I 4 2","139","","(Hg0.7 Tl0.3)2 Ba2 (Ca0.2 Y0.8) Cu2 O8","","- Ba2 Ca0.2 Cu2 Hg1.4 O8 Tl0.6 Y0.8 -","- Ba2 Ca0.2 Cu2 Hg1.4 O8 Tl0.6 Y0.8 -","- Ba4 Ca0.4 Cu4 Hg2.8 O16 Tl1.2 Y1.6 -","2","0.0625","","Wu, X.-J.; Adachi, S.; Tatsuki, T.; Tokiwa-Yamamoto, A.; Tanabe, K.","Study of structural variation caused by Ar annealing for (Hg0.7 Tl0.3)2 Ba2 (Ca0.2 Y0.8) Cu2 Oy","Physica C (Amsterdam)","1999","314","","219","227","","","","","","","","","","","","","","","","","","","","","","has coordinates","142462","2020-10-21","18:00:00",""
"1522242","3.884","","3.8193","","11.681","","90","","90","","90","","173.278","","","","","","","","","","","","","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.; Gao, J.","The influence of La substitution for Ba in Y Ba2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","315","","215","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522243","3.8837","","3.8189","","11.6612","","90","","90","","90","","172.953","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.85 La0.15) Cu3 O7","","- Ba1.85 Cu3 La0.15 O7 Y -","- Ba1.85 Cu3 La0.15 O7 Y -","- Ba1.85 Cu3 La0.15 O7 Y -","1","0.125","","Wu, X.S.; Gao, J.","The influence of La substitution for Ba in Y Ba2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","315","","215","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522244","3.8851","","3.8221","","11.6426","","90","","90","","90","","172.884","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.8 La0.2) Cu3 O7","","- Ba1.8 Cu3 La0.2 O7 Y -","- Ba1.8 Cu3 La0.2 O7 Y -","- Ba1.8 Cu3 La0.2 O7 Y -","1","0.125","","Wu, X.S.; Gao, J.","The influence of La substitution for Ba in Y Ba2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","315","","215","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522245","3.8807","","3.8245","","11.6324","","90","","90","","90","","172.645","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.75 La0.25) Cu3 O7","","- Ba1.75 Cu3 La0.25 O7 Y -","- Ba1.75 Cu3 La0.25 O7 Y -","- Ba1.75 Cu3 La0.25 O7 Y -","1","0.125","","Wu, X.S.; Gao, J.","The influence of La substitution for Ba in Y Ba2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","315","","215","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522246","3.8746","","3.8326","","11.6167","","90","","90","","90","","172.506","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.7 La0.3) Cu3 O7","","- Ba1.7 Cu3 La0.3 O7 Y -","- Ba1.7 Cu3 La0.3 O7 Y -","- Ba1.7 Cu3 La0.3 O7 Y -","1","0.125","","Wu, X.S.; Gao, J.","The influence of La substitution for Ba in Y Ba2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","315","","215","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522247","3.8589","","3.85","","11.5958","","90","","90","","90","","172.276","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","Y (Ba1.6 La0.4) Cu3 O7","","- Ba1.6 Cu3 La0.4 O7 Y -","- Ba1.6 Cu3 La0.4 O7 Y -","- Ba1.6 Cu3 La0.4 O7 Y -","1","0.125","","Wu, X.S.; Gao, J.","The influence of La substitution for Ba in Y Ba2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","315","","215","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522248","3.8554","","3.8554","","11.568","","90","","90","","90","","171.948","","","","","","","","","","","","","5","P 4/m m m","-P 4 2","123","","Y (Ba1.5 La0.5) Cu3 O7","","- Ba1.5 Cu3 La0.5 O7 Y -","- Ba1.5 Cu3 La0.5 O7 Y -","- Ba1.5 Cu3 La0.5 O7 Y -","1","0.0625","","Wu, X.S.; Gao, J.","The influence of La substitution for Ba in Y Ba2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","315","","215","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522249","3.879","","3.8295","","11.6819","","90","","90","","90","","173.53","","","","","","","","","","","","","5","P m m m","-P 2 2","47","","(Y0.8 Ca0.2) Ba2 Cu3 O7","","- Ba2 Ca0.2 Cu3 O7 Y0.8 -","- Ba2 Ca0.2 Cu3 O7 Y0.8 -","- Ba2 Ca0.2 Cu3 O7 Y0.8 -","1","0.125","","Wu, X.S.; Wang, F.Z.; Liu, J.S.; Jiang, S.S.; Gao, J.","Effects on structure and superconductivity for La and Ca codoping in Y Ba2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","320","","206","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","142470","2020-10-21","18:00:00",""
"1522250","3.8769","","3.8268","","11.6782","","90","","90","","90","","173.259","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.8 Ca0.2) (Ba1.9 La0.1) Cu3 O7","","- Ba1.9 Ca0.2 Cu3 La0.1 O7 Y0.8 -","- Ba1.9 Ca0.2 Cu3 La0.1 O7 Y0.8 -","- Ba1.9 Ca0.2 Cu3 La0.1 O7 Y0.8 -","1","0.125","","Wu, X.S.; Wang, F.Z.; Gao, J.; Liu, J.S.; Jiang, S.S.","Effects on structure and superconductivity for La and Ca codoping in Y Ba2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","320","","206","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","142471","2020-10-21","18:00:00",""
"1522251","3.8649","","3.8285","","11.6355","","90","","90","","90","","172.168","","","","","","","","","","","","","6","P m m m","-P 2 2","47","","(Y0.8 Ca0.2) (Ba1.7 La0.3) Cu3 O7","","- Ba1.7 Ca0.2 Cu3 La0.3 O7 Y0.8 -","- Ba1.7 Ca0.2 Cu3 La0.3 O7 Y0.8 -","- Ba1.7 Ca0.2 Cu3 La0.3 O7 Y0.8 -","1","0.125","","Wu, X.S.; Gao, J.; Liu, J.S.; Wang, F.Z.; Jiang, S.S.","Effects on structure and superconductivity for La and Ca codoping in Y Ba2 Cu3 Oy cuprates","Physica C (Amsterdam)","1999","320","","206","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","142472","2020-10-21","18:00:00",""
"1522252","11.08","","11.08","","4.098","","90","","90","","90","","503.097","","","","","","","","","","","","","3","P -4 21 m","P -4 2ab","113","","Sr2 Rh7 P6","","- P6 Rh7 Sr2 -","- P6 Rh7 Sr2 -","- P12 Rh14 Sr4 -","2","0.25","","Wurth, A.; Mewis, A.","Synthese und Kristallstruktur von Sr2 Rh7 P6","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1486","1488","","","","","","","","","","","","","","","","","","","","","","has coordinates","142473","2020-10-21","18:00:00",""
"1522253","7.029","","7.029","","3.519","","90","","90","","120","","150.569","","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","Mg Rh6 P4","","- Mg P4 Rh6 -","- Mg P4 Rh6 -","- Mg P4 Rh6 -","1","0.0833333","","Wurth, A.; Mewis, A.","Neue Rhodiumverbindungen mit Li Co6 P4 - Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","449","452","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522254","7.271","","7.271","","3.612","","90","","90","","120","","165.374","","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","Mg Rh6 As4","","- As4 Mg Rh6 -","- As4 Mg Rh6 -","- As4 Mg Rh6 -","1","0.0833333","","Wurth, A.; Mewis, A.","Neue Rhodiumverbindungen mit Li Co6 P4 - Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","449","452","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522255","7.201","","7.201","","3.755","","90","","90","","120","","168.627","","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","Ca Rh6 As4","","- As4 Ca Rh6 -","- As4 Ca Rh6 -","- As4 Ca Rh6 -","1","0.0833333","","Wurth, A.; Mewis, A.","Neue Rhodiumverbindungen mit Li Co6 P4 - Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","449","452","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522256","7.214","","7.214","","3.823","","90","","90","","120","","172.301","","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","Sr Rh6 As4","","- As4 Rh6 Sr -","- As4 Rh6 Sr -","- As4 Rh6 Sr -","1","0.0833333","","Wurth, A.; Mewis, A.","Neue Rhodiumverbindungen mit Li Co6 P4 - Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","449","452","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522257","7.206","","7.206","","3.754","","90","","90","","120","","168.816","","","","","","","","","","","","","3","P -6 m 2","P -6 2","187","","Yb Rh6 As4","","- As4 Rh6 Yb -","- As4 Rh6 Yb -","- As4 Rh6 Yb -","1","0.0833333","","Wurth, A.; Mewis, A.","Neue Rhodiumverbindungen mit Li Co6 P4 - Struktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","449","452","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522261","5.858","","5.858","","23.044","","90","","90","","120","","684.837","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","Pb (Fe10.6 Ga1.4) O19","","- Fe10.6 Ga1.4 O19 Pb -","- Fe10.602 Ga1.398 O19 Pb0.999 -","- Fe21.204 Ga2.796 O38 Pb1.998 -","2","0.0833333","","Yakubovich, O.V.; Popov, Yu.F.; Vorob'ev, G.P.; Kadomtseva, A.M.; Tegranchi, M.M.; Timofeeva, V.A.","Gallium-substituted magnetoplumbite Pb (Fe10.6 Ga1.4) O19: crystal structure and magnetic properties","Kristallografiya","1999","44","","601","606","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522262","13.863","","14.135","","10.047","","90","","90","","90","","1968.74","","","","","","","","","","","","","6","I m m m","-I 2 2","71","","Na4.72 K7.28 (Al12 Si20 O64) (H2 O)24.24","","- Al12 H48.48 K7.28 Na4.72 O88.24 Si20 -","- Al12 K7.28 Na4.72 O88.24 Si20 -","- Al12 K7.28 Na4.72 O88.24 Si20 -","1","0.0625","","Yakubovich, O.V.; Massa, W.; Pekov, I.V.; Kucherinenko, Ya.V.","Crystal structure of Na, K- variety of merlinoite","Kristallografiya","1999","44","","835","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522265","5.2961","","5.2961","","3.8534","","90","","90","","90","","108.083","","","","","","","","","","","","","3","P 4/n m m :1","P 4ab 2ab -1ab","129","","(Nb0.118 W0.882) O2.941","","- Nb0.118 O2.941 W0.882 -","- Nb0.118 O2.9409 W0.882 -","- Nb0.236 O5.8818 W1.764 -","2","0.125","","Yamada, H.; Hibino, M.; Kudo, T.","Li-intercalated (Re O3)-type solid solutions in the Nb2 O5 W O3 system","Materials Research Bulletin","1999","34","","955","962","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1522266","5.342","","5.342","","3.542","","90","","90","","90","","101.078","","","","","","","","","","","","","3","P 4/m b m","-P 4 2ab","127","","Dy B2 C2","","- C2 B2 Dy -","- C2 B2 Dy -","- C4 B4 Dy2 -","2","0.125","","Yamauchi, H.; Onodera, H.; Ohashi, M.; Onimaru, T.; Kosaka, M.; Ohoyama, K.; Yamaguchi, Y.","Magnetic structure modified by the quadrupolar interaction in Dy B2 C2","Journal of Physics and Chemistry of Solids","1999","60","","1217","1220","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522267","3.82914","","3.82385","","19.55849","","90","","90","","90","","286.377","","","","","","","","","","","","","5","I m m m","-I 2 2","71","","Sr2 (Y0.8 Ca0.2) Co2 O6","","- Ca0.2 Co2 O6 Sr2 Y0.8 -","- Ca0.2 Co2 O6 Sr2 Y0.8 -","- Ca0.4 Co4 O12 Sr4 Y1.6 -","2","0.125","","Yamaura, K.; Huang, Q.; Erwin, R.W.; Lynn, J.W.; Cava, R.J.","Anomalous crystal-structure distortion at the antiferromagnetic transition in the layered cobalt oxide Sr2 Y0.8 Ca0.2 Co2 O6","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1999","60","","9623","9629","","","","","","","","","","","","","","","","","","","","","","has coordinates","142488","2020-10-21","18:00:00",""
"1522269","11.786","","4.5133","","14.71","","90","","90","","90","","782.48","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Ba (La Cu Te3)","","- Ba Cu La Te3 -","- Ba Cu La Te3 -","- Ba4 Cu4 La4 Te12 -","4","0.5","","Yang, Y.-T.; Ibers, J.A.","Synthesis and characterisation of a series of quaternary chalcogenides Ba Ln M Q3 (Ln = rare earth, M = coinage metal, Q = Se or Te)","Journal of Solid State Chemistry","1999","147","","366","371","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522271","4.401","","14.706","","11.287","","90","","90","","90","","730.507","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Ba (Y Cu Te3)","","- Ba Cu Te3 Y -","- Ba Cu Te3 Y -","- Ba4 Cu4 Te12 Y4 -","4","0.25","","Yang, Y.-T.; Ibers, J.A.","Synthesis and characterisation of a series of quaternary chalcogenides Ba Ln M Q3 (Ln = rare earth, M = coinage metal, Q = Se or Te)","Journal of Solid State Chemistry","1999","147","","366","371","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522273","9.613","","11.569","","13.344","","90.41","","95.48","","106.48","","1415.64","","","","","","","","","","","","","6","P -1","-P 1","2","","Cs3 ((Se7 Br) (Re Br)6) (H2 O)","","- Br7 Cs3 H2 O Re6 Se7 -","- Br7 Cs3 H2 O Re6 Se7 -","- Br14 Cs6 H4 O2 Re12 Se14 -","2","1","","Yarovoi, S.S.; Mironov, Yu.V.; Fedorov, V.E.; Virovets, A.V.; Solodovnikov, S.F.","Synthesis and crystal structure of a new octahedral rhenium cluster compound Cs3 Re6 Se7 Br7 . (H2 O)","Materials Research Bulletin","1999","34","","1345","1351","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522287","25.119","","25.119","","25.119","","90","","90","","90","","15849.2","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Pb49 Tl18 O17 (Si100 Al92 O384)","","- Al92 O401 Pb49 Si100 Tl18 -","- Al91.9968 O400.998 Pb48.9984 Si100.003 Tl17.9936 -","- Al91.9968 O400.998 Pb48.9984 Si100.003 Tl17.9936 -","1","0.0104167","","Yeom, Y.H.; Kim, Y.; Seff, K.","Crystal structure of Pb(2+)44 Pb(4+)5 Tl(+)18 O(2-)17 Si100 Al92 O384 zeolite X exchanged with Pb(2+) and Tl(+) and dehydrated, containing Pb4 O4 (Pb(2+), Pb(4+) mixed)4 clusters","Microporous and Mesoporous Materials","1999","28","","103","112","","","","","","","","","","","","","","","","","","","","","","has coordinates","142508","2020-10-21","18:00:00",""
"1522289","20.072","","19.937","","13.414","","90","","90","","90","","5367.95","","","","","","","","","","","","","6","P n 21 a","P -2ac -2n","33","","((C3 H7)4 N)4 (Al4 Si92 O192)","","- C48 H112 Al4 N4 O192 Si92 -","- C48 Al4 N4 O192 Si92 -","- C48 Al4 N4 O192 Si92 -","1","0.25","","Yokomori, Y.; Idaka, S.","The structure of TPA-ZSM-5 with Si/Al=23","Microporous and Mesoporous Materials","1999","28","","405","413","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1522301","5.5243","","5.5246","","32.99959","","90","","90","","90","","1007.13","","","","","","","","","","","","","5","F m m m","-F 2 2","69","","Bi2 Sr2 Nb2 Mn O11.57","","- Bi2 Mn Nb2 O11.57 Sr2 -","- Bi2 Mn Nb2 O11.5684 Sr2 -","- Bi8 Mn4 Nb8 O46.2736 Sr8 -","4","0.125","","Yu, W.J.; Kim, Y.I.; Seong, S.; Ha, D.H.; Lee, J.-H.; Park, Y.K.; Hur, N.H.","A new manganese oxide with Aurivillius structure: Bi2 Sr2 Nb2 Mn O12-d","Solid State Communications","1999","111","","705","709","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522303","10.17","","7.418","","3.79","","90","","90","","90","","285.922","","","","","","","","","","","","","3","P 2 2 2","P 2 2","16","","Pr0.2 W O3","","- O3 Pr0.2 W -","- O3 Pr0.2 W -","- O15 Pr W5 -","5","1.25","","Zakharov, N.D.; Werner, P.; Zibrov, I.P.; Filonenko, V.P.; Sundberg, M.R.","Intergrowth tungsten bronze structures of Prx W O3, formed at 50 kbar: an HRTEM study","Journal of Solid State Chemistry","1999","147","","536","544","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522305","5.295","","7.873","","8.911","","90","","101.35","","90","","364.213","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Na (H Se O4)","","- H Na O4 Se -","- H Na O4 Se -","- H4 Na4 O16 Se4 -","4","1","","Zakharov, M.A.; Troyanov, S.I.; Rybakov, V.B.; Aslanov, L.A.; Kemnitz, E.","Synthesis and crystal structure of sodium hydrogen selenates, Na H Se O4 and Na3 (H (H Se O4)2) (H Se O4)2","Kristallografiya","1999","44","","448","453","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:08",""
"1522307","5.857","","7.254","","8.943","","104.83","","91.69","","105.41","","352.154","","","","","","","","","","","","","4","P -1","-P 1","2","","Na3 (H (H Se O4)2) (H Se O4)2","","- H5 Na3 O16 Se4 -","- H5 Na3 O16 Se4 -","- H5 Na3 O16 Se4 -","1","0.5","","Zakharov, M.A.; Troyanov, S.I.; Rybakov, V.B.; Aslanov, L.A.; Kemnitz, E.","Synthesis and crystal structure of sodium hydrogen selenates, Na H Se O4 and Na3 (H (H Se O4)2) (H Se O4)2","Kristallografiya","1999","44","","448","453","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:08",""
"1522309","10.97","","5.54","","3.94","","90","","90","","90","","239.449","","","","","","","","","","","","","3","C m m m","-C 2 2","65","","","","- Ba Cu3 O4 -","- Ba Cu3 O4 -","- Ba2 Cu6 O8 -","2","0.125","","Zandbergen, H.W.; Jansen, J.; Svetchnikov, V.L.; Graboy, I.E.; Samoylenkov, S.; Gorbenko, O.; Kaul, A.R.","The structure of Ba Cu3 O4 particles occurring on thin Ho Ba2 Cu3 O7 films prepared by MOCVD","Physica C (Amsterdam)","1999","328","","211","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522319","7.899","","7.899","","8.212","","90","","90","","90","","512.381","","","","","","","","","","","","","5","P 42/m n m","-P 4n 2n","136","","(N H4)2 (Cu (H2 O)2 Br2) Br2","","- Br4 Cu H12 N2 O2 -","- Br4 Cu H12 N2 O2 -","- Br8 Cu2 H24 N4 O4 -","2","0.125","","Zavodnik, V.E.; Bel'skii, V.K.; Diaz, I.; Fernandez, V.","Crystal structure of ammonium tetrabromocuprate dihydrate at different temperatures","Kristallografiya","1999","44","","623","626","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522322","12.098","","12.098","","14.379","","90","","90","","90","","2104.53","","","","","","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","La4 S3 (Si2 O7)","","- La4 O7 S3 Si2 -","- La4 O7 S3 Si2 -","- La32 O56 S24 Si16 -","8","0.25","","Zeng, H.-Y.; Mao, J.-G.; Huang, J.-S.","Synthesis and crystal structure of La4 S3 Si2 O7","Journal of Alloys Compd.","1999","291","","89","93","","","","","","","","","","","","","","","","","","","","","","has coordinates","142544","2020-10-21","18:00:00",""
"1522326","15.3812","","9.04167","","17.8808","","90","","125.361","","90","","2027.97","","","","","","","","","","","","","2","P 1 21/a 1","-P 2yab","14","","Al2 (Mo3 O12)","","- Al2 Mo3 -","- Al2 Mo3 -","- Al16 Mo24 -","8","2","","Zhao, X.-H.","The synthesis and structure of Al2 Mo3-x Wx O12","Gaodeng Xuexiao Huaxue Xuebao","1999","20","","339","343","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:08",""
"1522328","24.895","","24.895","","24.895","","90","","90","","90","","15429","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Cd46 (Si100 Al92 O384) Zn20","","- Al92 Cd46 O384 Si100 Zn20 -","- Al91.9968 Cd45.9968 O384 Si100.003 Zn20 -","- Al91.9968 Cd45.9968 O384 Si100.003 Zn20 -","1","0.0104167","","Zhen, S.-Y.; Seff, K.","Crystal structure of a zinc sorption complex of Cd(2+)-exchanged zeolite X containing tetrahedral Cd(2+)4 (mue3-Zn(0) Cd(2+) Zn(0))4 clusters","J. Phys. Chem. B","1999","103","","6493","6497","","","","","","","","","","","","","","","","","","","","","","has coordinates","142550","2020-10-21","18:00:00",""
"1522332","8.16528","","8.16528","","8.16528","","90","","90","","90","","544.394","","","","","","","","","","","","","4","P m -3","-P 2 2 3","200","","Gd Ba4 Cu3 O9.18","","- Ba4 Cu3 Gd O9.18 -","- Ba4 Cu3 Gd O9.18 -","- Ba8 Cu6 Gd2 O18.36 -","2","0.0833333","","Zhu, Y.T.; Mueller, F.M.; Peterson, E.J.; Baldonado, P.S.; Coulter, J.Y.; Peterson, D.E.","Synthesis and crystal chemistry of the new compounds Gd Ba4 Cu3 O8.5+d and Dy Ba4 Cu3 O8.5+d","Journal of Materials Research","1999","14","","334","339","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522334","8.10807","","8.10807","","8.10807","","90","","90","","90","","533.031","","","","","","","","","","","","","4","P 2 3","P 2 2 3","195","","Dy Ba4 Cu3 O9.09","","- Ba4 Cu3 Dy O9.09 -","- Ba4 Cu3 Dy O9.09 -","- Ba8 Cu6 Dy2 O18.18 -","2","0.166667","","Zhu, Y.T.; Coulter, J.Y.; Peterson, E.J.; Baldonado, P.S.; Mueller, F.M.; Peterson, D.E.","Synthesis and crystal chemistry of the new compounds Gd Ba4 Cu3 O8.5+d and Dy Ba4 Cu3 O8.5+d","Journal of Materials Research","1999","14","","334","339","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1522336","25.05229","","25.05229","","25.05229","","90","","90","","90","","15723.2","","","","","","","","","","","","","5","F d -3 :2","-F 2uv 2vw 3","203","","Na54 (D3 O)42 (Si96 Al96 O384) (D2 O)80","","- Al96 D53.3952 Na36.704 O453.093 Si96 -","- Al96 D53.3952 Na36.704 O453.093 Si96 -","- Al96 D53.3952 Na36.704 O453.093 Si96 -","1","0.0104167","","Zhu, L.; Seff, K.; von Dreele, R.B.; Olson, D.H.; Cohen, B.J.","Hydronium ions in zeolites. 1. Structures of partially and fully dehydrated Na, (H3 O)-X by X-ray and neutron diffraction","J. Phys. Chem. B","1999","103","","10365","10372","","","","","","","","","","","","","","","","","","","","","","has coordinates","142558","2020-10-21","18:00:00",""
"1522348","7.3556","","7.3556","","10.685","","90","","90","","90","","578.11","","","","","","","","","","","","","4","P -4 21 m","P -4 2ab","113","","(Nd0.023 Gd0.977)2 (Mo O4)3","","- Gd1.954 Mo3 Nd0.046 O12 -","- Gd1.954 Mo3 Nd0.046 O12 -","- Gd3.908 Mo6 Nd0.092 O24 -","2","0.25","","Zou, Y.-Q.; Chen, L.; Gao, X.-Y.; Tang, D.-Y.; Luo, Z.-D.","Crystal structure of P4-21m phase Nd(3+): Gd2 (Mo O4)3","Jiegon Huaxue","1999","18","","447","450","","","","","","","","","","","","","","","","","","","","","","has coordinates","142570","2020-10-21","18:00:00",""
"1527032","8.355","","8.355","","8.355","","90","","90","","90","","583.229","","","","","","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","","(Fe0.92 Mg0.08) (Fe1.08 Ni0.2 Mg0.72) O4","","- Fe2 Mg0.8 Ni0.2 O4 -","- Fe2 Mg0.8 Ni0.2 O4 -","- Fe16 Mg6.4 Ni1.6 O32 -","8","0.0416667","","Yunus, S.M.; Asgar, M.A.; Ahmed, F.U.","Studies of the cationic distributions and magnetization of Zn - Mg - Ni ferrite system from X-ray and bulk magnetization measurements","Nuclear Science and Applications","1999","8","","57","63","","","","","","","","","","","","","","","","","","","","","","has coordinates","148320","2020-10-21","18:00:00",""
"1527033","8.37","","8.37","","8.37","","90","","90","","90","","586.376","","","","","","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","(Fe0.8 Zn0.2) (Fe1.2 Ni0.2 Mg0.6) O4","","- Fe2 Mg0.6 Ni0.2 O4 Zn0.2 -","- Fe2 Mg0.6 Ni0.2 O4 Zn0.2 -","- Fe16 Mg4.8 Ni1.6 O32 Zn1.6 -","8","0.0416667","","Yunus, S.M.; Asgar, M.A.; Ahmed, F.U.","Studies of the cationic distributions and magnetization of Zn - Mg - Ni ferrite system from X-ray and bulk magnetization measurements","Nuclear Science and Applications","1999","8","","57","63","","","","","","","","","","","","","","","","","","","","","","has coordinates","148321","2020-10-21","18:00:00",""
"1527034","8.392","","8.392","","8.392","","90","","90","","90","","591.012","","","","","","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","(Fe0.6 Zn0.4) (Fe1.4 Ni0.2 Mg0.4) O4","","- Fe2 Mg0.4 Ni0.2 O4 Zn0.4 -","- Fe2 Mg0.4 Ni0.2 O4 Zn0.4 -","- Fe16 Mg3.2 Ni1.6 O32 Zn3.2 -","8","0.0416667","","Yunus, S.M.; Asgar, M.A.; Ahmed, F.U.","Studies of the cationic distributions and magnetization of Zn - Mg - Ni ferrite system from X-ray and bulk magnetization measurements","Nuclear Science and Applications","1999","8","","57","63","","","","","","","","","","","","","","","","","","","","","","has coordinates","148322","2020-10-21","18:00:00",""
"1527035","8.415","","8.415","","8.415","","90","","90","","90","","595.885","","","","","","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","(Fe0.4 Zn0.6) (Fe1.6 Ni0.2 Mg0.2) O4","","- Fe2 Mg0.2 Ni0.2 O4 Zn0.6 -","- Fe2 Mg0.2 Ni0.2 O4 Zn0.6 -","- Fe16 Mg1.6 Ni1.6 O32 Zn4.8 -","8","0.0416667","","Yunus, S.M.; Ahmed, F.U.; Asgar, M.A.","Studies of the cationic distributions and magnetization of Zn - Mg - Ni ferrite system from X-ray and bulk magnetization measurements","Nuclear Science and Applications","1999","8","","57","63","","","","","","","","","","","","","","","","","","","","","","has coordinates","148323","2020-10-21","18:00:00",""
"1528419","11.736","","11.736","","11.736","","90","","90","","90","","1616.44","","","","","","","","","","","","","4","I m -3","-I 2 2 3","204","","Mn (H C O O)3 (C O2)0.75","","- C3.75 H3 Mn O7.5 -","- C3.7525 H3 Mn O7.52 -","- C30.02 H24 Mn8 O60.16 -","8","0.166667","","Cornia, A.; Caneschi, A.; Fabretti, A.C.; Dapporto, P.; Sessoli, R.; Malavasi, W.; Gatteschi, D.; Sangregorio, C.","Mangan(III)-formiat: ein dreidimenionales Netzwerk, das Kohlendioxidmolekuele einschliesst","Angewandte Chemie (German Edition)","1999","111","","1897","1899","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530273","8.181","","8.2067","","3.755","","90","","90","","90","","252.107","","","","","","","","","","","","","4","C m m m","-C 2 2","65","","(Mg (N H3)2) Cl2","","- Cl2 H6 Mg N2 -","- Cl2 H6 Mg N2 -","- Cl4 H12 Mg2 N4 -","2","0.125","","Leineweber, A.; Friedriszik, M.W.; Jacobs, H.","Preparation and crystal structure of Mg (N H3)2 Cl2, Mg (N H3)2 Br2, and Mg (N H3)2 I2","Journal of Solid State Chemistry","1999","147","","229","234","","","","","","","","","","","","","","","","","","","","","","has coordinates","301778","2025-08-18","15:17:09",""
"1531271","13.056","","7.2941","","15.162","","90","","103.575","","90","","1403.57","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(N H4)2 (Ge7 O15)","","- Ge7 H8 N2 O15 -","- Ge7 N2 O15 -","- Ge28 N8 O60 -","4","0.5","","Cascales, C.; Gutierrez-Puebla, E.; Ruiz-Valero, C.; Monge, M.A.","A novel microporous Ge-material containing nine-rings","International Journal of Inorganic Materials","1999","1","","181","186","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531736","13.945","","13.945","","13.945","","90","","90","","90","","2711.79","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Li2 Cs C60","","- C60 Cs Li2 -","- C60 Cs Li2 -","- C240 Cs4 Li8 -","4","0.0208333","","Margadonna, S.; Prassides, K.; Brown, C.M.; Fitch, A.N.; Knudsen, K.D.; Tanigaki, K.; Le Bihan, T.; Mezouar, M.; Hirosawa, I.","Temperature and pressure dependence of orientational disorder and bonding in Li2 Cs C60","International Journal of Inorganic Materials","1999","1","","157","163","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531739","13.4147","","13.4147","","13.4147","","90","","90","","90","","2414.03","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Li2 Cs C60","","- C60 Cs Li2 -","- C60 Cs Li2 -","- C240 Cs4 Li8 -","4","0.0208333","","Margadonna, S.; Le Bihan, T.; Prassides, K.; Brown, C.M.; Knudsen, K.D.; Hirosawa, I.; Fitch, A.N.; Mezouar, M.; Tanigaki, K.","Temperature and pressure dependence of orientational disorder and bonding in Li2 Cs C60","International Journal of Inorganic Materials","1999","1","","157","163","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534814","19.652","","19.652","","5.018","","90","","90","","120","","1678.32","","","","","","","","","","","","","5","P 6 m m","P 6 -2","183","","(Ni3 (H3 O) (P O4)2.33) (H F) (H2 O)2.33","","- F H8.66 Ni3 O12.65 P2.33 -","- F Ni3 O12.6667 P2.33333 -","- F6 Ni18 O76 P14 -","6","0.5","","Guillou, N.; Gao, Q.-M.; Nogues, M.; Cheetham, A.K.; Hervieu, M.; Morris, R.E.; Ferey, G.","Zeolitic and magnetic properties of a 24-membered ring porous nickel(II) phosphate, VSB-1","C.R. Acad. Sci. Paris, T. 1, Serie II","1999","2","","387","392","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536622","34.10139","","30.495","","23.2829","","90","","123.92","","90","","20091.9","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Cs15.28 (Nb4 O6 (Nb3 Si W9 O40))4 (H2 O)16","","- Cs10.502 Nb16 W36 -","- Cs10.502 Nb16 W36 -","- Cs42.008 Nb64 W144 -","4","0.5","","Kim, G.-S.; Zeng, H.; van Derveer, D.; Hill, C.L.","A supramolecular tetra-Keggin polyoxometalate (Nb4 O6(alpha-Nb3 Si W9 O40)4)20-","Angew. Chem. Int. ed.","1999","38","","3205","3207","","","","","","","","","","","","","","","","","","","","","","has coordinates","164406","2020-10-21","18:00:00",""
"1536820","15.4036","","15.4036","","15.4036","","90","","90","","90","","3654.83","","","","","","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","Ce16 (Si15 O6 N32)","","- Ce16 N32 O6 Si15 -","- Ce16 N32 O6 Si15 -","- Ce64 N128 O24 Si60 -","4","0.166667","","Koellisch, K.; Schnick, W.","Ce16 Si15 O6 N32 - An oxonitridosilicate with silicon octahedrally coordinated by nitrogen","Angew. Chem. Int. ed.","1999","38","","357","358","","","","","","","","","","","","","","","","","","","","","","has coordinates","164694","2020-10-21","18:00:00",""
"1541512","48.5117","","38.0033","","45.4473","","90","","90","","90","","83786.9","","","","","","","","","","","","","4","C m c e","-C 2ac 2","64","","Na6.93 (Mo141.118 O418 (H2 O)58 (O H)14) (H2 O)240","","- H610 Mo141.118 Na6.93 O730 -","- Mo141.144 Na6.92 O732 -","- Mo564.576 Na27.68 O2928 -","4","0.25","","Mueller, A.; Schmidtmann, M.; Beugholt, C.; Koop, M.; Das, S.K.; Boegge, H.","Facile and optimized synthesis and structures of crystalline molybdenum blue compounds including one with an interesting high degree of defects: Na26 (Mo142 O432 (H2 O)58 * ca. 300 (H2 O) and Na16 ((Mo3)176 (H2 O)63 (C H3 O H)17 H16) * ca. 6000 )H2 O) * 6(C H3 O H)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1960","1962","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1544445","8.337","0.0001","8.337","0.0001","8.337","0.0001","90","","90","","90","","579.468","0.012","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","Sr3TaO5.5","","","- O5.5 Sr3 Ta -","- O5.496 Sr3 Ta -","- O21.984 Sr12 Ta4 -","4","0.0208333","","Kato, S.; Abe, T.; Sugai, M.; Takizawa, H.; Endo, T.","Synthesis and lattice distortion of the perovskite-type oxides Sr2(Sr1-xMx)TaOz (M=Ca,Nd)","Journal of the Ceramic Society of Japan","1999","107","","633","638","","","","","","","","","","","","","","","","","","","","","","has coordinates","187758","2020-10-21","18:00:00",""
"1544446","5.867","0.0001","5.9798","0.0002","8.3608","0.0002","90","","89.771","0.002","90","","293.324","0.013","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Sr2NdTaO6","","","- Nd O6 Sr2 Ta -","- Nd O6 Sr2 Ta -","- Nd2 O12 Sr4 Ta2 -","2","0.5","","Kato, S.; Abe, T.; Sugai, M.; Takizawa, H.; Endo, T.","Synthesis and lattice distortion of the perovskite-type oxides Sr2(Sr1-xMx)TaOz (M=Ca,Nd)","Journal of the Ceramic Society of Japan","1999","107","","633","638","","","","","","","","","","","","","","","","","","","","","","has coordinates","187759","2020-10-21","18:00:00",""
"1544447","8.2408","0.0002","8.2408","0.0002","8.2408","0.0002","90","","90","","90","","559.64","0.02","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","Sr2CaTaO5.5","","","- Ca O5.5 Sr2 Ta -","- Ca O5.496 Sr2 Ta -","- Ca4 O21.984 Sr8 Ta4 -","4","0.0208333","","Kato, S.; Abe, T.; Sugai, M.; Takizawa, H.; Endo, T.","Synthesis and lattice distortion of the perovskite-type oxides Sr2(Sr1-xMx)TaOz (M=Ca,Nd)","Journal of the Ceramic Society of Japan","1999","107","","633","638","","","","","","","","","","","","","","","","","","","","","","has coordinates","187760","2020-10-21","18:00:00",""
"1544448","8.319","0.0002","8.319","0.0002","8.319","0.0002","90","","90","","90","","575.72","0.02","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","Sr2Ca0.1Sr0.9TaO5.5","","","- Ca0.1 O5.5 Sr2.9 Ta -","- Ca0.1 O5.496 Sr2.9 Ta -","- Ca0.4 O21.984 Sr11.6 Ta4 -","4","0.0208333","","Kato, S.; Abe, T.; Sugai, M.; Takizawa, H.; Endo, T.","Synthesis and lattice distortion of the perovskite-type oxides Sr2(Sr1-xMx)TaOz (M=Ca,Nd)","Journal of the Ceramic Society of Japan","1999","107","","633","638","","","","","","","","","","","","","","","","","","","","","","has coordinates","187761","2020-10-21","18:00:00",""
"1544449","8.2725","0.0001","8.2725","0.0001","8.2725","0.0001","90","","90","","90","","566.122","0.012","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","SrCa0.5Sr0.5TaO5.5","","","- Ca0.5 O5.5 Sr1.5 Ta -","- Ca0.5 O5.496 Sr2.5 Ta -","- Ca2 O21.984 Sr10 Ta4 -","4","0.0208333","","Kato, S.; Abe, T.; Sugai, M.; Takizawa, H.; Endo, T.","Synthesis and lattice distortion of the perovskite-type oxides Sr2(Sr1-xMx)TaOz (M=Ca,Nd)","Journal of the Ceramic Society of Japan","1999","107","","633","638","","","","","","","","","","","","","","","","","","","","","","has coordinates","187762","2020-10-21","18:00:00",""
"1544450","8.2604","0.0001","8.2604","0.0001","8.2604","0.0001","90","","90","","90","","563.642","0.012","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","Sr2Ca0.7Sr0.3TaO5.5","","","- Ca0.7 O5.5 Sr2.3 Ta -","- Ca0.7 O5.496 Sr2.3 Ta -","- Ca2.8 O21.984 Sr9.2 Ta4 -","4","0.0208333","","Kato, S.; Abe, T.; Sugai, M.; Takizawa, H.; Endo, T.","Synthesis and lattice distortion of the perovskite-type oxides Sr2(Sr1-xMx)TaOz (M=Ca,Nd)","Journal of the Ceramic Society of Japan","1999","107","","633","638","","","","","","","","","","","","","","","","","","","","","","has coordinates","187763","2020-10-21","18:00:00",""
"1544451","8.2509","0.0002","8.2509","0.0002","8.2509","0.0002","90","","90","","90","","561.7","0.02","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","Sr2Ca0.9Sr0.1TaO5.5","","","- Ca0.9 O5.5 Sr2.1 Ta -","- Ca0.9 O5.496 Sr2.1 Ta -","- Ca3.6 O21.984 Sr8.4 Ta4 -","4","0.0208333","","Kato, S.; Abe, T.; Sugai, M.; Takizawa, H.; Endo, T.","Synthesis and lattice distortion of the perovskite-type oxides Sr2(Sr1-xMx)TaOz (M=Ca,Nd)","Journal of the Ceramic Society of Japan","1999","107","","633","638","","","","","","","","","","","","","","","","","","","","","","has coordinates","187764","2020-10-21","18:00:00",""
"1544452","5.8985","0.0005","5.8998","0.0004","8.2482","0.0003","90","","89.982","0.008","90","","287.04","0.03","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Sr2Sr0.3Nd0.7TaO5.85","","","- Nd0.7 O5.85 Sr2.3 Ta -","- Nd0.769 O5.85 Sr2.231 Ta -","- Nd1.538 O11.7 Sr4.462 Ta2 -","2","0.5","","Kato, S.; Abe, T.; Sugai, M.; Takizawa, H.; Endo, T.","Synthesis and lattice distortion of the perovskite-type oxides Sr2(Sr1-xMx)TaOz (M=Ca,Nd)","Journal of the Ceramic Society of Japan","1999","107","","633","638","","","","","","","","","","","","","","","","","","","","","","has coordinates","187765","2020-10-21","18:00:00",""
"1544560","3.9807","0.0007","5.688","0.001","5.711","0.001","90","","90","","90","","129.31","0.04","","","","","","","","","","","","3","A 2 m m","A -2 2","35","KNbO3","","","- K Nb O3 -","- K2 Nb O3 -","- K4 Nb2 O6 -","2","0.25","","Sugimoto, W.; Mimuro, K.; Sugahara, Y.; Kuroda, K.","Synthesis and structural study of the KNb4O6-type compound","Journal of the Ceramic Society of Japan","1999","107","","318","321","","","","","","","","","","","","","","","","","","","","","","has coordinates","188458","2020-10-21","18:00:00",""
"1544561","4.1396","0.0006","4.1396","0.0006","8.256","0.001","90","","90","","90","","141.48","0.03","","","","","","","","","","","","3","P 4/m m m","-P 4 2","123","KNb4O6","","","- K Nb4 O6 -","- K Nb4 O6 -","- K Nb4 O6 -","1","0.0625","","Sugimoto, W.; Mimuro, K.; Sugahara, Y.; Kuroda, K.","Synthesis and structural study of the KNb4O6-type compound","Journal of the Ceramic Society of Japan","1999","107","","318","321","","","","","","","","","","","","","","","","","","","","","","has coordinates","188459","2020-10-21","18:00:00",""
"1544725","8.884","0.003","5.899","0.004","19.292","0.006","90","","97.49","0.03","90","","1002.4","0.8","","","","","","","","","","","","6","A 1 2/m 1","-A 2y","12","Ca7.65(Al2.2Mg0.84Fe0.96)(Al6.53Fe1.43)Si12O56","","Fe-pumpellyite","- Al8.73 Ca7.65 Fe2.39 Mg0.83 O56 Si12.37 -","- Al8.76 Ca8 Fe2.4 Mg0.84 O56 Si12 -","- Al8.76 Ca8 Fe2.4 Mg0.84 O56 Si12 -","1","0.125","","Ohkawa, M.; Takeno, S.; Yoshiasa, A.; Ohsumi, K.","The structural study on Fe-pumpellyite: An application of Weissenberg technique combined with a synchrotron radiation and an imaging plate","Mineralogical Journal","1999","21","","151","156","","","","","","","","","","","","","","","","","","","","","","has coordinates","209176","2020-10-21","18:00:00",""
"1545077","5.6581","0.0001","5.6581","0.0001","6.941","0.002","90","","90","","120","","192.44","0.06","","","","","","","","","","","","4","P -3 m 1","-P 3 2""","164","SrMg0.4Ta0.6O2.9","","","- Mg0.4 O2.9 Sr Ta0.6 -","- Mg0.4 O2.901 Sr Ta0.6 -","- Mg1.2 O8.703 Sr3 Ta1.8 -","3","0.25","","Kato, S.; Ohmori, E.; Suzuki, Y.; Ohshima, Y.; Sugai, M.; Takazawa, H.; Endo, T.","Cation ordering in the oxygen deficient perovskite Sr2-xLaxMg1-yTa1+yOz","Journal of the Ceramic Society of Japan","1999","107","","209","214","","","","","","","","","","","","","","","","","","","","","","has coordinates","190715","2020-10-21","18:00:00",""
"1545078","5.654","0.002","5.654","0.002","6.926","0.004","90","","90","","120","","191.75","0.15","","","","","","","","","","","","5","P -3 m 1","-P 3 2""","164","Sr0.95La0.05Mg0.4Ta0.6O2.925","","","- La0.05 Mg0.4 O2.925 Sr0.95 Ta0.6 -","- La0.05 Mg0.403333 O2.925 Sr0.95 Ta0.596667 -","- La0.15 Mg1.21 O8.775 Sr2.85 Ta1.79 -","3","0.25","","Kato, S.; Ohmori, E.; Suzuki, Y.; Ohshima, Y.; Sugai, M.; Takazawa, H.; Endo, T.","Cation ordering in the oxygen deficient perovskite Sr2-xLaxMg1-yTa1+yOz","Journal of the Ceramic Society of Japan","1999","107","","209","214","","","","","","","","","","","","","","","","","","","","","","has coordinates","190716","2020-10-21","18:00:00",""
"1545079","7.9788","0.0001","7.9788","0.0001","7.9788","0.0001","90","","90","","90","","507.94","0.011","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","SrLaMgTaO6","","","- La Mg O6 Sr Ta -","- La Mg1.92 O6 Sr Ta0.08 -","- La4 Mg7.68 O24 Sr4 Ta0.32 -","4","0.0208333","","Kato, S.; Ohmori, E.; Suzuki, Y.; Ohshima, Y.; Sugai, M.; Takazawa, H.; Endo, T.","Cation ordering in the oxygen deficient perovskite Sr2-xLaxMg1-yTa1+yOz","Journal of the Ceramic Society of Japan","1999","107","","209","214","","","","","","","","","","","","","","","","","","","","","","has coordinates","190717","2020-10-21","18:00:00",""
"1545080","7.9804","0.0001","7.9804","0.0001","7.9804","0.0001","90","","90","","90","","508.246","0.011","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","Sr1.4La0.6MgTaO5.8","","","- La0.6 Mg O5.8 Sr1.4 Ta -","- La0.6 Mg1.82 O6 Sr1.4 Ta0.18 -","- La2.4 Mg7.28 O24 Sr5.6 Ta0.72 -","4","0.0208333","","Kato, S.; Ohmori, E.; Suzuki, Y.; Ohshima, Y.; Sugai, M.; Takazawa, H.; Endo, T.","Cation ordering in the oxygen deficient perovskite Sr2-xLaxMg1-yTa1+yOz","Journal of the Ceramic Society of Japan","1999","107","","209","214","","","","","","","","","","","","","","","","","","","","","","has coordinates","190718","2020-10-21","18:00:00",""
"1545081","7.9771","0.0001","7.9771","0.0001","7.9771","0.0001","90","","90","","90","","507.616","0.011","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","Sr1.2La0.8MgTaO5.9","","","- La0.8 Mg O5.9 Sr1.2 Ta -","- La0.8 Mg1.94 O6 Sr1.2 Ta0.06 -","- La3.2 Mg7.76 O24 Sr4.8 Ta0.24 -","4","0.0208333","","Kato, S.; Ohmori, E.; Suzuki, Y.; Ohshima, Y.; Sugai, M.; Takazawa, H.; Endo, T.","Cation ordering in the oxygen deficient perovskite Sr2-xLaxMg1-yTa1+yOz","Journal of the Ceramic Society of Japan","1999","107","","209","214","","","","","","","","","","","","","","","","","","","","","","has coordinates","190719","2020-10-21","18:00:00",""
"1545082","7.9835","0.0001","7.9835","0.0001","7.9835","0.0001","90","","90","","90","","508.839","0.011","","","","","","","","","","","","5","F m -3 m","-F 4 2 3","225","Sr1.6La0.4MgTaO5.7","","","- La0.4 Mg O5.7 Sr1.6 Ta -","- La0.4 Mg1.72 O6 Sr1.6 Ta0.28 -","- La1.6 Mg6.88 O24 Sr6.4 Ta1.12 -","4","0.0208333","","Kato, S.; Ohmori, E.; Suzuki, Y.; Ohshima, Y.; Sugai, M.; Takazawa, H.; Endo, T.","Cation ordering in the oxygen deficient perovskite Sr2-xLaxMg1-yTa1+yOz","Journal of the Ceramic Society of Japan","1999","107","","209","214","","","","","","","","","","","","","","","","","","","","","","has coordinates","190720","2020-10-21","18:00:00",""
"1545569","11.072","0.001","7.012","0.001","6.1096","0.0008","90","","100.98","0.01","90","","465.65","0.1","","","295","","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C3 H14 Al2 F3 N2 O6 P -","- C3 Al2 F3 N2 O6 P -","- C6 Al4 F6 N4 O12 P2 -","2","0.5","","Simon, N.; Guillou, N.; Loiseau, T.; Taulelle, F.; Ferey, G.","Synthesis and ab Initio Structure Determination from X-Ray Powder Diffraction of MIL-12, a New Layered Fluoroaluminophosphate Templated with 1,3 Diaminopropane: [N2C3H12]Al2(PO4)(OHx, F5-x) (x close to 2)","Journal of Solid State Chemistry","1999","147","","92","98","10.1006/jssc.1999.8182","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","0.062","0.088","","","","","","","","has coordinates","194263","2020-10-21","18:00:00",""
"1546510","6.272","0.0003","5.0701","0.0003","10.2989","0.0006","90","","95.882","0.002","90","","325.78","0.03","","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Al B Li2 O4 -","- Al B Li2 O4 -","- Al4 B4 Li8 O16 -","4","1","","Psycharis, V.; Kapoutsis, I. A.; Chryssikos, G. D.","Crystal structure and vibrational spectra of Li2BAlO4","Journal of Solid State Chemistry","1999","142","","214","219","","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","","0.0514","","","","","","","","has coordinates","198592","2020-10-21","18:00:00",""
"1551186","37.824","0.008","9.813","0.002","16.679","0.003","90","","92.7","0.03","90","","6184","2","","","295","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Cu3 F K3 O16 P4 Zn2 -","- Cu3 F K3 O16 P4 Zn2 -","- Cu48 F16 K48 O256 P64 Zn32 -","16","2","","Massa, W.; Yakubovich, O. V.; Dem Yanetz, L. N.","New open framework in the structure of K3[Cu3FZn2(PO4)4]","Solid State Sciences","1999","1","","109","119","10.1016/S1293-2558(00)80068-0","","x-ray","0.71073","MoKα","","","0.0255","","","0.0572","","","","","","","0.806","","","","has coordinates","250892","2020-10-21","18:00:00",""
"1569839","9.276","0.003","9.806","0.003","7.272","0.001","77.73","0.02","109.21","0.03","97.92","0.02","608.7","0.3","","","","","","","","","","","","4","P -1","-P 1","2","","Pentasodium Bismuth Bis(diphosphate(V))","","- Bi Na5 O14 P4 -","- Bi Na5 O14 P4 -","- Bi2 Na10 O28 P8 -","2","1","","Boughzala, H. Jouini, T.","Preparation et structure cristalline d'un nouveau bis-diphosphate de bismuth et de sodium Na5 Bi (P2 O7)2","Journal of Solid State Chemistry","1999","143","","104","","","","","","","","0.0167","","","","","","","","","","","","","","","has coordinates","286274","2023-09-08","07:15:19",""
"2000016","12.825","0.002","11.691","0.002","18.568","0.005","90","","90.15","0.03","90","","2784.02","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H72 Cl14 N2 W6 -","- C56 H126 Cl28 N2 W12 -","- C112 H252 Cl56 N4 W24 -","2","0.5","","Venkataraman, D.; Rayburn, Lori L.; Hill, Laurie I.; Jin, Song; Malik, Abds-Sami; Turneau, Kevin J.; DiSalvo, Francis J.","An Improved High Yield Synthesis Procedure and Reactivity of W~6~S~8~(4-tert-butylpyridine)~6~","Inorganic Chemistry","1999","38","","828","830","10.1021/ic980967s","","","","","","","0.0496","","","0.0496","","","","","","","","","","","has coordinates","199648","2020-10-21","18:00:00",""
"2000021","19.432","0.004","19.432","0.004","22.574","0.004","90","","90","","90","","8524","","","","173","","","","","","","","","5","I -4","I -4","82","","","","- C65 H137 N13 S8 W6 -","- C98 H186 N18 S16 W12 -","- C392 H744 N72 S64 W48 -","4","0.5","","Venkataraman, D.; Rayburn, Lori L.; Hill, Laurie I.; Jin, Song; Malik, Abds-Sami; Turneau, Kevin J.; DiSalvo, Francis J.","An Improved High Yield Synthesis Procedure and Reactivity of W~6~S~8~(4-tert-butylpyridine)~6~","Inorganic Chemistry","1999","38","4","828","830","10.1021/ic980967s","","","","","","","0.0579","","","0.0579","","","","","","","","","","","has coordinates","199648","2020-10-21","18:00:00",""
"2000022","17.481","0.003","17.481","0.003","19.935","0.004","90","","90","","120","","5275.69","","","","","","","","","","","","","5","R -3 :H","-R 3","148","","","","- C48 H102 P6 S8 W6 -","- C240 H504 P36 S40 W36 -","- C720 H1512 P108 S120 W108 -","3","0.166667","","Venkataraman, D.; Rayburn, Lori L.; Hill, Laurie I.; Jin, Song; Malik, Abds-Sami; Turneau, Kevin J.; DiSalvo, Francis J.","An Improved High Yield Synthesis Procedure and Reactivity of W~6~S~8~(4-tert-butylpyridine)~6~","Inorganic Chemistry","1999","38","4","828","830","10.1021/ic980967s","","","","","","","0.0402","","","0.0402","","","","","","","","","","","has coordinates","199648","2020-10-21","18:00:00",""
"2000053","10.734","0.004","10.734","0.004","35.245","0.006","90","","90","","120","","3516.83","","","","","","","","","","","","","6","P 31 2 1","P 31 2""","152","Chloro-bis((-)ephedrene)-palladium(ii)","","","- C20 H29 Cl N2 O2 Pd -","- C20 H29 Cl N2 O2 Pd -","- C120 H174 Cl6 N12 O12 Pd6 -","6","1","","Bouquillon, S.; du Moulinet d'Hardemare, A.; Averbuch-Pouchot, M.-T.; Hénin, F.; Muzart, J.; Durif, A.","A coordination compound of (‒)-ephedrine and palladium(II)","Acta Crystallographica, Section C: Crystal Structure Communications","1999","55","12","2028","2030","10.1107/s0108270199011555","","","","","","","0.03","","","0.03","","","","","","","","","","","has coordinates","199776","2020-10-21","18:00:00",""
"2000070","14.149","0.005","12.76","0.003","16.754","0.007","90","","107.68","0.03","90","","2881.92","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 O S -","- C18 H16 O S -","- C144 H128 O8 S8 -","8","2","","Minassian, F.; Pelloux-Léon, N.; Durif, A.; Vallée, Y.","12-Formyl-9,10-dimethyl-9,10-dihydro-11-thia-9,10-ethanoanthracene","Acta Crystallographica, Section C: Crystal Structure Communications","1999","55","5","781","783","10.1107/s010827019801782x","","","","","","","0.041","","","0.041","","","","","","","","","","","has coordinates","199666","2020-10-21","18:00:00",""
"2000093","7.594","0.003","17.346","0.004","14.106","0.002","90","","98.74","0.02","90","","1836.54","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C17 H19 N5 P2 -","- C17 H19 N5 P2 -","- C68 H76 N20 P8 -","4","1","","Gimbert, Yves; Robert, Frédéric; Durif, André; Averbuch, Marie-Thérèse; Kann, Nina; Greene, Andrew E.","Synthesis and Characterization of New Binuclear Co(0) Complexes with Diphosphinoamine Ligands. A Potential Approach for Asymmetric Pauson-Khand Reactions","The Journal of Organic Chemistry","1999","64","10","3492","3497","10.1021/jo982245o","","","","","","","0.033","","","0.033","","","","","","","","","","","has coordinates","301791","2025-08-18","23:14:58",""
"2000094","40.127","0.006","12.434","0.003","14.716","0.002","90","","92.87","0.02","90","","7333.18","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C37 H28 Co2 O4 P2 -","- C37 H28 Co2 O4 P2 -","- C296 H224 Co16 O32 P16 -","8","1","","Gimbert, Yves; Robert, Frédéric; Durif, André; Averbuch, Marie-Thérèse; Kann, Nina; Greene, Andrew E.","Synthesis and Characterization of New Binuclear Co(0) Complexes with Diphosphinoamine Ligands. A Potential Approach for Asymmetric Pauson-Khand Reactions","The Journal of Organic Chemistry","1999","64","10","3492","3497","10.1021/jo982245o","","","","","","","0.034","","","0.034","","","","","","","","","","","has coordinates","219250","2020-10-21","18:00:00",""
"2000095","14.128","0.005","14.927","0.006","17.277","0.009","90","","110.7","0.04","90","","3408.31","","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C37 H29 Co2 N O4 P2 -","- C37 H29 Co2 N O4 P2 -","- C148 H116 Co8 N4 O16 P8 -","4","1","","Gimbert, Yves; Robert, Frédéric; Durif, André; Averbuch, Marie-Thérèse; Kann, Nina; Greene, Andrew E.","Synthesis and Characterization of New Binuclear Co(0) Complexes with Diphosphinoamine Ligands. A Potential Approach for Asymmetric Pauson-Khand Reactions","The Journal of Organic Chemistry","1999","64","10","3492","3497","10.1021/jo982245o","","","","","","","0.037","","","0.037","","","","","","","","","","","has coordinates","219250","2020-10-21","18:00:00",""
"2000096","7.166","0.002","9.205","0.003","28.231","0.009","90","","90","","90","","1862.2","","","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C13 H9 Co2 F4 N O4 P2 -","- C13 H9 Co2 F4 N O4 P2 -","- C52 H36 Co8 F16 N4 O16 P8 -","4","1","","Gimbert, Yves; Robert, Frédéric; Durif, André; Averbuch, Marie-Thérèse; Kann, Nina; Greene, Andrew E.","Synthesis and Characterization of New Binuclear Co(0) Complexes with Diphosphinoamine Ligands. A Potential Approach for Asymmetric Pauson-Khand Reactions","The Journal of Organic Chemistry","1999","64","10","3492","3497","10.1021/jo982245o","","","","","","","0.04","","","0.04","","","","","","","","","","","has coordinates","219250","2020-10-21","18:00:00",""
"2000097","10.611","0.002","12.401","0.006","15.96","0.004","111.07","0.04","98.14","0.02","76.85","0.03","1904.19","","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C25 H13 Co2 F24 N O8 P2 -","- C25 H13 Co2 F24 N O8 P2 -","- C50 H26 Co4 F48 N2 O16 P4 -","2","1","","Gimbert, Yves; Robert, Frédéric; Durif, André; Averbuch, Marie-Thérèse; Kann, Nina; Greene, Andrew E.","Synthesis and Characterization of New Binuclear Co(0) Complexes with Diphosphinoamine Ligands. A Potential Approach for Asymmetric Pauson-Khand Reactions","The Journal of Organic Chemistry","1999","64","10","3492","3497","10.1021/jo982245o","","","","","","","0.039","","","0.039","","","","","","","","","","","has coordinates","219250","2020-10-21","18:00:00",""
"2000098","14.148","0.004","13.928","0.004","17.126","0.003","90","","111.54","0.02","90","","3139.05","","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C29 H25 Co2 N5 O4 P2 -","- C29 H25 Co2 N5 O4 P2 -","- C116 H100 Co8 N20 O16 P8 -","4","1","","Gimbert, Yves; Robert, Frédéric; Durif, André; Averbuch, Marie-Thérèse; Kann, Nina; Greene, Andrew E.","Synthesis and Characterization of New Binuclear Co(0) Complexes with Diphosphinoamine Ligands. A Potential Approach for Asymmetric Pauson-Khand Reactions","The Journal of Organic Chemistry","1999","64","10","3492","3497","10.1021/jo982245o","","","","","","","0.021","","","0.021","","","","","","","","","","","has coordinates","219250","2020-10-21","18:00:00",""
"2000101","10.091","0.006","10.002","0.002","11.524","0.003","90","","105.06","0.04","90","","1123.17","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H23 N P2 -","- C25 H23 N P2 -","- C50 H46 N2 P4 -","2","1","","Gimbert, Yves; Robert, Frédéric; Durif, André; Averbuch, Marie-Thérèse; Kann, Nina; Greene, Andrew E.","Synthesis and Characterization of New Binuclear Co(0) Complexes with Diphosphinoamine Ligands. A Potential Approach for Asymmetric Pauson-Khand Reactions","The Journal of Organic Chemistry","1999","64","10","3492","3497","10.1021/jo982245o","","","","","","","0.032","","","0.032","","","","","","","","","","","has coordinates","301791","2025-08-18","23:14:58",""
"2000113","14.503","0.001","12.267","0.001","22.202","0.002","90","","100.867","0.006","90","","3879.09","","","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H86 Cd4 Mo12 N4 O72 P8 -","- C16 Cd11 Mo24 N4 O146 P16 -","- C32 Cd22 Mo48 N8 O292 P32 -","2","0.5","","Leclaire, A.; Guesdon, A.; Berrah, F.; Borel, M. M.; Raveau, B.","Four New Mo(V) Phosphate Structures Built up of Isotypic Mo~12~MP~8~X~62~ Clusters","Journal of Solid State Chemistry","1999","145","1","291","301","10.1006/jssc.1999.8268","","","","","","","0.057","","","0.057","","","","","","","","","","","has coordinates","199775","2020-10-21","18:00:00",""
"2000114","15.123","0.001","12.305","0.001","19.264","0.002","90","","98.62","0.008","90","","3544.32","","","","","","","","","","","","","7","P 1 n 1","P -2yac","7","","","","- C16 H90 Cd2 Mo12 N4 O72 P8 -","- C8 Cd7 Mo12 N2 O79 P8 -","- C16 Cd14 Mo24 N4 O158 P16 -","2","1","","Leclaire, A.; Guesdon, A.; Berrah, F.; Borel, M. M.; Raveau, B.","Four New Mo(V) Phosphate Structures Built up of Isotypic Mo~12~MP~8~X~62~ Clusters","Journal of Solid State Chemistry","1999","145","1","291","301","10.1006/jssc.1999.8268","","","","","","","0.036","","","0.036","","","","","","","","","","","has coordinates","199775","2020-10-21","18:00:00",""
"2000115","11.82","0.001","13.248","0.001","14.794","0.001","68.593","0.006","82.067","0.007","87.372","0.008","2136.13","","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C24 H98.6 Cd3 Mo12 N6 O73.3 P8 -","- C32 Cd9 Mo24 N8 O140 P16 -","- C32 Cd9 Mo24 N8 O140 P16 -","1","0.5","","Leclaire, A.; Guesdon, A.; Berrah, F.; Borel, M. M.; Raveau, B.","Four New Mo(V) Phosphate Structures Built up of Isotypic Mo~12~MP~8~X~62~ Clusters","Journal of Solid State Chemistry","1999","145","1","291","301","10.1006/jssc.1999.8268","","","","","","","0.036","","","0.036","","","","","","","","","","","has coordinates","199775","2020-10-21","18:00:00",""
"2000116","11.535","0.001","14.344","0.001","14.5","0.002","67.772","0.008","71.517","0.009","76.728","0.007","2089.8","","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C8 H58 Mo12 N2 O74 P8 Zn3 -","- C16 Mo24 N4 O144 P16 Zn9 -","- C16 Mo24 N4 O144 P16 Zn9 -","1","0.5","","Leclaire, A.; Guesdon, A.; Berrah, F.; Borel, M. M.; Raveau, B.","Four New Mo(V) Phosphate Structures Built up of Isotypic Mo~12~MP~8~X~62~ Clusters","Journal of Solid State Chemistry","1999","145","1","291","301","10.1006/jssc.1999.8268","","","","","","","0.055","","","0.055","","","","","","","","","","","has coordinates","199775","2020-10-21","18:00:00",""
"2000127","8.368","0.007","11.274","0.01","11.462","0.012","72.4","0.07","89.45","0.08","85.37","0.07","1027.23","","","","","","","","","","","","","6","P -1","","2","","","","- C3 H18 Al3 N3 O16 P4 -","","","2","1","","Vidal, L.; Gramlich, V.; Patarin, J.; Gabelica, Z.","Synthesis, Characterization and Structure of Mu-7, a New Layered Aluminophosphate with a 4 × 8 Network","Chemical Letters","1999","28","3","201","202","10.1246/cl.1999.201","","","","","","","","","","","","","","","","","","","","","","174552","2020-10-21","18:00:00",""
"2000128","8.368","0.007","11.274","0.01","11.462","0.012","72.4","0.07","89.45","0.08","85.35","0.07","1027.2","","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C3 H18 Al3 N3 O16 P4 -","- C3 H18 Al6 N3 O20 P4 -","- C6 H36 Al12 N6 O40 P8 -","2","1","","Vidal, L.; Marichal, C.; Gramlich, V.; Patarin, J.; Gabelica, Z.","Mu-7, a New Layered Aluminophosphate [CH~3~NH~3~]~3~[Al~3~P~4~O~16~] with a 4 × 8 Network: Characterization, Structure, and Possible Crystallization Mechanism","Chemistry of Materials","1999","11","10","2728","2736","10.1021/cm991027o","","","","","","","0.0372","","","0.0372","","","","","","","","","","","has coordinates","178247","2020-10-21","18:00:00",""
"2002164","8.9731","0.0012","9.4598","0.0012","6.8713","0.0009","95.586","0.011","95.796","0.012","101.072","0.011","565.4","","","","","","","","","","","","","3","P -1","-P 1","2","","Bis(tetrachlorophosphorus) decachlorodirhenate(IV)","","- Cl18 P2 Re2 -","- Cl18 P2 Re2 -","- Cl18 P2 Re2 -","1","0.5","","Beck, J; Mueller-Buschbaum, K; Wolf, F","On tetrachlorophosphonium chlorometallates of rhenium and molybdenum: Syntheses, crystal structures and magnetism of (P Cl4)2 (Re2 Cl10) and (P Cl4)3 (Re Cl6)2 and the magnetic properties of (P Cl4)2 (Mo2 Cl10)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","975","981","10.1002/(SICI)1521-3749(199906)625:6<975::AID-ZAAC975>3.0.CO;2-#","","","","","","0.0233","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002165","14.962","0.001","14.962","0.001","13.6315","0.0015","90","","90","","90","","3051.6","","","","","","","","","","","","","3","P 42/m b c","-P 4c 2ab","135","","Tris(tetrachlorophosphorus) bis(hexachlororhenate)","","- Cl24 P3 Re2 -","- Cl24 P3 Re2 -","- Cl96 P12 Re8 -","4","0.25","","Beck, J; Mueller-Buschbaum, K; Wolf, F","On tetrachlorophosphonium chlorometallates of rhenium and molybdenum: Syntheses, crystal structures and magnetism of (P Cl4)2 (Re2 Cl10) and (P Cl4)3 (Re Cl6)2 and the magnetic properties of (P Cl4)2 (Mo2 Cl10)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","975","981","10.1002/(SICI)1521-3749(199906)625:6<975::AID-ZAAC975>3.0.CO;2-#","","","","","","0.1335","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002166","8.943","0.007","9.464","0.007","6.93","0.006","95.97","0.006","95.75","0.006","100.92","0.006","568.5","","","","","","","","","","","","","3","P -1","-P 1","2","","Bis(tetrachlorophosphorus) decachlorodimolybdate(IV)","","- Cl18 Mo2 P2 -","- Cl18 Mo2 P2 -","- Cl18 Mo2 P2 -","1","0.5","","Beck, J; Mueller-Buschbaum, K; Wolf, F","On tetrachlorophosphonium chlorometallates of rhenium and molybdenum: Syntheses, crystal structures and magnetism of (P Cl4)2 (Re2 Cl10) and (P Cl4)3 (Re Cl6)2 and the magnetic properties of (P Cl4)2 (Mo2 Cl10)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","975","981","10.1002/(SICI)1521-3749(199906)625:6<975::AID-ZAAC975>3.0.CO;2-#","","","","","","0.0377","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002167","8.9983","0.0003","8.9983","0.0003","22.493","0.002","90","","90","","120","","1577.2","","","","","","","","","","","","","3","P 3 1 c","P 3 -2c","159","","$-mue3-thio-tri-$-mue-dithio-hexachlorotrirhenium(V) chloride","","- Cl7 Re3 S7 -","- Cl7 Re3 S7 -","- Cl28 Re12 S28 -","4","0.666667","","Beck, J; Mueller-Buschbaum, K","Synthese und Kristallstrukturen der Rhenium-Dreieckscluster Re3 E7 X7 (E= S, Se; X= Cl, Br)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1212","1216","10.1002/(SICI)1521-3749(199907)625:7<1212::AID-ZAAC1212>3.0.CO;2-0","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002168","9.2635","0.0005","9.2635","0.0005","23.45219","0.0012","90","","90","","120","","1742.9","","","","","","","","","","","","","3","P 3 1 c","P 3 -2c","159","","$-mue3-thio-tri-$-mue-dithio-hexabromotrirhenium(V) bromide *","","- Br7 Re3 S7 -","- Br7 Re3 S7 -","- Br28 Re12 S28 -","4","0.666667","","Beck, J; Mueller-Buschbaum, K","Synthese und Kristallstrukturen der Rhenium-Dreieckscluster Re3 E7 X7 (E= S, Se; X= Cl, Br)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1212","1216","10.1002/(SICI)1521-3749(199907)625:7<1212::AID-ZAAC1212>3.0.CO;2-0","","","","","","0.0243","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002169","9.476","0.0015","9.476","0.0015","23.79599","0.003","90","","90","","120","","1850.5","","","","","","","","","","","","","3","P 3 1 c","P 3 -2c","159","","$-mue3-seleno-tri-$-mue-diseleno-hexabromotrirhenium(V) bromide *","","- Br7 Re3 Se7 -","- Br7 Re3 Se7 -","- Br28 Re12 Se28 -","4","0.666667","","Beck, J; Mueller-Buschbaum, K","Synthese und Kristallstrukturen der Rhenium-Dreieckscluster Re3 E7 X7 (E= S, Se; X= Cl, Br)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1212","1216","10.1002/(SICI)1521-3749(199907)625:7<1212::AID-ZAAC1212>3.0.CO;2-0","","","","","","0.0589","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002170","11.897","0.002","14.168","0.003","10.147","0.003","90","","90","","90","","1710.3","","","","","","","","","","","","","3","P b c m","-P 2c 2b","57","","$-mue3-seleno-tri-$-mue-diseleno-hexachlorotrirhenium(V) chloride *","","- Cl7 Re3 Se7 -","- Cl7 Re3 Se7 -","- Cl28 Re12 Se28 -","4","0.5","","Beck, J; Mueller-Buschbaum, K","Synthese und Kristallstrukturen der Rhenium-Dreieckscluster Re3E7X7 (E=S,Se; X=Cl,Br)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1999","625","","1212","1216","10.1002/(SICI)1521-3749(199907)625:7<1212::AID-ZAAC1212>3.0.CO;2-0","","","","","","0.0339","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002887","11.275","0.001","8.6185","0.0009","12.31","0.0011","90","","105.469","0.009","90","","1152.9","","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","Di-$-mue-bromidotelluro-$-mue-ditellurido- bis(dibromotelluridodibromorhenium)","","- Br10 Re2 Te6 -","- Br10 Re2 Te6 -","- Br20 Re4 Te12 -","2","1","","Beck, J; Mueller-Buschbaum, K","Synthesis and crystal structure of (Re2 Br4 (Te2) (Te Br)2 (Te Br2)2), a dinuclear complex with (Te2)2-, TeBr-, and Te Br2 ligands","European Journal of Inorganic Chemistry","1999","1999","","839","842","10.1002/(SICI)1099-0682(199905)1999:5<839::AID-EJIC839>3.0.CO;2-E","","","","","","0.0648","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002906","8.36","0.002","6.33","0.001","14.75","0.003","90","","92.86","0.03","90","","779.6","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Lys.3HIO3","α,ε–diaminocapronic acid.3HIO~3~","","- C6 H17 I3 N2 O11 -","- C6 H17 I3 N2 O11 -","- C12 H34 I6 N4 O22 -","2","1","AN0540","A. M. Petrosyan; R. P. Sukiasyan; S. S. Terzyan; V. M. Burbelo","Interaction of lysine with iodic acid","Acta Crystallographica Section B","1999","55","2","221","225","10.1107/S0108768198011975","","","0.71073","MoKα","","0.0339","0.0338","","0.0921","0.0918","","","","1.071","1.071","1.071","","","","","has coordinates","301791","2025-08-18","23:15:21",""
"2002915","7.235","0.002","13.056","0.004","14.415","0.004","90","","90","","90","","1361.6","0.7","110","2","110","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-Acetyl-L-tyrosine Ethyl Ester Monohydrate","","- C13 H19 N O5 -","- C13 H19 N O5 -","- C52 H76 N4 O20 -","4","1","AN0551","Slimane Dahaoui; Christian Jelsch; Judith A. K. Howard; Claude Lecomte","Charge density study of <i>N</i>-acetyl-<small>L</small>-tyrosine ethyl ester monohydrate derived from CCD area detector data","Acta Crystallographica Section B","1999","55","2","226","230","10.1107/S0108768198012099","","","0.71073","MoKα","","","0.0272","","","0.0202","","","","","0.65","0.65","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002916","7.3827","0.0002","13.1421","0.0004","14.515","0.0004","90","","90","","90","","1408.31","0.07","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-Acetyl-L-tyrosine Ethyl Ester Monohydrate","","- C13 H19 N O5 -","- C13 H19 N O5 -","- C52 H76 N4 O20 -","4","1","AN0551","Slimane Dahaoui; Christian Jelsch; Judith A. K. Howard; Claude Lecomte","Charge density study of <i>N</i>-acetyl-<small>L</small>-tyrosine ethyl ester monohydrate derived from CCD area detector data","Acta Crystallographica Section B","1999","55","2","226","230","10.1107/S0108768198012099","","","0.71073","MoKα","","0.0526","0.0382","","0.0997","0.0874","","","","1.103","1.084","1.084","","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2002917","7.4889","0.0008","17.273","0.002","7.4073","0.0008","90","0.0001","111.937","0.006","90","0.0001","888.8","0.2","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","[1-(2-aminoethyl)-1,2-dihydroimidazolidene-2]nitroacetonitrile","","- C7 H11 N5 O2 -","- C7 H11 N5 O2 -","- C28 H44 N20 O8 -","4","1","AN0555","Chernyshev, Vladimir V.; Fitch, Andrew N.; Sonneveld, Eduard J.; Kurbakov, Alexander I.; Makarov, Vadim A.; Tafeenko, Victor A.","Crystal and molecular structures of 2-[1-(2-aminoethyl)-2-imidazolidinylidene]-2-nitroacetonitrile (C~7~H~11~N~5~O~2~) and 2,6-diamino-5-hydroxy-3-nitro-4<i>H</i>-pyrazolo[1,5-<i>a</i>]pyrimidin-7-one monohydrate (C~6~H~6~N~6~O~4~·H~2~O) from X-ray, synchrotron and neutron powder diffraction data","Acta Crystallographica Section B","1999","55","4","554","562","10.1107/S010876819900213X","","","0.85617","synchrotron","","","","","","","","","","1.45","","","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002918","17.576","0.003","10.9","0.002","4.6738","0.0006","90","0.0001","92.867","0.008","90","0.0001","894.3","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,7-diamino-4-nitro-6-hydroxy-8-oxopyrazolo[1,5-a]pyrimidine monohydrate","","- C6 H8 N6 O5 -","- C6 H8 N6 O5 -","- C24 H32 N24 O20 -","4","1","AN0555","Chernyshev, Vladimir V.; Fitch, Andrew N.; Sonneveld, Eduard J.; Kurbakov, Alexander I.; Makarov, Vadim A.; Tafeenko, Victor A.","Crystal and molecular structures of 2-[1-(2-aminoethyl)-2-imidazolidinylidene]-2-nitroacetonitrile (C~7~H~11~N~5~O~2~) and 2,6-diamino-5-hydroxy-3-nitro-4<i>H</i>-pyrazolo[1,5-<i>a</i>]pyrimidin-7-one monohydrate (C~6~H~6~N~6~O~4~·H~2~O) from X-ray, synchrotron and neutron powder diffraction data","Acta Crystallographica Section B","1999","55","4","554","562","10.1107/S010876819900213X","","","0.95044","synchrotron","","","","","","","","","","1.75","","","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002925","7.531","0.003","5.874","0.002","10.399","0.004","90","","90","","90","","460","0.3","200","","200","","","","","","","","","4","P n m a","-P 2ac 2n","62","","ammonium tetrafluoroberyllate","","- Be F4 H8 N2 -","- Be F4 H8 N2 -","- Be4 F16 H32 N8 -","4","0.5","BK0051","Srivastava, R. C.; Klooster, W. T.; Koetzle, T. F.","Neutron structures of ammonium tetrafluoroberyllate","Acta Crystallographica Section B","1999","55","1","17","23","10.1107/S010876819800737X","","neutron","1.0462","neutron","","0.0679","0.0679","","0.0733","0.0733","","","","1.0428","1.0428","1.0428","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002926","15.017","0.006","5.876","0.003","10.418","0.004","90","","90","","90","","919.3","0.7","163","","163","","","","","","","","","4","P n a 21","P 2c -2n","33","","ammonium tetrafluoroberyllate","","- Be F4 H8 N2 -","- Be F4 H8 N2 -","- Be8 F32 H64 N16 -","8","2","BK0051","Srivastava, R. C.; Klooster, W. T.; Koetzle, T. F.","Neutron structures of ammonium tetrafluoroberyllate","Acta Crystallographica Section B","1999","55","1","17","23","10.1107/S010876819800737X","","neutron","1.0462","neutron","","0.0476","0.0476","","0.0552","0.0552","","","","1.065","1.065","1.065","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002927","14.997","0.005","5.86","0.003","10.402","0.004","90","","90","","90","","914.2","0.7","20","","20","","","","","","","","","4","P n a 21","P 2c -2n","33","","ammonium tetrafluoroberyllate","","- Be F4 H8 N2 -","- Be F4 H8 N2 -","- Be8 F32 H64 N16 -","8","2","BK0051","Srivastava, R. C.; Klooster, W. T.; Koetzle, T. F.","Neutron structures of ammonium tetrafluoroberyllate","Acta Crystallographica Section B","1999","55","1","17","23","10.1107/S010876819800737X","","neutron","1.0462","neutron","","0.0342","0.0342","","0.0405","0.0405","","","","1.0436","1.0436","1.0436","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002928","7.4544","0.0004","6.0826","0.0006","20.0946","0.0012","90","","90","","90","","911.13","0.12","","","","","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- C12 H12 -","- C12 H12 -","- C48 H48 -","4","0.5","BK0054","Kaduk, J.A.; Golab, J.T.","Structures of 2,6-disubstituted naphthalenes","Acta Crystallographica Section B","1999","55","1","85","94","10.1107/S0108768198008945","","","1.5406","Cu","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002929","3.7061","0.0008","7.4688","0.0014","8.535","0.002","86.62","0.02","85.49","0.02","87.99","0.02","235","0.09","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C12 H8 O4 -","- C12 H8 O4 -","- C12 H8 O4 -","1","0.5","BK0054","Kaduk, J.A.; Golab, J.T.","Structures of 2,6-disubstituted naphthalenes","Acta Crystallographica Section B","1999","55","1","85","94","10.1107/S0108768198008945","","","1.5406","Cu","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002930","13.41931","0.00014","6.14869","0.00005","7.15257","0.00005","90","","100.4","0.001","90","","580.471","0.009","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 O4 -","- C14 H12 O4 -","- C28 H24 O8 -","2","0.5","BK0054","Kaduk, J.A.; Golab, J.T.","Structures of 2,6-disubstituted naphthalenes","Acta Crystallographica Section B","1999","55","1","85","94","10.1107/S0108768198008945","","","1.15023","synchrotron","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002932","11.397","0.002","8.871","0.002","7.222","0.004","90","","95.12","0.03","90","","727.3","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5,6-dichlorobenzfurazan-1-oxide","","- C6 H2 Cl2 N2 O2 -","- C6 H2 Cl2 N2 O2 -","- C24 H8 Cl8 N8 O8 -","4","0.5","BK0061","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z.","Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide","Acta Crystallographica Section B","1999","55","4","530","542","10.1107/S0108768199000348","","","0.71073","MoKα","","0.034","0.029","","0.076","0.073","","","","1.127","1.144","1.144","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2002933","11.554","0.002","8.926","0.002","7.31","0.006","90","","96.1","0.04","90","","749.6","0.7","297","2","297","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5,6-dichlorobenzfurazan-1-oxide","","- C6 H2 Cl2 N2 O2 -","- C6 H2 Cl2 N2 O2 -","- C24 H8 Cl8 N8 O8 -","4","0.5","BK0061","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z.","Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide","Acta Crystallographica Section B","1999","55","4","530","542","10.1107/S0108768199000348","","","0.71073","MoKα","","0.042","0.035","","0.085","0.08","","","","1.093","1.127","1.127","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2002934","7.0679","0.0006","11.7502","0.0009","9.0114","0.0007","90","","98.563","0.001","90","","740.05","0.1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5,6-dichlorobenzfurazan-1-oxide","","- C6 H2 Cl2 N2 O2 -","- C6 H2 Cl2 N2 O2 -","- C24 H8 Cl8 N8 O8 -","4","1","BK0061","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z.","Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide","Acta Crystallographica Section B","1999","55","4","530","542","10.1107/S0108768199000348","","","0.71073","MoKα","","0.043","0.038","","0.11","0.106","","","","1.044","1.093","1.093","","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:22",""
"2002935","7.1739","0.0002","11.8351","0.0002","9.0639","0.0001","90","","98.35","0.001","90","","761.4","0.03","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","5,6-dichlorobenzfurazan-1.oxide","","- C6 H2 Cl2 N2 O2 -","- C6 H2 Cl2 N2 O2 -","- C24 H8 Cl8 N8 O8 -","4","1","BK0061","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z.","Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide","Acta Crystallographica Section B","1999","55","4","530","542","10.1107/S0108768199000348","","","0.71073","MoKα","","0.041","0.036","","0.107","0.104","","","","1.731","1.844","1.844","","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:22",""
"2002936","7.2233","0.0001","9.0549","0.0003","11.57","0.0004","90","","95.315","0.002","90","","753.5","0.04","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5,6-dichlorobenzfurazan-1-oxide","","- C6 H2 Cl2 N2 O2 -","- C6 H2 Cl2 N2 O2 -","- C24 H8 Cl8 N8 O8 -","4","0.5","BK0061","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z.","Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide","Acta Crystallographica Section B","1999","55","4","530","542","10.1107/S0108768199000348","","","0.71073","MoKα","","0.03","0.027","","0.073","0.071","","","","1.116","1.151","1.151","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2002937","7.293","0.005","9.061","0.006","11.618","0.002","90","","96.12","0.03","90","","763.4","0.7","297","2","297","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","5,6-dichlorobenzfurazan-1-oxide'","","- C6 H2 Cl2 N2 O2 -","- C6 H2 Cl2 N2 O2 -","- C24 H8 Cl8 N8 O8 -","4","0.5","BK0061","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z.","Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide","Acta Crystallographica Section B","1999","55","4","530","542","10.1107/S0108768199000348","","","0.71073","MoKα","","0.069","0.038","","0.136","0.099","","","","0.825","0.806","0.806","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2002938","11.987","0.004","8.994","0.003","7.423","0.004","90","","92.91","0.04","90","","799.2","0.6","297","2","297","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","4,5-dichlorophthalic anhydride","","","- C8 H2 Cl2 O3 -","- C8 H2 Cl2 O3 -","- C32 H8 Cl8 O12 -","4","0.5","BK0061","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z.","Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide","Acta Crystallographica Section B","1999","55","4","530","542","10.1107/S0108768199000348","","","0.71073","MoKα","","0.033","0.029","","0.085","0.082","","","","1.063","1.088","1.088","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002939","12.923","0.003","9.209","0.002","7.628","0.0015","105.08","0.03","99.2","0.03","81.29","0.03","859.5","0.4","297","2","297","2","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","4,5-dibromophthalic anhydride","","","- C8 H2 Br2 O3 -","- C8 H2 Br2 O3 -","- C32 H8 Br8 O12 -","4","","BK0061","Ojala, Charles R.; Ojala, William H.; Britton, Doyle; Gougoutas, J. Z.","Packing similarities of three isosteric molecules: 4,5-dichlorophthalic anhydride, 4,5-dibromophthalic anhydride and 5,6-dichlorobenzfurazan 1-oxide, including three polymorphs of 5,6-dichlorobenzfurazan 1-oxide","Acta Crystallographica Section B","1999","55","4","530","542","10.1107/S0108768199000348","","","0.71073","MoKα","","0.099","0.05","","0.139","0.117","","","","1.028","1.12","1.12","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002940","10.76","0.001","7.74","0.001","27.145","0.003","90","","90","","90","","2260.7","0.4","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Potassium 3-benzoylthiophene-2-carboxylate","","- C12 H7 K O3 S -","- C12 H7 K O3 S -","- C96 H56 K8 O24 S8 -","8","1","BK0064","Craven, B. M.; Ballas, F. L.","Thermal vibrations in potassium 3-benzoyl-2-thiophenecarboxylate","Acta Crystallographica Section B","1999","55","3","375","379","10.1107/S0108768198012907","","","1.5418","CuKα","","0.034","0.032","","0.037","0.036","","","","2.486","2.561","2.561","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002942","7.85758","0.00003","7.86793","0.00003","7.8765","0.0003","90","","90","","90","","486.948","0.019","813","","","","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Na Nb O3 -","- Na Nb O3 -","- Na8 Nb8 O24 -","8","0.5","BM0015","Darlington, C. N. W.; Knight, K. S.","High-temperature phases of NaNbO~3~ and NaTaO~3~","Acta Crystallographica Section B","1999","55","1","24","30","10.1107/S010876819800963X","","neutron","","neutron","","","","","","","","","","","","","","","","","has coordinates","198388","2020-10-21","18:00:00",""
"2002943","7.83729","0.00004","7.84887","0.00004","7.85728","0.00004","90","","90","","90","","483.332","0.004","803","","","","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Na O3 Ta -","- Na O3 Ta -","- Na8 O24 Ta8 -","8","0.5","BM0015","Darlington, C. N. W.; Knight, K. S.","High-temperature phases of NaNbO~3~ and NaTaO~3~","Acta Crystallographica Section B","1999","55","1","24","30","10.1107/S010876819800963X","","neutron","","neutron","","","","","","","","","","","","","","","","","has coordinates","198486","2020-10-21","18:00:00",""
"2002944","5.56896","0.00002","5.56896","0.00002","3.94408","0.00002","90","","90","","90","","122.319","0.0009","888","","","","","","","","","","","3","P 4/m b m","-P 4 2ab","","","","","- Na Nb O3 -","- Na Nb O3 -","- Na2 Nb2 O6 -","2","0.125","BM0015","Darlington, C. N. W.; Knight, K. S.","High-temperature phases of NaNbO~3~ and NaTaO~3~","Acta Crystallographica Section B","1999","55","1","24","30","10.1107/S010876819800963X","","neutron","","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002945","5.55465","0.00002","5.55465","0.00002","3.93426","0.00002","90","","90","","90","","121.388","0.0009","878","","","","","","","","","","","3","P 4/m b m","-P 4 2ab","","","","","- Na O3 Ta -","- Na O3 Ta -","- Na2 O6 Ta2 -","2","0.125","BM0015","Darlington, C. N. W.; Knight, K. S.","High-temperature phases of NaNbO~3~ and NaTaO~3~","Acta Crystallographica Section B","1999","55","1","24","30","10.1107/S010876819800963X","","neutron","","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002946","14.417","0.001","12.02","0.001","12.042","0.001","119.99","0.007","105.991","0.007","87.224","0.01","1727.4","0.3","200","","200","","","","","","","","","3","P -1","-P 1","2","","4,5-dimethylpyrazole","","- C5 H8 N2 -","- C5 H8 N2 -","- C60 H96 N24 -","12","6","BM0017","Infantes, L.; Foces-Foces, C.; Elguero,J.","3(5),4-Dimethyl- and 3,4,5-trimethylpyrazole at 200K. X-ray crystallography and quantum-chemical analysis","Acta Crystallographica Section B","1999","55","3","441","447","10.1107/S0108768198014013","","","1.5418","CuKα","","0.087","0.075","","0.105","0.092","","","","0.856","0.848","0.848","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002947","14.1911","0.0009","8.252","0.0006","16.7382","0.0019","90","","90.696","0.009","90","","1960","0.3","200","","200","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","3,4,5-trimethylpyrazole","","- C6 H10 N2 -","- C6 H12 N2 -","- C72 H144 N24 -","12","1.5","BM0017","Infantes, L.; Foces-Foces, C.; Elguero,J.","3(5),4-Dimethyl- and 3,4,5-trimethylpyrazole at 200K. X-ray crystallography and quantum-chemical analysis","Acta Crystallographica Section B","1999","55","3","441","447","10.1107/S0108768198014013","","","1.5418","CuKα","","0.059","0.048","","0.063","0.054","","","","0.913","0.887","0.887","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2002948","9.179989","","9.179989","","9.179989","","90","","90","","90","","773.6","","","","","","","","","","","","","3","P 21 3","P 2ac 2ab 3","","","","","- O8 W2 Zr -","- O8 W2 Zr -","- O32 W8 Zr4 -","4","0.333333","","Evans, J. S. O.; David, W. I. F.; Sleight, A. W.","Structural investigation of the negative-thermal-expansion material ZrW~2~O~8~","Acta Crystallographica, Section B","1999","55","3","333","340","10.1107/S0108768198016966","","neutron","","neutron","","","","","","","","","","","","","","","","","has coordinates","188604","2020-10-21","18:00:00",""
"2002949","10.464","0.004","10.464","","15.056","0.004","90","","90","","120","","1427.7","0.7","294.2","0.2","294","2","","","","","","","","6","P 65 2 2","P 65 2 (0 0 1)","179","","","","- Co0.2 H2 Na O5 P Zn0.8 -","- Na O5 P Zn -","- Na12 O60 P12 Zn12 -","12","1","BM0019","Madeleine Helliwell","Determination of the site of incorporation of cobalt in CoZnPO-CZP by multiple-wavelength anomalous-dispersion crystallography","Acta Crystallographica Section B","1999","55","3","327","332","10.1107/S0108768198014414","","","1.5418","CuKα","","0.0607","0.0513","","","","0.1252","","","","","","1.081","","","","has coordinates","198601","2020-10-21","18:00:00",""
"2002953","9.0971","0.0006","9.0971","0.0006","9.0971","0.0006","90","","90","","90","","752.85","0.09","295","","295","","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- Co1.26 Fe2.74 La0.743 Sb12 -","- Co1.26 Fe2.74 La0.743 Sb12 -","- Co2.52 Fe5.48 La1.486 Sb24 -","2","0.0416667","BR0074","Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle","Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior","Acta Crystallographica Section B","1999","55","3","341","347","10.1107/S0108768198018345","","neutron","0.8387","neutron","","","0.045","","","0.035","","","","1.31","1.735","1.735","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002954","9.0854","0.0011","9.0854","0.0011","9.0854","0.0011","90","","90","","90","","749.95","0.16","200","","200","","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- Co1.26 Fe2.74 La0.743 Sb12 -","- Co1.256 Fe2.744 La0.743 Sb12 -","- Co2.512 Fe5.488 La1.486 Sb24 -","2","0.0416667","BR0074","Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle","Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior","Acta Crystallographica Section B","1999","55","3","341","347","10.1107/S0108768198018345","","neutron","0.8387","neutron","","","0.048","","","0.036","","","","1.34","1.805","1.805","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002955","9.0857","0.0011","9.0857","0.0011","9.0857","0.0011","90","","90","","90","","750.02","0.16","150","","150","","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- Co1.26 Fe2.74 La0.743 Sb12 -","- Co1.256 Fe2.744 La0.743 Sb12 -","- Co2.512 Fe5.488 La1.486 Sb24 -","2","0.0416667","BR0074","Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle","Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior","Acta Crystallographica Section B","1999","55","3","341","347","10.1107/S0108768198018345","","neutron","0.8387","neutron","","","0.045","","","0.036","","","","1.35","1.814","1.814","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002956","9.0813","0.0005","9.0813","0.0005","9.0813","0.0005","90","","90","","90","","748.93","0.07","125","","125","","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- Co1.26 Fe2.74 La0.743 Sb12 -","- Co1.256 Fe2.744 La0.743 Sb12 -","- Co2.512 Fe5.488 La1.486 Sb24 -","2","0.0416667","BR0074","Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle","Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior","Acta Crystallographica Section B","1999","55","3","341","347","10.1107/S0108768198018345","","neutron","0.8387","neutron","","","0.062","","","0.043","","","","1.26","1.578","1.578","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002957","9.0809","0.0004","9.0809","0.0004","9.0809","0.0004","90","","90","","90","","748.84","0.06","100","","100","","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- Co1.26 Fe2.74 La0.743 Sb12 -","- Co1.256 Fe2.744 La0.743 Sb12 -","- Co2.512 Fe5.488 La1.486 Sb24 -","2","0.0416667","BR0074","Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle","Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior","Acta Crystallographica Section B","1999","55","3","341","347","10.1107/S0108768198018345","","neutron","0.8387","neutron","","","0.041","","","0.031","","","","1.23","1.518","1.518","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002958","9.0814","0.0005","9.0814","0.0005","9.0814","0.0005","90","","90","","90","","748.96","0.07","75","","75","","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- Co1.26 Fe2.74 La0.743 Sb12 -","- Co1.256 Fe2.744 La0.743 Sb12 -","- Co2.512 Fe5.488 La1.486 Sb24 -","2","0.0416667","BR0074","Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle","Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior","Acta Crystallographica Section B","1999","55","3","341","347","10.1107/S0108768198018345","","neutron","0.8387","neutron","","","0.042","","","0.034","","","","1.36","1.846","1.846","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002959","9.0839","0.0006","9.0839","0.0006","9.0839","0.0006","90","","90","","90","","749.58","0.09","50","","50","","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- Co1.26 Fe2.74 La0.743 Sb12 -","- Co1.256 Fe2.744 La0.743 Sb12 -","- Co2.512 Fe5.488 La1.486 Sb24 -","2","0.0416667","BR0074","Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle","Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior","Acta Crystallographica Section B","1999","55","3","341","347","10.1107/S0108768198018345","","neutron","0.8387","neutron","","","0.039","","","0.031","","","","1.24","1.549","1.549","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002960","9.0771","0.0004","9.0771","0.0004","9.0771","0.0004","90","","90","","90","","747.9","0.06","25","","25","","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- Co1.26 Fe2.74 La0.743 Sb12 -","- Co1.256 Fe2.744 La0.743 Sb12 -","- Co2.512 Fe5.488 La1.486 Sb24 -","2","0.0416667","BR0074","Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle","Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior","Acta Crystallographica Section B","1999","55","3","341","347","10.1107/S0108768198018345","","neutron","0.8387","neutron","","","0.049","","","0.036","","","","1.39","1.932","1.932","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002961","9.0762","0.0012","9.0762","0.0012","9.0762","0.0012","90","","90","","90","","747.67","0.17","10","","10","","","","","","","","","4","I m -3","-I 2 2 3","204","","","","- Co1.26 Fe2.74 La0.743 Sb12 -","- Co1.256 Fe2.744 La0.743 Sb12 -","- Co2.512 Fe5.488 La1.486 Sb24 -","2","0.0416667","BR0074","Chakoumakos, Bryan C.; Sales, Brian C.; Mandrus, David; Keppens, Veerle","Disparate atomic displacements in skutterudite-type LaFe~3~CoSb~12~, a model for thermoelectric behavior","Acta Crystallographica Section B","1999","55","3","341","347","10.1107/S0108768198018345","","neutron","0.8387","neutron","","","0.037","","","0.029","","","","1.16","1.343","1.343","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002962","10.4232","0.0001","17.6675","0.0002","7.5363","0.0001","90","","90","","90","","1387.82","0.03","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","aminoguanidinium(2+) hexafluorosilicate","","- C H8 F6 N4 Si -","- C H8 F6 N4 Si -","- C8 H64 F48 N32 Si8 -","8","1","BR0080","Ross II, Charles R.; Bauer, M.R.; Nielson, R.M; Abrahams, S.C.","Anhydrous ammonioguanidinium(2+) and dihydrated bis[aminoguanidinium(1+)] hexafluorosilicates: new co-products of preparing ferroelectric ammonioguanidinium(2+) hexafluorozirconate","Acta Crystallographica Section B","1999","55","2","246","254","10.1107/S0108768198013044","","","1.5418","CuKα","","0.0268","0.0255","","","","0.0653","","","","","","1.146","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002963","6.5124","0.0001","6.6952","0.0002","8.0215","0.0003","70.723","0.002","82.745","0.002","89.243","0.003","327.348","0.017","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","diaminoguanidinium hexafluorosilicate dihydrate","","- C2 H18 F6 N8 O2 Si -","- C2 H18 F6 N8 O2 Si -","- C2 H18 F6 N8 O2 Si -","1","0.5","BR0080","Ross II, Charles R.; Bauer, M.R.; Nielson, R.M; Abrahams, S.C.","Anhydrous ammonioguanidinium(2+) and dihydrated bis[aminoguanidinium(1+)] hexafluorosilicates: new co-products of preparing ferroelectric ammonioguanidinium(2+) hexafluorozirconate","Acta Crystallographica Section B","1999","55","2","246","254","10.1107/S0108768198013044","","","1.5418","CuKα","","0.0305","0.0301","","","","0.0745","","","","","","1.065","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002964","19.769","0.009","7.685","0.002","8.858","0.003","90","","100.6","0.04","90","","1322.8","1.4","15","0.5","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- Cs3 H3.5 O12 P0.5 S2.5 -","- Cs3 H5 O12 P S2 -","- Cs12 H20 O48 P4 S8 -","4","0.5","","Haile, S. M.; Klooster, W. T.","Single-crystal neutron diffraction study of β-Cs~3~(HSO~4~)~2~[H~2-x~(S~x~P~1-x~)O~4~] (x ≃ 0.5) at 15 K","Acta Crystallographica, Section B: Structural Science","1999","55","3","285","296","10.1107/s0108768198013573","","neutron","1.0462","Neutron","","0.111","","","0.084","","0.038","","","1.3","","","","","","","has coordinates","297159","2025-01-07","06:57:16",""
"2002965","19.769","0.009","7.685","0.002","8.858","0.003","90","","100.6","0.04","90","","1322.8","1.4","15","0.5","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- Cs3 H3.5 O12 P0.5 S2.5 -","- Cs3 H3.5 O12 P S2 -","- Cs12 H14 O48 P4 S8 -","4","0.5","","Haile, S. M.; Klooster, W. T.","Single-crystal neutron diffraction study of β-Cs~3~(HSO~4~)~2~[H~2-x~(S~x~P~1-x~)O~4~] (x ≃ 0.5) at 15 K","Acta Crystallographica, Section B: Structural Science","1999","55","3","285","296","10.1107/s0108768198013573","","neutron","1.0462","Neutron","","0.108","","","0.081","","0.036","","","1.25","","","","","","","has coordinates","297159","2025-01-07","06:57:19",""
"2002966","4.547","0.002","5.947","0.003","14.731","0.009","90","","90","","90","","398.3","0.4","143","1","143","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-trifluoromethyl formamide","","- C2 H2 F3 N O -","- C2 H2 F3 N O -","- C8 H8 F12 N4 O4 -","4","1","CA0001","Perpetuo, Genivaldo; Buschmann, Jürgen; Luger, Peter; Lentz, Dieter; Dreissig, D.","Low-temperature crystallization and structure determination of <i>N</i>-(trifluoromethyl)formamide, <i>N</i>-(2,2,2-trifluoroethyl)formamide and 2,2,2-trifluoroethyl isocyanide","Acta Crystallographica Section B","1999","55","1","70","77","10.1107/S0108768198006570","","","0.71068","MoKα","","0.123","0.0696","","0.2259","0.1708","","","","1.105","1.105","1.105","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002967","4.807","0.001","16.707","0.003","6.708","0.001","90","","109.9","0.01","90","","506.55","0.16","141","1","141","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C3 H4 F3 N O -","- C3 H4 F3 N O -","- C12 H16 F12 N4 O4 -","4","1","CA0001","Perpetuo, Genivaldo; Buschmann, Jürgen; Luger, Peter; Lentz, Dieter; Dreissig, D.","Low-temperature crystallization and structure determination of <i>N</i>-(trifluoromethyl)formamide, <i>N</i>-(2,2,2-trifluoroethyl)formamide and 2,2,2-trifluoroethyl isocyanide","Acta Crystallographica Section B","1999","55","1","70","77","10.1107/S0108768198006570","","","0.71068","MoKα","","0.0783","0.0508","","0.1402","0.1619","","","","1.085","1.085","1.085","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002968","5.668","0.002","9.266","0.003","8.626","0.002","90","","90","","90","","453","0.2","163","1","163","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,2,2-trifluoroethyl isocyanide","","- C3 H2 F3 N -","- C3 H2 F3 N -","- C12 H8 F12 N4 -","4","1","CA0001","Perpetuo, Genivaldo; Buschmann, Jürgen; Luger, Peter; Lentz, Dieter; Dreissig, D.","Low-temperature crystallization and structure determination of <i>N</i>-(trifluoromethyl)formamide, <i>N</i>-(2,2,2-trifluoroethyl)formamide and 2,2,2-trifluoroethyl isocyanide","Acta Crystallographica Section B","1999","55","1","70","77","10.1107/S0108768198006570","","","0.71068","MoKα","","0.0627","0.0329","","0.0976","0.0839","","","","1.008","1.044","1.044","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002971","8.3506","0.0009","18.0102","0.0017","9.636","0.0014","90","","110.869","0.008","90","","1354.1","0.3","294","1","294","1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","4,4'-Sulfonyldiphenol-pyrazine (2/1)","","- C28 H24 N2 O8 S2 -","- C28 H24 N2 O8 S2 -","- C56 H48 N4 O16 S4 -","2","0.5","CF0004","Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S.","Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1)","Acta Crystallographica, Section B: Structural Science","1999","55","4","573","590","10.1107/S0108768199002645","","","0.7107","MoKα","","0.0489","0.0356","","","","0.0966","","","","","","1.035","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002972","7.5765","0.001","23.9154","0.001","11.225","0.002","90","","105.921","0.01","90","","1955.9","0.5","294","1","294","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,4'-Sulfonyldiphenol-4,4'-bipyridyl (1/1)","","- C22 H18 N2 O4 S -","- C22 H18 N2 O4 S -","- C88 H72 N8 O16 S4 -","4","1","CF0004","Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S.","Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1)","Acta Crystallographica, Section B: Structural Science","1999","55","4","573","590","10.1107/S0108768199002645","","","0.7107","MoKα","","0.0667","0.0392","","","","0.0984","","","","","","1.053","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002973","7.3981","0.0008","12.7472","0.0015","13.0006","0.0013","115.037","0.008","102.398","0.01","94.239","0.01","1065.9","0.2","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","4,4'-Sulphonyldiphenol - trans-1,2-bis(4-pyridyl)ethylene (1/1)","","- C24 H20 N2 O4 S -","- C24 H20 N2 O4 S -","- C48 H40 N4 O8 S2 -","2","1","CF0004","Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S.","Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1)","Acta Crystallographica, Section B: Structural Science","1999","55","4","573","590","10.1107/S0108768199002645","","","0.7107","MoKα","","0.0509","0.0357","","","","0.1002","","","","","","0.98","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:22",""
"2002974","7.7599","0.0009","12.4866","0.0016","12.914","0.002","114.003","0.014","104.694","0.014","93.69","0.013","1085.6","0.3","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","4,4'Sulfonyldiphenol–1,2-bis(4-pyridyl)ethane (1/1)","","- C24 H22 N2 O4 S -","- C24 H22 N2 O4 S -","- C48 H44 N4 O8 S2 -","2","1","CF0004","Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S.","Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1)","Acta Crystallographica, Section B: Structural Science","1999","55","4","573","590","10.1107/S0108768199002645","","","0.7107","MoKα","","0.0558","0.0418","","","","0.1225","","","","","","1.072","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002975","10.0292","0.001","15.579","0.002","15.0208","0.001","90","","105.47","0.001","90","","2261.9","0.4","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4'-Sulfonyldiphenol–4,4'-trimethylenedipyridine (1/1)","","- C25 H24 N2 O4 S -","- C25 H24 N2 O4 S -","- C100 H96 N8 O16 S4 -","4","1","CF0004","Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S.","Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1)","Acta Crystallographica, Section B: Structural Science","1999","55","4","573","590","10.1107/S0108768199002645","","","0.7107","MoKα","","0.0692","0.0405","","","","0.1151","","","","","","1.039","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002976","12.2739","0.001","19.454","0.002","20.6251","0.0013","90","","90","","90","","4924.8","0.7","294","1","294","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4,4'-Sulfonyldiphenol-4,4'-trimethylenedipiperidine-water (2/2/1)","","- C25 H37 N2 O4.5 S -","- C25 H37 N2 O4.5 S -","- C200 H296 N16 O36 S8 -","8","2","CF0004","Ferguson, George; Glidewell, Christopher; Gregson, Richard M.; Lavender, Emma S.","Crystal engineering using bisphenols: interwoven ladders, sheet and framework structures in the binary adducts of 4,4'-sulfonyldiphenol with pyrazine (2/1), 4,4'-bipyridyl (1/1), <i>trans</i>-1,2-bis(4-pyridyl)ethene (1/1), 1,2-bis(4-pyridyl)ethane (1/1) and 4,4'-trimethylenedipyridine (1/1), and in 4,4'-sulfonyldiphenol–4,4'-trimethylenedipiperidine–water (2/2/1)","Acta Crystallographica, Section B: Structural Science","1999","55","4","573","590","10.1107/S0108768199002645","","","0.7107","MoKα","","0.0769","0.0416","","","","0.1031","","","","","","1.031","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002977","13.0288","0.0017","12.1865","0.001","12.0778","0.0012","90","","105.199","0.009","90","","1850.6","0.3","294","1","294","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,4'-Biphenol–1,10-phenanthroline (1/1)","","- C24 H18 N2 O2 -","- C24 H18 N2 O2 -","- C96 H72 N8 O8 -","4","0.5","CF0005","Ferguson, George; Glidewell, Christopher; Lavender, Emma S.","Crystal engineering using bisphenols and trisphenols. Complexes with 1,10-phenanthroline: hydrogen-bonded chains in adducts with 4,4'-biphenol (1/1) and 4,4'-sulfonyldiphenol (2/3), π–π stacked chains in the (1/2) adduct with 4,4'-thiodiphenol, and pairwise-interwoven nets in 1,1,1-tris(4-hydroxyphenyl)ethane–1,10-phenanthroline–methanol (1/1/1)","Acta Crystallographica Section B","1999","55","4","591","600","10.1107/S0108768199002657","","","0.7107","MolybdenumKα","","0.0878","0.0334","","","","0.0989","","","","","","0.976","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002978","7.7342","0.0005","13.3624","0.0014","14.9843","0.0011","110.514","0.006","95.195","0.006","95.895","0.007","1429.3","0.2","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","4,4'-Thiodiphenol–1,10-phenanthroline (1/2)","","- C36 H26 N4 O2 S -","- C36 H26 N4 O2 S -","- C72 H52 N8 O4 S2 -","2","1","CF0005","Ferguson, George; Glidewell, Christopher; Lavender, Emma S.","Crystal engineering using bisphenols and trisphenols. Complexes with 1,10-phenanthroline: hydrogen-bonded chains in adducts with 4,4'-biphenol (1/1) and 4,4'-sulfonyldiphenol (2/3), π–π stacked chains in the (1/2) adduct with 4,4'-thiodiphenol, and pairwise-interwoven nets in 1,1,1-tris(4-hydroxyphenyl)ethane–1,10-phenanthroline–methanol (1/1/1)","Acta Crystallographica Section B","1999","55","4","591","600","10.1107/S0108768199002657","","","0.7107","MolybdenumKα","","0.0648","0.0351","","","","0.1004","","","","","","1.035","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002979","15.8692","0.0016","24.3728","0.0017","13.0952","0.0009","90","","102.362","0.008","90","","4947.5","0.7","294","1","294","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4,4'-Sulfonyldiphenol–1,10-phenanthroline (2/3)","","- C60 H44 N6 O8 S2 -","- C60 H44 N6 O8 S2 -","- C240 H176 N24 O32 S8 -","4","0.5","CF0005","Ferguson, George; Glidewell, Christopher; Lavender, Emma S.","Crystal engineering using bisphenols and trisphenols. Complexes with 1,10-phenanthroline: hydrogen-bonded chains in adducts with 4,4'-biphenol (1/1) and 4,4'-sulfonyldiphenol (2/3), π–π stacked chains in the (1/2) adduct with 4,4'-thiodiphenol, and pairwise-interwoven nets in 1,1,1-tris(4-hydroxyphenyl)ethane–1,10-phenanthroline–methanol (1/1/1)","Acta Crystallographica Section B","1999","55","4","591","600","10.1107/S0108768199002657","","","0.7107","MolybdenumKα","","0.0638","0.0408","","","","0.104","","","","","","1.034","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002980","22.811","0.003","22.029","0.003","10.7965","0.001","90","","90","","90","","5425.3","1.1","294","1","294","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1,1,1-Tris(4-hydroxyphenyl)ethane‒1,10-phenanthroline‒methanol (1/1/1)","","- C33 H30 N2 O4 -","- C33 H30 N2 O4 -","- C264 H240 N16 O32 -","8","1","CF0005","Ferguson, George; Glidewell, Christopher; Lavender, Emma S.","Crystal engineering using bisphenols and trisphenols. Complexes with 1,10-phenanthroline: hydrogen-bonded chains in adducts with 4,4'-biphenol (1/1) and 4,4'-sulfonyldiphenol (2/3), π‒π stacked chains in the (1/2) adduct with 4,4'-thiodiphenol, and pairwise-interwoven nets in 1,1,1-tris(4-hydroxyphenyl)ethane‒1,10-phenanthroline‒methanol (1/1/1)","Acta Crystallographica Section B","1999","55","4","591","600","10.1107/S0108768199002657","","","0.7107","MolybdenumKα","","0.1305","0.0388","","","","0.1075","","","","","","0.874","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2002981","7.301","0.001","7.658","0.002","13.855","0.003","90","","90","","90","","774.6","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(R,R)-Tartaric Acid Mono (N-Methylamide) Monohydrate","(R,R)-Tartaric Acid Mono (N-Methylamide) Monohydrate","","- C5 H11 N O6 -","- C5 H11 N O6 -","- C20 H44 N4 O24 -","4","1","CF0006","Rychlewska, Urszula; Szarecka, Agnieszka; Rychlewski, Jacek; Motała, Rafał","A mediated hydrogen bond in an α-hydroxycarboxyl group: X-ray structure of (<i>R</i>,<i>R</i>)-<i>N</i>-methyltartramic acid monohydrate and an <i>ab initio</i> study of model systems","Acta Crystallographica Section B","1999","55","4","617","625","10.1107/S0108768199005091","","","0.71073","MoKα","","0.0587","0.031","","0.0839","0.0737","","","","1.065","1.063","1.063","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002984","7.3091","0.0006","7.3091","0.0006","7.3091","0.0006","90","0.007","90","0.007","90","0.007","390.47","0.06","293","","293","","","","","","","","","2","F d -3 m :2","-F 4vw 2vw 3","227","cubic_Laves","","","- Fe2 Ho -","- Fe2 Ho -","- Fe16 Ho8 -","8","0.0416667","CR0535","Streltsov V. A.","Synchrotron X-ray analysis of the electron density in HoFe~2~","Acta Crystallographica Section B","1999","55","3","321","326","10.1107/S0108768198016759","","","0.75","xray_vertical_wiggler","","0.00956","0.00956","","0.01098","0.01098","","","","1.403","1.403","1.403","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002986","23.048","0.007","34.383","0.006","11.992","0.006","90","","90","","90","","9503","6","175","","175","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","D20P","1:1 complex of (R)-2,3:4,5-bis[1,2-(3-phenylnaphtho)]-1,6,9,12,15,18-hexaoxacycloeicosa-2,4- diene with phenylglycinium methyl ester perchlorate","","- C51 H52 Cl N O13 -","- C51 H52 Cl N O13 -","- C408 H416 Cl8 N8 O104 -","8","2","FR0005","Cram, Donald J.; de Graaff, R. A. G.; Knobler, Carolyn B.; Lingenfelter, David S.; Maverick, Emily F.; Trueblood, Kenneth N.","Chiral recognition between host and guest: a binaphthyl-18-crown-6 host with <small>D</small>-phenylglycinium methyl ester perchlorate guest. A difficult structure solved with <i>CRUNCH</i>","Acta Crystallographica Section B","1999","55","3","432","440","10.1107/S0108768198013524","","","1.5418","CuKα","","0.0896","0.0793","","0.2247","0.2112","","","","1.003","1.01","1.01","","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2002990","9.369","0.002","5.563","0.001","13.626","0.003","90","","92.36","0.03","90","","709.6","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2-methyl-5-nitroaniline","","- C7 H8 N2 O2 -","- C7 H8 N2 O2 -","- C28 H32 N8 O8 -","4","1","HA0171","Ellena, Javier; Goeta, Andrés E.; Howard, Judith A. K.; Wilson, Chick C.; Autino, Juan C.; Punte, Graciela","Experimental evidence for the amino-group non-planarity in nitroanilines: neutron diffraction study of 2-methyl-5-nitroaniline at 100 K","Acta Crystallographica, Section B: Structural Science","1999","55","2","209","215","10.1107/S0108768198010349","","neutron","","neutron","","0.0669","0.0669","","0.1544","0.1544","","","","1.137","1.137","1.137","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2002991","5.289","0.0001","12.6877","0.0001","11.4872","0.0001","90","","95.8136","0.0005","90","","766.887","0.017","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-leucyl-L-valine methanol (1:1)","","- C12 H26 N2 O4 -","- C12 H26 N2 O4 -","- C24 H52 N4 O8 -","2","1","HA0173","Görbitz, Carl Henrik; Torgersen, Eirin","Symmetry, pseudosymmetry and packing disorder in the alcohol solvates of <small>L</small>-leucyl-<small>L</small>-valine","Acta Crystallographica, Section B: Structural Science","1999","55","1","104","113","10.1107/S0108768198010192","","","0.71073","MoKα","","0.1003","0.0656","","0.179","0.1584","","","","0.985","1.064","1.064","","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:22",""
"2002992","11.0112","0.0001","23.5186","0.0001","12.2636","0.0001","90","","90.0121","0.0008","90","","3175.88","0.04","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-leucyl-L-valine ethanol (1:1)","","- C13 H28 N2 O4 -","- C13 H28 N2 O4 -","- C104 H224 N16 O32 -","8","4","HA0173","Görbitz, Carl Henrik; Torgersen, Eirin","Symmetry, pseudosymmetry and packing disorder in the alcohol solvates of <small>L</small>-leucyl-<small>L</small>-valine","Acta Crystallographica, Section B: Structural Science","1999","55","1","104","113","10.1107/S0108768198010192","","","0.71073","MoKα","","0.1004","0.0645","","0.1441","0.1249","","","","1.072","1.088","1.088","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:22",""
"2002993","5.1709","0.0001","14.6136","0.0002","22.423","0.0004","90","","90","","90","","1694.4","0.05","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-leucyl-L-valine 2-propanol (1:1)","","- C14 H30 N2 O4 -","- C14 H30 N2 O4 -","- C56 H120 N8 O16 -","4","1","HA0173","Görbitz, Carl Henrik; Torgersen, Eirin","Symmetry, pseudosymmetry and packing disorder in the alcohol solvates of <small>L</small>-leucyl-<small>L</small>-valine","Acta Crystallographica, Section B: Structural Science","1999","55","1","104","113","10.1107/S0108768198010192","","","0.71073","MoKα","","0.0796","0.0559","","0.1358","0.1225","","","","1.106","1.14","1.14","","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:22",""
"2002994","6.585","","9.038","","15.205","","94.9","","95.74","","110","","839.138","","200","2","200","2","","","","","","","","4","P -1","-P 1","2","beta-co-(BEDT-TTF)2I3","beta-co-(bis(ethylenedithio)tetrathiafulvalene)2 triiodide","","- C10 H8 I1.5 S8 -","- C10 H8 I1.479 S8 -","- C20 H16 I2.958 S16 -","2","1","HA0183","Madsen, Dennis; Burghammer, Manfred; Fiedler, Stefan; Muller, Harald","The single-crystal structure of the organic superconductor β~CO~-(BEDT-TTF)~2~I~3~ from a powder grain","Acta Crystallographica Section B","1999","55","4","601","606","10.1107/S0108768199003468","","","0.6887","Synchrotron","","0.0462","0.0371","","","","0.0812","","","","","","1.076","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2003000","8.075","0.002","8.871","0.002","11.606","0.002","72.69","0.03","80.07","0.03","71.84","0.03","751.3","0.3","153","2","153","2","","","","","","","","3","P 1","P 1","1","Emycin_E","","","- C19 H18 O4 -","- C19 H18 O4 -","- C38 H36 O8 -","2","2","JZ0006","Walker, Martina; Pohl, Ehmke; Herbst-Irmer, Regine; Gerlitz, Martin; Rohr, Jürgen; Sheldrick, George M.","Absolute configurations of Emycin D, E and F; mimicry of centrosymmetric space groups by mixtures of chiral stereoisomers","Acta Crystallographica Section B","1999","55","4","607","616","10.1107/S0108768199003948","","","0.71073","MoKα","","0.0779","0.0526","","","","0.1178","","","","","","1.033","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003001","7.796","0.002","7.914","0.002","22.243","0.002","90","","92.12","0.02","90","","1371.4","0.5","153","2","153","2","","","","","","","","4","P 1 21 1","P 2yb","4","Di-o-brominebenzoyl-Emycin_F","","","- C33 H24 Br2 O6 -","- C33 H24 Br2 O6 -","- C66 H48 Br4 O12 -","2","1","JZ0006","Walker, Martina; Pohl, Ehmke; Herbst-Irmer, Regine; Gerlitz, Martin; Rohr, Jürgen; Sheldrick, George M.","Absolute configurations of Emycin D, E and F; mimicry of centrosymmetric space groups by mixtures of chiral stereoisomers","Acta Crystallographica Section B","1999","55","4","607","616","10.1107/S0108768199003948","","","0.71073","MoKα","","0.0552","0.0418","","","","0.0966","","","","","","1.029","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003002","8.279","0.002","11.539","0.003","11.962","0.003","101.32","0.02","110.25","0.02","92.76","0.02","1042.9","0.5","153","2","153","2","","","","","","","","4","P 1","P 1","1","O-brominebenzoyl-Emycin_D","","","- C26 H19 Br O5 -","- C26 H19 Br O5 -","- C52 H38 Br2 O10 -","2","2","JZ0006","Walker, Martina; Pohl, Ehmke; Herbst-Irmer, Regine; Gerlitz, Martin; Rohr, Jürgen; Sheldrick, George M.","Absolute configurations of Emycin D, E and F; mimicry of centrosymmetric space groups by mixtures of chiral stereoisomers","Acta Crystallographica Section B","1999","55","4","607","616","10.1107/S0108768199003948","","","0.71073","MoKα","","0.0334","0.0307","","","","0.0892","","","","","","1.298","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003008","10.386","0.001","10.386","0.001","11.742","0.002","90","","90","","90","","1266.6","0.4","","","9","1","","","","","","","","5","P 42 21 2","P 4n 2n","","","","","- C8 H24 P4 S8 Th -","- C8 H24 P4 S8 Th -","- C16 H48 P8 S16 Th2 -","2","0.25","","Iversen, B. B.; Larsen, F. K.; Pinkerton, A. A.; Martin, A.; Darovsky, A.; Reynolds, P. A.","Accurate charge densities in days ‒ use of synchrotrons, image plates and very low temperatures","Acta Crystallographica, Section B: Structural Science","1999","55","3","363","374","10.1107/s0108768198010398","","","0.5603","AgKα","","","","","","","","","","","","","","","","","has coordinates","249482","2020-10-21","18:00:00",""
"2003009","10.42","0.004","10.42","0.004","11.784","0.008","90","","90","","90","","1279","1","","","28","5","","","","","","","","5","P 42 21 2","P 4n 2n","","","","","- C8 H24 P4 S8 Th -","- C8 H24 P4 S8 Th -","- C16 H48 P8 S16 Th2 -","2","0.25","","Iversen, B. B.; Larsen, F. K.; Pinkerton, A. A.; Martin, A.; Darovsky, A.; Reynolds, P. A.","Accurate charge densities in days ‒ use of synchrotrons, image plates and very low temperatures","Acta Crystallographica, Section B: Structural Science","1999","55","3","363","374","10.1107/s0108768198010398","","","0.394","Synchrotron","","","","","","","","","","","","","","","","","has coordinates","249482","2020-10-21","18:00:00",""
"2003010","10.42","0.004","10.42","0.004","11.784","0.008","90","","90","","90","","1279","1","","","28","5","","","","","","","","5","P 42 21 2","P 4n 2n","","","","","- C8 H24 P4 S8 Th -","- C8 H24 P4 S8 Th -","- C16 H48 P8 S16 Th2 -","2","0.25","","Iversen, B. B.; Larsen, F. K.; Pinkerton, A. A.; Martin, A.; Darovsky, A.; Reynolds, P. A.","Accurate charge densities in days ‒ use of synchrotrons, image plates and very low temperatures","Acta Crystallographica, Section B: Structural Science","1999","55","3","363","374","10.1107/s0108768198010398","","","0.394","Synchrotron","","","","","","","","","","","","","","","","","has coordinates","249482","2020-10-21","18:00:00",""
"2003011","10.386","0.001","10.386","0.001","11.742","0.002","90","","90","","90","","1266.6","0.4","","","","","","","","","","","","5","P 42 21 2","P 4n 2n","","","","","- C8 H24 P4 S8 Th -","- C8 H24 P4 S8 Th -","- C16 H48 P8 S16 Th2 -","2","0.25","","Iversen, B. B.; Larsen, F. K.; Pinkerton, A. A.; Martin, A.; Darovsky, A.; Reynolds, P. A.","Accurate charge densities in days ‒ use of synchrotrons, image plates and very low temperatures","Acta Crystallographica, Section B: Structural Science","1999","55","3","363","374","10.1107/s0108768198010398","","","0.5603","AgKα","","","","","","","","","","","","","","","","","has coordinates","249482","2020-10-21","18:00:00",""
"2003012","12.646","0.001","12.646","0.001","3.9551","0.0002","90","","90","","90","","632.5","","790","","","","","","","","","","","4","P 4/m b m","-P 4 2ab","127","","","","- K Nb5 O15 Pb2 -","- K Nb5 O15 Pb3.1 -","- K2 Nb10 O30 Pb6.2 -","2","0.125","","Sciau, Philippe; Calvarin, Gilbert; Ravez, Jean","Structures des phases paraélectrique et ferroélectrique de Pb~2~KNb~5~O~15~","Acta Crystallographica Section B","1999","55","4","459","466","10.1107/S0108768198017984","","","1.39217","CuKβ","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003013","12.646","0.001","12.646","0.001","3.9551","0.0002","90","","90","","90","","632.5","","790","","","","","","","","","","","4","P 4/m b m","-P 4 2ab","127","","","","- K Nb5 O15 Pb2 -","- K Nb5 O15 Pb3.1 -","- K2 Nb10 O30 Pb6.2 -","2","0.125","","Sciau, Philippe; Calvarin, Gilbert; Ravez, Jean","Structures des phases paraélectrique et ferroélectrique de Pb~2~KNb~5~O~15~","Acta Crystallographica Section B","1999","55","4","459","466","10.1107/S0108768198017984","","neutron","1.985","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003014","17.779","0.002","18.015","0.002","3.9209","0.0004","90","","90","","90","","1255.82","","294","","","","","","","","","","","4","C m 2 m","C -2 -2","38","","","","- K Nb5 O15 Pb2 -","- K2 Nb5 O15 Pb4 -","- K8 Nb20 O60 Pb16 -","4","0.5","","Sciau, Philippe; Calvarin, Gilbert; Ravez, Jean","Structures des phases paraélectrique et ferroélectrique de Pb~2~KNb~5~O~15~","Acta Crystallographica Section B","1999","55","4","459","466","10.1107/S0108768198017984","","neutron","1.985","neutron","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003015","17.756","0.001","18.019","0.001","3.9141","0.0002","90","","90","","90","","1252.3","","81","","","","","","","","","","","4","C m 2 m","C -2 -2","38","","","","- K Nb5 O15 Pb2 -","- K2 Nb5 O15 Pb4 -","- K8 Nb20 O60 Pb16 -","4","0.5","","Sciau, Philippe; Calvarin, Gilbert; Ravez, Jean","Structures des phases paraélectrique et ferroélectrique de Pb~2~KNb~5~O~15~","Acta Crystallographica Section B","1999","55","4","459","466","10.1107/S0108768198017984","","","1.39217","CuKβ","","","","","","","","","","","","","","","","","has coordinates","277834","2022-09-14","16:39:43",""
"2003030","4.0246","0.0005","15.5147","0.0005","9.1453","0.0009","90","","101.23","0.01","90","","560.1","0.09","295","3","295","3","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","5,10-dimethyl-4,9-diazapyrene","","- C16 H12 N2 -","- C16 H12 N2 -","- C32 H24 N4 -","2","0.5","NA0085","Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Piantanida, Ivo","Crystal and molecular structures of diazapyrenes and a study of π···π interactions","Acta Crystallographica Section B","1999","55","1","55","69","10.1107/S0108768198006557","","","1.54184","CuKα","","0.2272","0.0425","","0.4272","0.1281","","","","0.629","0.66","0.66","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003031","12.4968","0.0003","11.4751","0.0004","3.9615","0.0003","90","","96.8","0.01","90","","564.09","0.05","295","2","295","3","","","","","","","","3","C 1 2/m 1","-C 2y","12","","2,7-dimethyl-4,9-diazapyrene","","- C16 H12 N2 -","- C13 H11 N2 -","- C26 H22 N4 -","2","0.25","NA0085","Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Piantanida, Ivo","Crystal and molecular structures of diazapyrenes and a study of π···π interactions","Acta Crystallographica Section B","1999","55","1","55","69","10.1107/S0108768198006557","","","1.54184","CuKα","","0.061","0.0405","","0.138","0.1237","","","","0.896","1.055","1.055","","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2003033","5.4514","0.0008","11.945","0.001","40.482","0.003","84.662","0.007","86.97","0.01","79.77","0.01","2581.1","0.5","243","","243","","","","","","","","","3","P -1","-P 1","2","tripalmitin","1,2,3-trihexadecanoyl-glycerol","","- C51 H98 O6 -","- C51 H98 O6 -","- C102 H196 O12 -","2","1","NA0087","A.J. van Langevelde","Structure of mono-acid even-numbered β-triacylglycerols","Acta Crystallographica Section B","1999","55","1","114","122","10.1107/S0108768198009392","","","1.5418","CuKα","","0.153","0.078","","0.1","0.071","","","","0.695","0.803","0.803","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003051","3.877","0.004","15.6","0.01","9.375","0.006","90","","98.45","0.07","90","","560.9","0.8","150","","150","","","","","","","","","4","P 1 21/c 1","","","nicotinamide","","","- C6 H6 N2 O -","- C3 H3 N O0.5 -","- C12 H12 N4 O2 -","4","1","OA0014","Yoshihisa Miwa; Takashi Mizuno; Kazunori Tsuchida; Tooru Taga; Yutaka Iwata","Experimental charge density and electrostatic potential in nicotinamide","Acta Crystallographica Section B","1999","55","1","78","84","10.1107/S0108768198007848","","","0.71073","MoKα","","","0.054","","","0.056","","","","","0.29","0.29","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2003052","3.975","0.005","15.632","0.008","9.422","0.004","90","","99.03","0.07","90","","578.2","","295","","295","","","","","","","","","4","P 1 21/c 1","","","nicotinamide","","","- C6 H6 N2 O -","- C3 H3 N O0.5 -","- C12 H12 N4 O2 -","4","1","","Yoshihisa Miwa; Takashi Mizuno; Kazunori Tsuchida; Tooru Taga; Yutaka Iwata","Experimental Charge Density and Electrostatic Potential in Nicotinamide","Acta Crystallographica, Section B","1999","55","","78","84","","","","0.71073","MoKα","","","0.057","","","0.066","","","","","0.4","0.4","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003053","3.975","0.005","15.632","0.008","9.422","0.004","90","","99.03","0.07","90","","578.2","","295","","295","","","","","","","","","4","P 1 21/c 1","","","nicotinamide","","","- C6 H6 N2 O -","- C3 H3 N O0.5 -","- C12 H12 N4 O2 -","4","1","","Yoshihisa Miwa; Takashi Mizuno; Kazunori Tsuchida; Tooru Taga; Yutaka Iwata","Experimental Charge Density and Electrostatic Potential in Nicotinamide","Acta Crystallographica, Section B","1999","55","","78","84","","","neutron","1.005","neutron","","","0.06","","","0.068","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003054","10.125","0.003","11.133","0.002","15.014","0.002","73.78","0.01","71.68","0.01","68.87","0.02","1472","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H40 Co K N12 O4 -","- C18 H40 Co K N12 O4 -","- C36 H80 Co2 K2 N24 O8 -","2","1","OA0016","Steve C.F. Au-Yeung","Crystal structures of [18]aneN~6~H~2~K[Co(CN)~6~].4H~2~O, [16]aneN~4~H~2~K[Co(CN)~6~] and [12]aneN~4~H~3~[Co(CN)~6~].2H~2~O. Insight into the electrostatic and hydrogen-bonding interaction in self-assembling supercomplexes","Acta Crystallographica Section B","1999","55","3","389","395","10.1107/S0108768198014281","","","0.71073","MoKα","","0.0964","0.0592","","0.0745","0.0667","","","","","1.38","1.38","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003055","10.675","0.002","10.516","0.002","21.051","0.004","90","","91.89","0.03","90","","2361.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H30 Co K N10 -","- C18 H30 Co K N10 -","- C72 H120 Co4 K4 N40 -","4","1","OA0016","Steve C.F. Au-Yeung","Crystal structures of [18]aneN~6~H~2~K[Co(CN)~6~].4H~2~O, [16]aneN~4~H~2~K[Co(CN)~6~] and [12]aneN~4~H~3~[Co(CN)~6~].2H~2~O. Insight into the electrostatic and hydrogen-bonding interaction in self-assembling supercomplexes","Acta Crystallographica Section B","1999","55","3","389","395","10.1107/S0108768198014281","","","0.71073","MoKα","","0.107","0.0489","","0.0625","0.0582","","","","","1.62","1.62","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003056","7.635","0.002","8.202","0.005","9.442","0.003","109.08","0.01","103.46","0.01","107.03","0.01","497.7","0.4","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C14 H27 Co N10 O2 -","- C14 H22 Co N10 O2 -","- C14 H22 Co N10 O2 -","1","1","OA0016","Steve C.F. Au-Yeung","Crystal structures of [18]aneN~6~H~2~K[Co(CN)~6~].4H~2~O, [16]aneN~4~H~2~K[Co(CN)~6~] and [12]aneN~4~H~3~[Co(CN)~6~].2H~2~O. Insight into the electrostatic and hydrogen-bonding interaction in self-assembling supercomplexes","Acta Crystallographica Section B","1999","55","3","389","395","10.1107/S0108768198014281","","","0.71073","MoKα","","0.0802","0.0614","","0.082","0.0741","","","","","1.37","1.37","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003057","8.507","0.003","10.613","0.004","12.457","0.003","80.05","0.03","71.38","0.02","76.69","0.03","1031.2","0.6","295","","295","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H21 O6 P -","- C26 H24 O6 P -","- C52 H48 O12 P2 -","2","1","OA0018","Cho, Ching-Sheng; Dr Liau, Wen-Bin; Dr Chen, Leo-Wang","Single-crystal structure analysis of a novel aryl phosphinate diglycidyl ether","Acta Crystallographica Section B","1999","55","4","525","529","10.1107/S010876819900018X","","","0.71073","MolybdenumKα","","0.063","0.063","","0.057","0.057","","","","","1.48","1.48","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003058","20.0097","0.0013","15.249","0.002","10.4168","0.0018","90","","90","","90","","3178.5","0.7","296","2","296","","","","","","","","","5","P b c a","-P 2ac 2ab","61","F-TEMPO","4-(4-fluorophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C16 H22 F N2 O -","- C16 H22 F N2 O -","- C128 H176 F8 N16 O8 -","8","1","OA0019","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds","Acta Crystallographica, Section B: Structural Science","1999","55","2","231","245","10.1107/S0108768198012786","","","0.71073","MoKα","","0.103","0.0425","","","","0.1397","","","","","","0.989","","","","has coordinates,has Fobs","208977","2020-10-21","18:00:00",""
"2003059","10.98","0.004","38.914","0.004","8.358","0.004","90","","103.88","0.03","90","","3467","2","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","I-TEMPO(b)","4-(4-iodophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C16 H22 I N2 O -","- C16 H22 I N2 O -","- C128 H176 I8 N16 O8 -","8","2","OA0019","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds","Acta Crystallographica, Section B: Structural Science","1999","55","2","231","245","10.1107/S0108768198012786","","","0.71073","MoKα","","0.0766","0.037","","","","0.107","","","","","","1.029","","","","has coordinates,has Fobs","208977","2020-10-21","18:00:00",""
"2003060","7.977","0.006","20.158","0.007","11.383","0.009","90","","125.95","0.06","90","","1482","2","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-Py-TEMPO","4-(4-pyridyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C15 H22 N3 O -","- C15 H22 N3 O -","- C60 H88 N12 O4 -","4","1","OA0019","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds","Acta Crystallographica, Section B: Structural Science","1999","55","2","231","245","10.1107/S0108768198012786","","","0.71073","MoKα","","0.0621","0.0407","","","","0.1204","","","","","","1.001","","","","has coordinates,has Fobs","208977","2020-10-21","18:00:00",""
"2003061","14.035","0.003","22.964","0.003","10.71","0.002","90","","90","","90","","3451.8","1.1","295","","295","","","","","","","","","5","P b c a","-P 2ac 2ab","61","3,5-diCl-TEMPO","4-(3,5-dichlorophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C16 H21 Cl2 N2 O -","- C16 H21 Cl2 N2 O -","- C128 H168 Cl16 N16 O8 -","8","1","OA0019","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds","Acta Crystallographica, Section B: Structural Science","1999","55","2","231","245","10.1107/S0108768198012786","","","0.71073","MoKα","","0.1287","0.0491","","","","0.1233","","","","","","0.996","","","","has coordinates,has Fobs","208977","2020-10-21","18:00:00",""
"2003062","5.8845","0.0019","24.417","0.002","11.397","0.002","90","","104.09","0.02","90","","1588.3","0.6","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Cl-TEMPO","4-(4-chlorophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C16 H22 Cl N2 O -","- C16 H22 Cl N2 O -","- C64 H88 Cl4 N8 O4 -","4","1","OA0019","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds","Acta Crystallographica, Section B: Structural Science","1999","55","2","231","245","10.1107/S0108768198012786","","","0.71073","MoKα","","0.0798","0.0399","","","","0.1186","","","","","","0.993","","","","has coordinates,has Fobs","208977","2020-10-21","18:00:00",""
"2003063","7.541","0.001","20.848","0.003","10.591","0.001","90","","91.56","0.01","90","","1664.4","0.4","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Br-TEMPO","4-(4-bromophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C16 H22 Br N2 O -","- C16 H22 Br N2 O -","- C64 H88 Br4 N8 O4 -","4","1","OA0019","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds","Acta Crystallographica, Section B: Structural Science","1999","55","2","231","245","10.1107/S0108768198012786","","","0.71073","MoKα","","0.1421","0.0462","","","","0.0982","","","","","","0.97","","","","has coordinates,has Fobs","208977","2020-10-21","18:00:00",""
"2003064","5.889","0.004","25.851","0.003","11.322","0.003","90","","105.27","0.03","90","","1662.8","1.3","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","I-TEMPO(a)","4-(4-iodophenyl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C16 H22 I N2 O -","- C16 H22 I N2 O -","- C64 H88 I4 N8 O4 -","4","1","OA0019","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds","Acta Crystallographica, Section B: Structural Science","1999","55","2","231","245","10.1107/S0108768198012786","","","0.71073","MoKα","","0.071","0.0329","","","","0.0945","","","","","","0.992","","","","has coordinates,has Fobs","208977","2020-10-21","18:00:00",""
"2003065","5.955","0.001","28.488","0.005","11.796","0.002","90","","106.72","0.02","90","","1916.5","0.6","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","biPh-TEMPO","4-(biphenyl-4-yl)methyleneamino-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C22 H27 N2 O -","- C22 H27 N2 O -","- C88 H108 N8 O4 -","4","1","OA0019","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Kan-nari, Eiji; Takada, Kiwamu; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. I. 4-(4-Halobenzylideneamino)TEMPO and related compounds","Acta Crystallographica, Section B: Structural Science","1999","55","2","231","245","10.1107/S0108768198012786","","","0.71073","MoKα","","0.1175","0.0624","","","","0.1817","","","","","","0.981","","","","has coordinates,has Fobs","208977","2020-10-21","18:00:00",""
"2003066","12.0062","0.0005","12.0062","0.0005","12.0062","0.0005","90","","90","","90","","1730.68","0.12","296","","","","","","","","","","","3","I a -3 d","-I 4bd 2c 3","230","","","","- Al5 O12 Y3 -","- Al5 O12 Y3 -","- Al40 O96 Y24 -","8","0.0833333","OH0057","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.","Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions","Acta Crystallographica Section B","1999","55","3","266","272","10.1107/S0108768198012567","","","0.71069","MoKα","","","0.029","","","0.026","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003067","12.0432","0.0007","12.0432","0.0007","12.0432","0.0007","90","","90","","90","","1746.73","0.18","296","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al4 Ga O12 Y3 -","- Al4.002 Ga0.998 O12 Y3 -","- Al32.016 Ga7.984 O96 Y24 -","8","0.0833333","OH0057","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.","Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions","Acta Crystallographica Section B","1999","55","3","266","272","10.1107/S0108768198012567","","","0.71069","MoKα","","","0.022","","","0.016","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003068","12.0926","0.0009","12.0926","0.0009","12.0926","0.0009","90","","90","","90","","1768.3","0.2","296","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al3 Ga2 O12 Y3 -","- Al2.999 Ga2.001 O12 Y3 -","- Al23.992 Ga16.008 O96 Y24 -","8","0.0833333","OH0057","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.","Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions","Acta Crystallographica Section B","1999","55","3","266","272","10.1107/S0108768198012567","","","0.71069","MoKα","","","0.018","","","0.017","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003069","12.1552","0.0006","12.1552","0.0006","12.1552","0.0006","90","","90","","90","","1795.92","0.15","296","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al2 Ga3 O12 Y3 -","- Al2.001 Ga2.999 O12 Y3 -","- Al16.008 Ga23.992 O96 Y24 -","8","0.0833333","OH0057","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.","Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions","Acta Crystallographica Section B","1999","55","3","266","272","10.1107/S0108768198012567","","","0.71069","MoKα","","","0.018","","","0.013","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003070","12.2123","0.0008","12.2123","0.0008","12.2123","0.0008","90","","90","","90","","1821.3","0.2","296","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","","- Al Ga4 O12 Y3 -","- Al0.999 Ga4.001 O12 Y3 -","- Al7.992 Ga32.008 O96 Y24 -","8","0.0833333","OH0057","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.","Cation distribution and crystal chemistry of Y~3~Al~5{-~<i>x</i>}Ga~<i>x~</i>O~12~ (0 {łeq} <i>x</i> {łeq} 5) garnet solid solutions","Acta Crystallographica Section B","1999","55","3","266","272","10.1107/S0108768198012567","","","0.71069","MoKα","","","0.014","","","0.009","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2003075","12.94","0.003","18.06","0.002","22.544","0.011","90","","96.29","0.02","90","","5237","3","132","2","132","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Tetrakis(2,2'-bipyridine)bis(mu-oxo)dimanganese(3+) hexanitratocerate(3-) pentahydrate","","- C40 H42 Ce Mn2 N14 O25 -","- C40 H42 Ce Mn2 N14 O25 -","- C160 H168 Ce4 Mn8 N56 O100 -","4","0.5","OS0004","D. Ramalakshmi; M. V. Rajasekharan","Crystallographic disorder in mixed-valent dioxo-bridged Mn^III,IV^ complexes. [Mn~2~O~2~(bpy)~4~][Ce(NO~3~)~6~].5H~2~O","Acta Crystallographica Section B","1999","55","2","186","191","10.1107/S0108768198011586","","","0.71073","MoKα","","0.0539","0.0358","","0.0947","0.0783","","","","1.105","1.136","1.136","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003076","34.005","0.003","7.6024","0.0004","6.6358","0.0005","90.086","0.006","109.127","0.006","90.043","0.006","1620.8","0.2","293","","293","","","","","","","","","3","C 1","C 1","1","","bismuth tantalum oxide","","- Bi7 O18 Ta3 -","- Bi7 O18 Ta3 -","- Bi28 O72 Ta12 -","4","","OS0006","Ling, C. D.; Schmid, S.; Withers, R. L.; Thompson, J. G.; Ishizawa, N.; Kishimoto, S","Solution and refinement of the crystal structure of Bi~7~Ta~3~O~18~","Acta Crystallographica Section B","1999","55","2","157","164","10.1107/S0108768198011148","","","0.958","synchrotron","","0.05","0.0386","","","0.0337","","","","","1.249","1.249","","","","","has coordinates","209123","2020-10-21","18:00:00",""
"2003077","34.0084","0.0009","7.6069","0.0002","6.63644","0.00017","90","","109.238","0.0011","90","","1620.97","0.07","293","","293","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","bismuth tantalum oxide","","- Bi7 O18 Ta3 -","- Bi7 O18 Ta3 -","- Bi28 O72 Ta12 -","4","0.5","OS0006","Ling, C. D.; Schmid, S.; Withers, R. L.; Thompson, J. G.; Ishizawa, N.; Kishimoto, S","Solution and refinement of the crystal structure of Bi~7~Ta~3~O~18~","Acta Crystallographica Section B","1999","55","2","157","164","10.1107/S0108768198011148","","neutron","","neutron","","","","","","","","","","5.41","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003078","12.934","0.003","14.748","0.003","15.858","0.003","90","","90","","90","","3024.9","1.1","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium iodide","","- C19 H9 I O3 -","- C19 H9 I O3 -","- C152 H72 I8 O24 -","8","1","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0496","0.0438","","","","0.1104","","","","","","1.196","","","","has coordinates","208975","2020-10-21","18:00:00",""
"2003079","12.817","0.003","15.196","0.003","15.396","0.003","90","","90","","90","","2998.6","1.1","120","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium tetrafluoroborate","","- C19 H9 B F4 O3 -","- C19 H9 B F4 O3 -","- C152 H72 B8 F32 O24 -","8","1","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.059","0.0437","","","","0.1239","","","","","","1.031","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003080","13.55","0.003","15.807","0.003","32.201","0.006","90","","90","","90","","6897","2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluoroarsenate","","- C19 H9 As F6 O3 -","- C19 H9 As F6 O3 -","- C304 H144 As16 F96 O48 -","16","2","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0967","0.0572","","","","0.1779","","","","","","1.068","","","","has coordinates","208975","2020-10-21","18:00:00",""
"2003081","12.946","0.002","12.946","0.002","16.806","0.003","90","","90","","120","","2439.3","0.7","120","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate","","- C19 H9 F6 O3 P -","- C19 H9 F6 O3 P -","- C114 H54 F36 O18 P6 -","6","0.166667","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0336","0.0261","","","","0.0819","","","","","","1.047","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003082","6.496","0.0013","7.653","0.0015","33.039","0.007","90","","91.95","0.03","90","","1641.5","0.6","120","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium nitratehydrogennitrate","","- C19 H10 N2 O9 -","- C19 H10 N2 O9 -","- C76 H40 N8 O36 -","4","1","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0852","0.0425","","","","0.1134","","","","","","1.002","","","","has coordinates","208975","2020-10-21","18:00:00",""
"2003083","15.771","0.003","15.473","0.003","15.332","0.003","90","","115.7","0.03","90","","3371.3","1.4","120","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium trifluoromethanesulphonate","","- C20 H9 F3 O6 S -","- C20 H9 F3 O6 S -","- C160 H72 F24 O48 S8 -","8","2","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0394","0.0315","","","","0.0889","","","","","","1.022","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003084","18.205","0.004","13.54","0.003","18.679","0.004","90","","97.93","0.03","90","","4560.3","1.8","120","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium) tetradecachlorohexamolybdate","","- C38 H18 Cl14 Mo6 O6 -","- C38 H18 Cl14 Mo6 O6 -","- C152 H72 Cl56 Mo24 O24 -","4","0.5","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0288","0.0221","","","","0.0563","","","","","","1.094","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2003085","8.63","0.0017","8.968","0.0018","9.876","0.002","97.91","0.03","102.37","0.03","108.61","0.03","689.8","0.3","120","2","293","2","","","","","","","","4","P -1","-P 1","2","","Bis(4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium) dithionate","","- C38 H18 O12 S2 -","- C38 H18 O12 S2 -","- C38 H18 O12 S2 -","1","0.5","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0375","0.0323","","","","0.0923","","","","","","1.024","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2003086","12.085","0.002","11.347","0.002","22.93","0.005","90","","102.87","0.03","90","","3065.4","1.1","120","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","2,6,10-tri-tert-butyl-4,8,12-trioxa-4,8,12,12c-tetrahydro- dibenzo[cd,mn]pyrenium hexafluorophosphate acetonitrile","","- C33 H36 F6 N O3 P -","- C33 H36.009 F6 N O3 P -","- C132 H144.036 F24 N4 O12 P4 -","4","1","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0484","0.0364","","","","0.0997","","","","","","1.043","","","","has coordinates,has disorder","208975","2020-10-21","18:00:00",""
"2003087","17.157","0.003","11.13","0.002","18.456","0.004","90","","96.4","0.03","90","","3502.3","1.2","120","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(2,6,10-tri-tert-butyl-4,8,12-trioxa-4,8,12,12c-tetrahydro- dibenzo[cd,mn]pyrenium) tetradecachlorohexamolybdate","","- C62 H66 Cl14 Mo6 O6 -","- C62 H66 Cl14 Mo6 O6 -","- C124 H132 Cl28 Mo12 O12 -","2","0.5","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0294","0.0234","","","","0.0582","","","","","","1.097","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2003088","12.964","0.002","12.964","0.002","16.813","0.003","90","","90","","120","","2447.1","0.7","160","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate","","- C19 H9 F6 O3 P -","- C19 H9 F6 O3 P -","- C114 H54 F36 O18 P6 -","6","0.166667","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0462","0.031","","","","0.0902","","","","","","1.036","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003089","12.997","0.002","12.997","0.002","16.843","0.003","90","","90","","120","","2464","0.7","198","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate","","- C19 H9 F6 O3 P -","- C19 H9 F6 O3 P -","- C114 H54 F36 O18 P6 -","6","0.166667","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0585","0.0333","","","","0.0988","","","","","","1.06","","","","has coordinates","208975","2020-10-21","18:00:00",""
"2003090","13.015","0.002","13.015","0.002","16.859","0.003","90","","90","","120","","2473.2","0.7","220","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate","","- C19 H9 F6 O3 P -","- C19 H9 F6 O3 P -","- C114 H54 F36 O18 P6 -","6","0.166667","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0593","0.0325","","","","0.0993","","","","","","1.022","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003091","13.04","0.002","13.04","0.002","16.884","0.003","90","","90","","120","","2486.3","0.7","243","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate","","- C19 H9 F6 O3 P -","- C19 H9 F6 O3 P -","- C114 H54 F36 O18 P6 -","6","0.166667","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0638","0.0296","","","","0.0953","","","","","","0.948","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003092","13.067","0.002","13.067","0.002","16.91","0.003","90","","90","","120","","2500.5","0.7","268","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate","","- C19 H9 F6 O3 P -","- C19 H9 F6 O3 P -","- C114 H54 F36 O18 P6 -","6","0.166667","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0758","0.0371","","","","0.1124","","","","","","1.067","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003093","13.094","0.002","13.094","0.002","16.937","0.003","90","","90","","120","","2514.8","0.7","293","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate","","- C19 H9 F6 O3 P -","- C19 H9 F6 O3 P -","- C114 H54 F36 O18 P6 -","6","0.166667","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0851","0.0344","","","","0.1106","","","","","","1.001","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003094","13.111","0.002","13.111","0.002","16.953","0.003","90","","90","","120","","2523.8","0.7","313","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate","","- C19 H9 F6 O3 P -","- C19 H9 F6 O3 P -","- C114 H54 F36 O18 P6 -","6","0.166667","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.0863","0.0363","","","","0.1095","","","","","","1.054","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003095","13.131","0.002","13.131","0.002","16.97","0.003","90","","90","","120","","2534","0.7","338","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate","","- C19 H9 F6 O3 P -","- C19 H9 F6 O3 P -","- C114 H54 F36 O18 P6 -","6","0.166667","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.1019","0.0365","","","","0.1137","","","","","","1.049","","","","has coordinates","208975","2020-10-21","18:00:00",""
"2003096","13.181","0.002","13.181","0.002","17.025","0.003","90","","90","","120","","2561.6","0.7","373","2","293","2","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","4,8,12-trioxa-4,8,12,12c-tetrahydro-dibenzo[cd,mn]pyrenium hexafluorophosphate","","- C19 H9 F6 O3 P -","- C19 H9 F6 O3 P -","- C114 H54 F36 O18 P6 -","6","0.166667","OS0007","Krebs, Frederik C.; Laursen, Bo W.; Johannsen, Ib; Faldt, André; Bechgaard, Klaus; Jacobsen, Claus S.; Thorup, Niels; Boubekeur, Kamal","The geometry and structural properties of the 4,8,12-trioxa-4,8,12,12c-tetrahydrodibenzo[cd,mn]pyrene system in the cationic state. Structures of a planar organic cation with various monovalent and divalent anions","Acta Crystallographica, Section B: Structural Science","1999","55","3","410","423","10.1107/S0108768198016140","","","0.71073","MoKα","","0.1208","0.042","","","","0.1276","","","","","","1.093","","","","has coordinates","208975","2020-10-21","18:00:00",""
"2003097","9.567","0.001","9.567","0.001","20.754","0.002","90","","90","","120","","1645.1","0.3","293","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca15 I O37 P9 -","- Ca15 I1.048 O36.98 P9 -","- Ca30 I2.096 O73.96 P18 -","2","0.166667","OS0009","Alberius Henning, Peter; Lidin, Sven; Petříček, Vačlav","Iodo-oxyapatite, the first example from a new class of modulated apatites","Acta Crystallographica Section B","1999","55","2","165","169","10.1107/S0108768198012312","","","0.7107","MoKα","","0.0937","0.0452","","0.0545","0.0459","","","","1.01","1.29","1.29","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003098","9.8944","0.0002","4.7425","0.0001","12.9045","0.0002","90","","93.374","0.001","90","","604.48","0.02","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-Isoleucine:D-Alanine","","- C9 H20 N2 O4 -","- C9 H20 N2 O4 -","- C18 H40 N4 O8 -","2","1","OS0011","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series","Acta Crystallographica Section B","1999","55","3","424","431","10.1107/S0108768198013494","","","0.71073","MoKα","","0.0885","0.0612","","0.1697","0.1548","","","","1.004","1.084","1.084","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003099","26.9873","0.0006","4.7471","0.0001","9.9652","0.0002","90","","94.546","0.001","90","","1272.64","0.05","170","2","170","2","","","","","","","","4","C 1 2 1","C 2y","5","","L-Isoleucine:D-aminobutyric acid","","- C10 H22 N2 O4 -","- C10 H22 N2 O4 -","- C40 H88 N8 O16 -","4","1","OS0011","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series","Acta Crystallographica Section B","1999","55","3","424","431","10.1107/S0108768198013494","","","0.71073","MoKα","","0.0428","0.0385","","0.1043","0.0995","","","","1.085","1.073","1.073","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003100","29.0557","0.0007","4.7551","0.0001","9.9398","0.0002","90","","101.358","0.001","90","","1346.42","0.05","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","","L-Isoleucine:D-Norvaline","","- C11 H24 N2 O4 -","- C11 H24 N2 O4 -","- C44 H96 N8 O16 -","4","1","OS0011","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series","Acta Crystallographica Section B","1999","55","3","424","431","10.1107/S0108768198013494","","","0.71073","MoKα","","0.0364","0.0349","","0.0971","0.0946","","","","1.093","1.079","1.079","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003101","10.012","0.002","4.7227","0.0009","30.335","0.006","90","","98.38","0.03","90","","1419","0.5","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-Isoleucine:D-Norleucine","","- C12 H26 N2 O4 -","- C12 H26 N2 O4 -","- C48 H104 N8 O16 -","4","2","OS0011","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series","Acta Crystallographica Section B","1999","55","3","424","431","10.1107/S0108768198013494","","","0.71073","MoKα","","0.0621","0.0482","","0.1183","0.1109","","","","1.119","1.143","1.143","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003102","31.7681","0.0003","4.717","0.0001","10.0043","0.0001","90","","105.914","0.001","90","","1441.69","0.04","150","2","150","2","","","","","","","","5","C 1 2 1","C 2y","5","","L-Isoleucine:D-Methionine","","- C11 H24 N2 O4 S -","- C11 H24 N2 O4 S -","- C44 H96 N8 O16 S4 -","4","1","OS0011","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series","Acta Crystallographica Section B","1999","55","3","424","431","10.1107/S0108768198013494","","","0.71073","MoKα","","0.0606","0.0419","","0.1028","0.0931","","","","1.075","1.088","1.088","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003103","5.2528","0.0001","23.9809","0.0006","5.42","0.0001","90","","110.42","0.001","90","","639.84","0.02","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-Isoleucine:D-Valine","","- C11 H24 N2 O4 -","- C11 H24 N2 O4 -","- C22 H48 N4 O8 -","2","1","OS0011","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series","Acta Crystallographica Section B","1999","55","3","424","431","10.1107/S0108768198013494","","","0.71073","MoKα","","0.0532","0.0458","","0.1114","0.1066","","","","1.14","1.145","1.145","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003104","5.1933","0.0003","5.4064","0.0003","13.6968","0.0007","91.516","0.002","98.603","0.002","110.376","0.002","355.16","0.03","150","2","150","2","","","","","","","","4","P 1","P 1","1","","L-Isoleucine:D-Leucine","","- C12 H26 N2 O4 -","- C12 H26 N2 O4 -","- C12 H26 N2 O4 -","1","1","OS0011","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. I. The <small>L</small>-isoleucine series","Acta Crystallographica Section B","1999","55","3","424","431","10.1107/S0108768198013494","","","0.71073","MoKα","","0.0665","0.0526","","0.134","0.1181","","","","1.119","1.059","1.059","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003105","8.71083","0.00004","8.71083","","17.32202","0.0001","90","","90","","90","","1314.37","0.01","293","","293","","","","","","","","","3","I 4/m","-I 4","87","","bismuth tungsten oxide","","- Bi14 O24 W -","- Bi14 O24 W -","- Bi28 O48 W2 -","2","0.125","OS0017","Ling, C. D.; Withers, R. L.; Thompson, J. G.; Schmid, S.","Structures of Bi~14~WO~24~ and Bi~14~MoO~24~ from neutron powder diffraction data","Acta Crystallographica Section B","1999","55","3","306","312","10.1107/S0108768198014086","","neutron","","neutron","","","","","","","","","","2.71","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003106","8.70839","0.00004","8.70839","","17.31634","0.00014","90","","90","","90","","1313.2","0.012","293","","293","","","","","","","","","3","I 4/m","-I 4","87","","bismuth tungsten oxide","","- Bi14 Mo O24 -","- Bi14 Mo O24 -","- Bi28 Mo2 O48 -","2","0.125","OS0017","Ling, C. D.; Withers, R. L.; Thompson, J. G.; Schmid, S.","Structures of Bi~14~WO~24~ and Bi~14~MoO~24~ from neutron powder diffraction data","Acta Crystallographica Section B","1999","55","3","306","312","10.1107/S0108768198014086","","neutron","","neutron","","","","","","","","","","2.59","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2003107","8.695","0.0008","12.1085","0.0015","12.4538","0.0011","80.905","0.007","86.368","0.009","84.22","0.009","1286.4","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Hydrated,bis[(diethylenetrimine)copper]-μ-(1,3-imidazolate-N,N') triperchlorate","","- C11 H29 Cl3 Cu2 N8 O13 -","- C11 H27 Cl3 Cu2 N8 O13 -","- C22 H54 Cl6 Cu4 N16 O26 -","2","1","","Bu, Weiming; Ye, Ling; Zhu, Hailiang; Yang, Guangdi; Fan, Yuguo; Tang, Wenxia","μ-1,3-Imidazolyl-κN:κN'-bis[(diethylenetriaminato-κ^3^N)copper] triperchlorate hydrate","Acta Crystallographica, Section C: Crystal Structure Communications","1999","55","5","IUC9900045","","10.1107/s0108270199099527","","","0.71073","MoKα","","0.0548","0.0426","","0.0654","0.0521","","","","1.015","1.156","1.156","","","","","has coordinates","182018","2020-10-21","18:00:00",""
"2003109","14.7711","0.0005","14.7711","0.0005","3.82206","0.00006","90","","90","","120","","722.19","0.04","293","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- C10 H15 Li -","- C7.998 Li -","- C23.994 Li3 -","3","0.166667","SE0236","Robert E. Dinnebier","Disorder determined by high-resolution powder diffraction: structure of pentamethylcyclopentadienyllithium","Acta Crystallographica Section B","1999","55","1","35","44","10.1107/S0108768198007009","","","0.84979","synchrotron","","","","","","","","","","","","","","","","","has coordinates","208817","2020-10-21","18:00:00",""
"2003110","5.8907","0.0007","26.071","0.002","11.8868","0.0011","90","","106.118","0.009","90","","1753.8","0.3","258","1","258","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1:1 adduct of hexamethylenetetramine and azelaic acid","","","- C15 H28 N4 O4 -","- C15 H28 N4 O4 -","- C60 H112 N16 O16 -","4","1","SE0259","Marc Hostettler; Henrik Birkedal; Manual Gardon; Gervais Chapuis; Dieter Schwarzenbach; Michel Bonin","Phase-transition-induced twinning in the 1:1 adduct of hexamethylenetetramine and azelaic acid","Acta Crystallographica Section B","1999","55","3","448","458","10.1107/S0108768198017200","","","0.71073","MoKα","","0.0469","0.0469","","","","0.1364","","","","","","1.15","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2003112","5.589","0.0005","5.589","0.0005","4.6947","0.0004","90","","90","","90","","146.65","0.02","148","","","","","","","","","","","4","P -4 21 m","P -4 2ab","","","","","- C H4 N2 O -","- C H4 N2 O -","- C2 H8 N4 O2 -","2","0.25","SH0102","Zavodnik, Valery; Stash, Adam; Tsirelson, Vladimir; de Vries, Roelof; Feil, Dirk","Electron density study of urea using TDS-corrected X-ray diffraction data: quantitative comparison of experimental and theoretical results","Acta Crystallographica Section B","1999","55","1","45","54","10.1107/S0108768198005746","","","0.7069","MoKα","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003124","5.5887","0.0005","7.7619","0.0005","5.4489","0.0005","90","0.007","90","0.007","90","0.007","236.37","0.03","293","","293","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Fe Nd O3 -","- Fe Nd O3 -","- Fe4 Nd4 O12 -","4","0.5","SH0113","Streltsov, V. A.; Ishizawa, N.","Synchrotron X-ray study of the electron density in <i>R</i>FeO~3~ (<i>R</i> = Nd, Dy)","Acta Crystallographica Section B","1999","55","1","1","7","10.1107/S0108768198005400","","","0.84","xray_vertical_wiggler","","0.03","0.029","","0.033","0.033","","","","2.491","2.509","2.509","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2003125","5.5957","0.0008","7.629","0.0009","5.3009","0.0011","90","0.012","90","0.012","90","0.012","226.29","0.06","293","","293","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Dy Fe O3 -","- Dy Fe O3 -","- Dy4 Fe4 O12 -","4","0.5","SH0113","Streltsov, V. A.; Ishizawa, N.","Synchrotron X-ray study of the electron density in <i>R</i>FeO~3~ (<i>R</i> = Nd, Dy)","Acta Crystallographica Section B","1999","55","1","1","7","10.1107/S0108768198005400","","","0.84","xray_vertical_wiggler","","0.038","0.038","","0.04","0.04","","","","3.263","3.263","3.263","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2003129","9.462","0.001","8.392","0.001","5.221","0.001","90","","110.18","0.01","90","","389.12","0.1","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Al Li O6 Si2 -","- Al Li O6 Si2 -","- Al4 Li4 O24 Si8 -","4","0.5","SH0121","Kuntzinger, Sandrine; Ghermani, Nour Eddine","Electron density distribution and Madelung potential in α-spodumene, LiAl(SiO~3~)~2~, from two-wavelength high-resolution X-ray diffraction data","Acta Crystallographica Section B","1999","55","3","273","284","10.1107/S0108768198013536","","","0.7107","MoKα","","","0.0137","","","","0.0145","","","","","","0.97","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2003130","9.456","0.001","8.386","0.001","5.216","0.001","90","","110.13","0.01","90","","388.35","0.1","293","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Al Li O6 Si2 -","- Al Li O6 Si2 -","- Al4 Li4 O24 Si8 -","4","0.5","SH0121","Kuntzinger, Sandrine; Ghermani, Nour Eddine","Electron density distribution and Madelung potential in α-spodumene, LiAl(SiO~3~)~2~, from two-wavelength high-resolution X-ray diffraction data","Acta Crystallographica Section B","1999","55","3","273","284","10.1107/S0108768198013536","","","0.5608","AgKα","","","0.0155","","","","0.0151","","","","","","0.84","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2003131","5.79095","0.00008","5.8221","0.00007","8.20358","0.00012","90","","90.1262","0.0011","90","","276.59","","","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Nb0.5 O3 Sr Yb0.5 -","- Nb O6 Sr2 Yb -","- Nb2 O12 Sr4 Yb2 -","2","0.5","SH0123","Yang, Jae Ho; Choo, Woong Kil; Lee, Jin Ho; Lee, Chang Hee","The Crystal Structure of B-site Ordered Complex Perovskite SrYb~0.5~Nb~0.5~O~3~","Acta Crystallographica, Section B","1999","55","2","348","354","10.1107/S0108768198018333","","x-ray","1.54056","CuKα","","","","","","","","","","3.28","","","","","","","has coordinates","188497","2020-10-21","18:00:00",""
"2003132","5.79095","","5.8221","","8.20358","","90","","90.1262","","90","","276.59","","","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Nb0.5 O3 Sr Yb0.5 -","- Nb O6 Sr2 Yb -","- Nb2 O12 Sr4 Yb2 -","2","0.5","SH0123","Yang, Jae Ho; Choo, Woong Kil; Lee, Jin Ho; Lee, Chang Hee","The Crystal Structure of B-site Ordered Complex Perovskite SrYb~0.5~Nb~0.5~O~3~","Acta Crystallographica, Section B","1999","55","2","348","354","10.1107/S0108768198018333","","neutron","1.8339","","","","","","","","","","","1.7005","","","","","","","has coordinates","188497","2020-10-21","18:00:00",""
"2003133","9.094","0.008","18.143","0.004","12.902","0.003","90","","106.13","0.04","90","","2045","2","173","1","173","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-chloropyridinium trichloromercurate(II)","","- C5 H5 Cl4 Hg N -","- C5 H5 Cl4 Hg N -","- C40 H40 Cl32 Hg8 N8 -","8","2","SH0124","Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick","Polynuclear chloromercurate(II) systems in their chloropyridinium salts","Acta Crystallographica Section B","1999","55","3","396","409","10.1107/S010876819801550X","","","0.71069","MoKα","","0.1002","0.0437","","0.0392","","0.0358","","","","","","1.684","","","","has coordinates,has Fobs","288311","2023-12-14","14:19:09",""
"2003134","7.522","0.002","28.046","0.003","9.165","0.002","90","","105.78","0.02","90","","1860.6","0.7","173","1","173","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tetrakis(3-chloropyridinium) decachlorotrimercurate(II)","","- C20 H20 Cl14 Hg3 N4 -","- C20 H20 Cl14 Hg3 N4 -","- C40 H40 Cl28 Hg6 N8 -","2","0.5","SH0124","Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick","Polynuclear chloromercurate(II) systems in their chloropyridinium salts","Acta Crystallographica Section B","1999","55","3","396","409","10.1107/S010876819801550X","","","0.71069","MoKα","","0.0562","0.0357","","0.0388","","0.0375","","","","","","1.95","","","","has coordinates,has Fobs","288311","2023-12-14","14:19:17",""
"2003135","9.907","0.003","13.226","0.002","7.282","0.002","84.41","0.02","74.81","0.02","87.34","0.02","916.2","0.4","173","1","173","1","","","","","","","","5","P -1","-P 1","2","","tetrakis(4-chloropyridinium) decachlorotrimercurate(II)","","- C20 H20 Cl14 Hg3 N4 -","- C20 H20 Cl14 Hg3 N4 -","- C20 H20 Cl14 Hg3 N4 -","1","0.5","SH0124","Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick","Polynuclear chloromercurate(II) systems in their chloropyridinium salts","Acta Crystallographica Section B","1999","55","3","396","409","10.1107/S010876819801550X","","","0.71069","MoKα","","0.055","0.0383","","0.0396","","0.0386","","","","","","2.2","","","","has coordinates","288311","2023-12-14","14:19:32",""
"2003136","7.243","0.005","22.145","0.008","12.32","0.003","90","","99.52","0.03","90","","1948.9","1.6","173","1","173","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-chloropyridinium trichloromercurate(II)","","- C5 H5 Cl4 Hg N -","- C5 H5 Cl4 Hg N -","- C40 H40 Cl32 Hg8 N8 -","8","2","SH0124","Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick","Polynuclear chloromercurate(II) systems in their chloropyridinium salts","Acta Crystallographica Section B","1999","55","3","396","409","10.1107/S010876819801550X","","","0.71069","MoKα","","0.0879","0.0486","","0.0513","","0.0489","","","","","","2.014","","","","has coordinates,has Fobs","288311","2023-12-14","14:19:45",""
"2003137","13.447","0.003","7.534","0.002","9.939","0.002","90","","97.48","0.02","90","","998.3","0.4","173","1","173","1","","","","","","","","5","C 1 2/m 1","-C 2y","12","","bis(4-chloropyridinium) hexachlorodimercurate(II)","","- C10 H10 Cl8 Hg2 N2 -","- C12 H10 Cl8 Hg2 N4 -","- C24 H20 Cl16 Hg4 N8 -","2","0.25","SH0124","Linden, Anthony; James, Bruce D.; Liesegang, John; Gonis, Nick","Polynuclear chloromercurate(II) systems in their chloropyridinium salts","Acta Crystallographica Section B","1999","55","3","396","409","10.1107/S010876819801550X","","","0.71069","MoKα","","","0.0528","","0.0675","","0.0641","","","0.0653","","","2.187","","","","has coordinates,has Fobs","288311","2023-12-14","14:19:52",""
"2003165","10.191","0.005","17.678","0.008","17.754","0.009","90","","99.42","0.02","90","","3155","3","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H48 Cl2 N6 O8 Zn -","- C44 H104.32 Cl4.002 N12 O17.22 Zn2 -","- C176 H417.28 Cl16.008 N48 O68.88 Zn8 -","4","0.5","TA0004","Haller, Kenneth J.; Rae, A. David; Bygott, Alexia M. T.; Hockless, David C. R.; Ralph, Stephen F.; Geue, Rodney J.; Sargeson, Alan M.","Four-component intergrowth structures of the metal-ion cage complexes <i>fac</i>-(1,5,9,13,20-pentamethyl-3,7,11,15,18,22-hexaazabicyclo[7.7.7]tricosane)<i>M</i>^II^ diperchlorate hydrate, [<i>M</i>(C~22~H~48~N~6~)](ClO~4~)~2~.<i>x</i>H~2~O, <i>M</i> = Ni, Zn","Acta Crystallographica Section B","1999","55","3","380","388","10.1107/S0108768198012968","","","1.5418","CuKα","","0.069","0.054","","0.09","0.083","","","","1.73","1.78","1.78","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2003166","10.177","0.001","17.648","0.002","17.605","0.002","90","","99.7","0.01","90","","3116.7","0.6","295","2","295","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H48 Cl2 N6 Ni O8 -","- C26.62 H58.08 Cl2.42 N7.26 Ni1.21 O10.292 -","- C106.48 H232.32 Cl9.68 N29.04 Ni4.84 O41.168 -","4","0.5","TA0004","Haller, Kenneth J.; Rae, A. David; Bygott, Alexia M. T.; Hockless, David C. R.; Ralph, Stephen F.; Geue, Rodney J.; Sargeson, Alan M.","Four-component intergrowth structures of the metal-ion cage complexes <i>fac</i>-(1,5,9,13,20-pentamethyl-3,7,11,15,18,22-hexaazabicyclo[7.7.7]tricosane)<i>M</i>^II^ diperchlorate hydrate, [<i>M</i>(C~22~H~48~N~6~)](ClO~4~)~2~.<i>x</i>H~2~O, <i>M</i> = Ni, Zn","Acta Crystallographica Section B","1999","55","3","380","388","10.1107/S0108768198012968","","","1.5418","CuKα","","0.133","0.074","","0.137","0.121","","","","1.91","2.55","2.55","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2003173","36.394","0.001","7.3674","0.0005","31.006","0.002","90","","90","","90","","8313.6","0.8","293","","293","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","calcium_zirconium_tantalum_oxide","","- Ca7 O36 Ta6 Zr7 -","- Ca6.98667 O36 Ta5.94667 Zr7.06667 -","- Ca83.84 O432 Ta71.36 Zr84.8 -","12","0.375","BR0081","Schmid, Siegbert; Thompson, John G.; Withers, Ray L.; Ling, Christopher D.; Ishizawa, Nobuo; Kishimoto, Shunji","The crystal structure of Ca~7~Zr~7~Ta~6~O~36~ refined using synchrotron-radiation data","Acta Crystallographica Section B","1999","55","3","313","320","10.1107/S0108768198014268","","","1.2682","xray","","0.047","0.031","","0.038","0.034","","","","1.379","1.508","1.508","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008042","11.8769","0.0001","11.8769","0.0001","23.0394","0.0004","90","","90","","120","","2814.54","0.06","228","2","228","2","","","","","","","","6","R -3 m :H","-R 3 2""","166","","","","- Co H28 I Mo6 Na3 O38 -","- Co1.02 I Mo6 Na3 O38 -","- Co3.06 I3 Mo18 Na9 O114 -","3","0.0833333","BK1375","Rosu, Cristina; Dickman, Michael H.","Cobalt(II) trisodium hexamolybdoperiodate tetradecahydrate","Acta Crystallographica Section C","1999","55","1","11","13","10.1107/S0108270198011391","","","0.71073","MoKα","","0.0357","0.0334","","0.1024","0.0997","","","","1.167","1.181","1.181","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008043","12.852","0.002","12.852","0.002","13.037","0.003","90","","90","","90","","2153.4","0.7","293","2","293","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C12 H33 Cl4 Co N4 O3 -","- C12 H30 Cl4 Co N4 O3 -","- C48 H120 Cl16 Co4 N16 O12 -","4","0.5","BK1391","Jeong, Jong Hwa; Kim, Dong Yeub; Lee, Dong Jin; Lee, Bae Wook; Doh, Myung Ki","Oxonium Λ-{<i>N</i>,<i>N</i>'-bis[2(<i>S</i>)-pyrrolidinylmethyl]ethane-1,2-diamine}-<i>cis</i>-α-dichlorocobalt(III) dichloride dihydrate","Acta Crystallographica Section C","1999","55","1","56","58","10.1107/S0108270198009421","","","0.71073","MoKα","","0.046","0.042","","","","0.088","","","","","","1.084","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2008044","7.6544","0.0012","15.351","0.003","10.287","0.002","90","","106.544","0.008","90","","1158.7","0.4","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H14 Cl2 N8 Sn -","- C26 H14 Cl2 N8 Sn -","- C52 H28 Cl4 N16 Sn2 -","2","0.5","BK1399","Farris, Philip J.; Jacobs, Jude T.; Okonczac, Michael P.; Durfee, William S.; Noll, Bruce C.","<i>trans</i>-Dichloro(hemiporphyrazinato)tin(IV)","Acta Crystallographica Section C","1999","55","1","32","33","10.1107/S0108270198011408","","","0.71073","MoKα","","0.079","0.046","","0.12","0.1043","","","","0.999","1.042","1.042","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008045","10.273","0.002","11.077","0.002","13.803","0.003","69.43","0.01","68.45","0.01","79.33","0.01","1364.9","0.5","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","bis(tetraphenylphosphonium) bis(cis-1,2-dicarbomethoxyethylene-1,2-diseleno)- palladate(II)","","- C60 H52 O8 P2 Pd Se4 -","- C60 H52 O8 P2 Pd Se4 -","- C60 H52 O8 P2 Pd Se4 -","1","0.5","BK1405","McLauchlan, Craig C.; Ibers, James A.","[PPh~4~]~2~[Pd{Se~2~C~2~(COOCH~3~)~2~}~2~]","Acta Crystallographica Section C","1999","55","1","30","32","10.1107/S0108270198010543","","","0.71073","MoKα","","0.0789","0.0414","","","","0.0889","","","","","","0.899","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008046","15.894","0.001","13.693","0.002","8.442","0.001","90","","94.87","0.01","90","","1830.7","0.4","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","3,3',5,5'-tetramethyl-6,6'-dimethoxybiphenyl-2,2'-dimethanol","","","- C20 H26 O4 -","- C20 H26 O4 -","- C80 H104 O16 -","4","1","BK1410","Dobson, Allison J.; Gerkin, Roger E.","6,6'-Dimethoxy-3,3',5,5'-tetramethylbiphenyl-2,2'-dimethanol","Acta Crystallographica Section C","1999","55","1","82","84","10.1107/S0108270198009779","","","0.71073","MoKα","","","0.057","","","0.07","","","","","1.71","1.71","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008047","30.559","0.003","6.363","0.003","19.744","0.004","90","","105.82","0.01","90","","3693.7","1.9","296","","296","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","dineopentylprehnitene","","","- C20 H34 -","- C20 H34 -","- C160 H272 -","8","1","BK1414","Gerkin, Roger E.","Dineopentylprehnitene (1,2,3,4-tetramethyl-5,6-dineopentylbenzene) at 296 and 223K","Acta Crystallographica Section C","1999","55","1","79","82","10.1107/S010827019801141X","","","0.71073","MoKα","","","0.086","","","0.112","","","","","1.54","1.54","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008048","30.439","0.002","6.314","0.003","19.663","0.003","90","","106.06","0.01","90","","3631.6","1.8","223","","223","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","dineopentylprehnitene","","","- C20 H34 -","- C20 H34 -","- C160 H272 -","8","1","BK1414","Gerkin, Roger E.","Dineopentylprehnitene (1,2,3,4-tetramethyl-5,6-dineopentylbenzene) at 296 and 223K","Acta Crystallographica Section C","1999","55","1","79","82","10.1107/S010827019801141X","","","0.71073","MoKα","","","0.072","","","0.107","","","","","1.8","1.8","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008049","10.1867","0.001","9.759","0.002","17.7778","0.001","90","0.001","94.009","0.01","90","0.02","1763","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","N-H...π (Indole) Intermolecular Interaction in 3,3'-Di Indolyl-Phenyl Methane","","- C23 H18 N2 -","- C23 H18 N2 -","- C92 H72 N8 -","4","1","BM1241","R. Krishna; D. Velmurugan; G. Babu; P.T. Perumal","N—H···π(indole) intermolecular interactions in 3,3'-benzylidenediindole","Acta Crystallographica Section C","1999","55","1","75","78","10.1107/S0108270198010695","","","1.54178","CuKα","","0.0671","0.0532","","0.1892","0.1618","","","","1.039","1.063","1.063","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008050","23.93","0.002","12.5245","0.0011","11.903","0.002","90","","90","","90","","3567.5","0.7","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","A complex of 4,4,8,8-tetrakis(1-pyrazolyl)pyrazabole and diphenyltin(IV) dichloride monohydrate","","- C30 H30 B2 Cl2 N12 O Sn -","- C30 H30 B2 Cl2 N12 O Sn -","- C120 H120 B8 Cl8 N48 O4 Sn4 -","4","1","BM1258","Dey, Dilip Kumar; Das, Mrinal Kanti; Chinnakali, Kandasamy; Fun, Hoong-Kun; Razak, Ibrahim Abdul","An adduct of aquadichlorodiphenyltin(IV) and 4,4,8,8-tetrakis(1-pyrazolyl)pyrazabole","Acta Crystallographica Section C","1999","55","1","20","22","10.1107/S0108270198009780","","","0.71073","MoKα","","0.068","0.039","","0.088","0.081","","","","0.887","1.01","1.01","","","","","has coordinates","194546","2020-10-21","18:00:00",""
"2008051","8.951","0.002","12.802","0.002","12.879","0.002","107.62","0.01","104.61","0.01","90.31","0.01","1355.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H10 Mo N2 O4 -","- C12 H10 Mo N2 O4 -","- C48 H40 Mo4 N8 O16 -","4","2","BM1268","Mentes, Ayfer; Fawcett, John; Kemmitt, Raymond D. W.; Russell, David R.","Molybdenum‒tetracarbonyl complexes with Schiff base ligands","Acta Crystallographica Section C","1999","55","1","48","50","10.1107/S0108270198011433","","","0.71073","MoKα","","0.044","0.033","","0.085","0.079","","","","1.071","1.102","1.102","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008052","11.529","0.002","11.879","0.001","12.661","0.004","90","","96.21","0.01","90","","1723.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H12 Mo N2 O4 -","- C17 H12 Mo N2 O4 -","- C68 H48 Mo4 N8 O16 -","4","1","BM1268","Mentes, Ayfer; Fawcett, John; Kemmitt, Raymond D. W.; Russell, David R.","Molybdenum‒tetracarbonyl complexes with Schiff base ligands","Acta Crystallographica Section C","1999","55","1","48","50","10.1107/S0108270198011433","","","0.71073","MoKα","","0.044","0.032","","0.083","0.077","","","","1.096","1.137","1.137","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008053","8.5887","0.001","8.6404","0.0006","9.6169","0.0006","90","","98.398","0.007","90","","706.02","0.11","294","1","294","1","","","","","","","","4","P 1 21 1","P 2yb","4","N-((R/S)-2-Hydroxy-2-Phenylacetyl)-L-leucine","(2S)-2-{[(2R)-2-hydroxy-2-phenylethanoyl]amino}-4-methylpentanoic acid","","- C14 H19 N O4 -","- C14 H19 N O4 -","- C28 H38 N2 O8 -","2","1","BM1269","Dalton, John P.; Gallagher, John F.; Kenny, Peter T. M.; O'Donohoe, Michael","Intramolecular N—H···O, intermolecular O—H···O, C—H···O and C<i>sp</i>^3^—H···π~arene~ interactions in (2<i>S</i>)-2-{[(2<i>R</i>)-2-hydroxy-2-phenylethanoyl]amino}-4-methylpentanoic acid","Acta Crystallographica Section C","1999","55","1","126","129","10.1107/S0108270198010063","","","0.7107","MolybdenumKα","","0.057","0.04","","","","0.119","","","","","","1.013","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008054","9.969","0.004","11.671","0.003","12.706","0.002","63.859","0.013","77.63","0.02","65.257","0.015","1204.5","0.6","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H27 Fe N4 O3 -","- C27 H27 Fe N4 O3 -","- C54 H54 Fe2 N8 O6 -","2","1","BM1273","Ling He; Qing-Fang Shi; Shao-Hua Gou; Ming Qian; Chun-Ying Duan","[<i>N</i>-Salicyl-<i>N</i>,<i>N</i>-bis(salicylidenenitriloethyl)amino]iron(III) acetonitrile solvate","Acta Crystallographica Section C","1999","55","1","46","47","10.1107/S0108270198010580","","","0.71073","MoKα","","0.0578","0.0447","","0.1207","0.1116","","","","1.045","1.069","1.069","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008055","7.212","0.002","5.177","0.001","11.498","0.003","90","0.02","93.11","0.02","90","0.03","428.6","0.4","293","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- B2 Ca2 O5 -","- B2 Ca2 O5 -","- B8 Ca8 O20 -","4","1","","Lin, Qi-Sheng; Cheng, Wen-Dan; Chen, Jiu-Tong; Huang, Jin-Shun","Calcium pyroborate, Ca~2~B~2~O~5~","Acta Crystallographica Section C","1999","55","","04","06","","","","","","","","0.0561","","","0.071","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008056","9.256","0.003","9.726","0.003","12.073","0.003","90","","90","","90","","1086.9","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Cl4 K3 N O3 Zn -","- Cl4 K3 N O3 Zn -","- Cl16 K12 N4 O12 Zn4 -","4","0.5","","Carter, Robert L.; Zompa, Leverett J.","The Double-Anion Salts M~3~[ZnCl~4~]NO~3~ (M = K^+^ and NH~4~^+^)","Acta Crystallographica Section C","1999","55","","06","08","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2008057","9.268","0.003","10.042","0.003","12.482","0.003","90","","90","","90","","1161.7","0.6","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Cl4 H12 N4 O3 Zn -","- Cl4 H12 N4 O3 Zn -","- Cl16 H48 N16 O12 Zn4 -","4","0.5","","Carter, Robert L.; Zompa, Leverett J.","The Double-Anion Salts M~3~[ZnCl~4~]NO~3~ (M = K^+^ and NH~4~^+^)","Acta Crystallographica Section C","1999","55","","06","08","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008058","19.8165","0.0002","11.4468","0.0001","9.9208","0.0001","90","","109.185","0.0005","90","","2125.41","0.04","293","","293","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Ba4 O27 Ti12 -","- Ba4 O27 Ti12 -","- Ba16 O108 Ti48 -","4","0.5","","Currao, Antonio","Ba~4~Ti~12~O~27~: Rietveld refinement using x-ray powder diffraction data","Acta Crystallographica Section C","1999","55","","02","04","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008059","11.129","0.001","8.247","0.001","5.5395","0.0003","90","","100.88","0.01","90","","499.28","0.08","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","Bloedite","","","- H8 Mg Na2 O12 S2 -","- H8 Mg Na2 O12 S2 -","- H16 Mg2 Na4 O24 S4 -","2","0.5","BR1219","Vizcayno, Carmen; Garcia-Gonzalez, M. Teresa","Na~2~Mg(SO~4~)~2~.4H~2~O, the Mg end-member of the bloedite-type of mineral","Acta Crystallographica Section C","1999","55","1","8","11","10.1107/S0108270198011135","","","0.7107","MoKα","","0.0294","0.0289","","0.079","0.078","","","","1.207","1.201","1.201","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008060","9.486","0.001","21.276","0.004","25.266","0.004","90","","94.92","0.01","90","","5080.5","1.4","213","1","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50 H38 Cl2 O11 P2 Ru3 -","- C50 H38 Cl2 O11 P2 Ru3 -","- C200 H152 Cl8 O44 P8 Ru12 -","4","1","DA1022","Liu, Jianping; Boyd, Edwin P.; Shore, Sheldon G.","The [Ru~3~(CO)~11~]^2-^ dianion","Acta Crystallographica Section C","1999","55","1","29","30","10.1107/S010827019800883X","","","0.71073","MoKα","","0.055","0.033","","0.139","","0.084","","","","","","1.049","","","","has coordinates,has Fobs","278322","2022-10-03","12:14:44",""
"2008061","7.826","0.002","17.069","0.003","11.578","0.002","90","","93.09","0.03","90","","1544.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(triethanolamine)strontium(II) bis(2,4-dinitrophenolate)","","- C24 H36 N6 O16 Sr -","- C24 H36 N6 O16 Sr -","- C48 H72 N12 O32 Sr2 -","2","0.5","DE1079","Poonia, Narinder Singh; Chhabra, Neera; Sheldrick, W. S.; Hundal, Geeta; Obrai, Sangeeta; Hundal, Maninder Singh","Bis(triethanolamine)strontium(II) bis(2,4-dinitrophenolate)","Acta Crystallographica Section C","1999","55","1","24","26","10.1107/S0108270198010075","","","0.71073","MoKα","","0.136","0.078","","0.279","0.191","","","","1.077","1.109","1.109","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008062","8.736","0.002","9.655","0.002","18.773","0.004","99.79","0.03","95.9","0.03","102.93","0.03","1504.4","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2,5,8,11,14-pentaoxapentadecanecalcium(II) (2,4,6-trinitrophenolate)","","- C22 H26 Ca N6 O19 -","- C22 H26 Ca N6 O19 -","- C44 H52 Ca2 N12 O38 -","2","1","DE1081","Poonia, Narinder Singh; Hundal,Geeta; Obrai, Sangeeta; Hundal, Maninder Singh","(2,5,8,11,14-Pentaoxapentadecane-κ^5^<i>O</i>)bis(2,4,6-trinitrophenolato-<i>O</i>^1^,<i>O</i>^2^)calcium(II)","Acta Crystallographica Section C","1999","55","1","26","28","10.1107/S0108270198005721","","","0.71073","MoKα","","0.1","0.061","","0.187","0.152","","","","1.047","1.129","1.129","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008063","11.834","0.002","12.159","0.004","12.438","0.004","90","","112.77","0.02","90","","1650.2","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(2,2'-biphenoxy)(cyclohexylamino)phosphate","2,2'-Biphenyl (Cyclohexylamino)phosphonate","","- C18 H20 N O3 P -","- C18 H20 N O3 P -","- C72 H80 N4 O12 P4 -","4","1","DE1092","Muthaiah, C.; Kumara Swamy, K. C.","2,2'-Biphenyl (cyclohexylamino)phosphonate: a hydrogen-bonded dimer","Acta Crystallographica Section C","1999","55","1","110","112","10.1107/S0108270198010087","","","0.71073","MoKα","","0.064","0.044","","","","0.148","","","","","","1.08","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008064","12.0436","0.0009","9.187","0.0005","18.7995","0.001","90","","93.128","0.008","90","","2077","0.2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,1'-Diiodo-3,3'-bis(trimethylsilyl)ferrocene","","- C16 H24 Fe I2 Si2 -","- C16 H24 Fe I2 Si2 -","- C64 H96 Fe4 I8 Si8 -","4","1","FG1467","Foucher, Daniel A.; Lough, Alan J.; Park, Peter","1,1'-Diiodo-3,3'-bis(trimethylsilyl)ferrocene","Acta Crystallographica Section C","1999","55","1","33","35","10.1107/S0108270198009792","","","0.71073","MoKα","","0.056","0.038","","0.098","0.092","","","","0.922","1.021","1.021","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2008065","6.29","0.002","7.04","0.003","27.479","0.004","90","","100.83","0.03","90","","1195.1","0.7","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H26 Mn O12 S2 -","- C16 H26 Mn O12 S2 -","- C32 H52 Mn2 O24 S4 -","2","0.5","FG1487","Melvin A. Leonard; Philip J. Squattrito; Surendra N. Dubey","Hexaaquametal(II) 4-styrenesulfonates of manganese, cobalt and nickel","Acta Crystallographica Section C","1999","55","1","35","39","10.1107/S0108270198010105","","","0.7107","MoKα","","","0.083","","","0.091","","","","","","","1.48","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008066","6.298","0.002","6.987","0.003","27.309","0.004","90","","100.86","0.04","90","","1180.2","0.7","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H26 Co O12 S2 -","- C16 H26 Co O12 S2 -","- C32 H52 Co2 O24 S4 -","2","0.5","FG1487","Melvin A. Leonard; Philip J. Squattrito; Surendra N. Dubey","Hexaaquametal(II) 4-styrenesulfonates of manganese, cobalt and nickel","Acta Crystallographica Section C","1999","55","1","35","39","10.1107/S0108270198010105","","","0.7107","MoKα","","","0.068","","","0.088","","","","","","","1.93","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008067","6.292","0.002","6.934","0.005","27.315","0.005","90","","100.68","0.04","90","","1171.1","1","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H26 Ni O12 S2 -","- C16 H26 Ni O12 S2 -","- C32 H52 Ni2 O24 S4 -","2","0.5","FG1487","Melvin A. Leonard; Philip J. Squattrito; Surendra N. Dubey","Hexaaquametal(II) 4-styrenesulfonates of manganese, cobalt and nickel","Acta Crystallographica Section C","1999","55","1","35","39","10.1107/S0108270198010105","","","0.7107","MoKα","","","0.081","","","0.104","","","","","","","2.27","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008068","11.9156","0.0012","12.7033","0.0019","11.9651","0.0017","90","","100.415","0.01","90","","1781.3","0.4","293","1","293","1","","","","","","","","4","P 1 21 1","P 2yb","4","Pseudaconitine","[1α,6α,14α(E),16β]-20-Ethyl-1,6,16-trimethoxy-4-methoxymethyl-3,13- dihydroxyaconitane-8,14-diyl 8-acetate 14-(3',4'-dimethoxybenzoate)","","- C36 H51 N O12 -","- C36 H51 N O12 -","- C72 H102 N2 O24 -","2","1","FG1489","Parvez, Masood; Gul, Waseem; Atta-ur-Rahman; Choudhary, M. Iqbal; Nasreen, Amber; Fatima, Nuzhat","Pseudaconitine","Acta Crystallographica Section C","1999","55","1","72","74","10.1107/S0108270198010129","","","1.54178","CuKα","","0.069","0.057","","","","0.161","","","","","","1.044","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008069","10.8326","0.0007","14.3281","0.0015","10.976","0.003","90","","107.026","0.011","90","","1628.9","0.5","293","1","293","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Gliclazide","N-[(perhydrocyclopenta[c]pyrrol-2-yl)aminocarbonyl]-p-toluenesulfonamide","","- C15 H21 N3 O3 S -","- C15 H21 N3 O3 S -","- C60 H84 N12 O12 S4 -","4","1","FG1499","Parvez, Masood; Arayne, M. Saeed; Zaman, M. Kamran; Sultana, Najma","Gliclazide","Acta Crystallographica Section C","1999","55","1","74","75","10.1107/S0108270198009883","","","1.54178","CuKα","","0.066","0.053","","","","0.149","","","","","","1.019","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008070","15.593","0.003","15.596","0.009","20.041","0.006","90","","95.12","0.02","90","","4854","3","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","25,27-dihydroxyethoxy-26,28-dipropoxy-tert-butyl-calix[4]arene","","- C54 H76 O6 -","- C54 H76 O6 -","- C216 H304 O24 -","4","1","FG1502","Nissinen, Maija; Parzuchowski, Pawel; Böhmer, Volker; Rokicki, Gabriel; Rissanen, Kari","25,27-Dihydroxyethoxy-26,28-dipropoxy-<i>tert</i>-butylcalix[4]arene","Acta Crystallographica Section C","1999","55","1","104","106","10.1107/S0108270198010221","","","0.71073","MoKα","","0.075","0.047","","","","0.14","","","","","","1.093","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:32",""
"2008071","32.802","0.003","9.267","0.002","11.756","0.002","90","","108.93","0.01","90","","3380.3","1","293","1","293","1","","","","","","","","4","C 1 2 1","C 2y","5","indaconitine","","","- C35 H48.5 N1.5 O10 -","- C35 H48.5 N1.5 O10 -","- C140 H194 N6 O40 -","4","1","FG1503","Parvez, Masood; Gul, Waseem; Anwar, Saeed; Miana, Ghulam A.; Atta-ur-Rahman; Choudhary, M. Iqbal","Indaconitine 0.5-acetonitrile solvate","Acta Crystallographica Section C","1999","55","1","70","72","10.1107/S0108270198010130","","","1.54178","CuKα","","0.074","0.067","","0.188","0.179","","","","","","","1.038","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2008072","7.1459","0.001","7.5905","0.0009","8.8515","0.0008","82.682","0.009","77.437","0.009","68.864","0.01","436.46","0.09","296","","296","","","","","","","","","4","P -1","-P 1","2","(1R*,7aS*)-hexahydro-7-carboxymethyl-3H-pyrrolizidin-3-one","1-(5-Oxo-2,3,5,6,7,7a-hexahydro-1H-pyrrolizinyl)acetic acid","","- C9 H13 N O3 -","- C9 H13 N O3 -","- C18 H26 N2 O6 -","2","1","FG1513","Gerkin, Roger E.","Hydrogen bonding in [(1<i>R</i>*,7a<i>S</i>*)-hexahydro-5-oxo-1<i>H</i>-pyrrolizinyl-1-yl]acetic acid","Acta Crystallographica Section C","1999","55","1","84","87","10.1107/S0108270198010099","","","0.71073","MoKα","","","0.04","","","0.095","","","","","1.97","1.97","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008073","8.4254","0.0004","17.2278","0.0006","10.9291","0.0003","90","","96.164","0.002","90","","1577.2","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-benzoyl-1-ethyl-4-phenylpyrimidine-2-one","","- C19 H16 N2 O2 -","- C19 H16 N2 O2 -","- C76 H64 N8 O8 -","4","1","FR1134","Sema Öztürk; Mehmet Akkurt; İbrahim Abdul Razak; Hoong-Kun Fun; İsmail Yıldırım","5-Benzoyl-1-ethyl-4-phenyl-1<i>H</i>-pyrimidin-2-one","Acta Crystallographica Section C","1999","55","1","97","99","10.1107/S0108270198009822","","","0.71073","MoKα","","0.1788","0.0677","","0.121","0.0905","","","","1.009","1.204","1.204","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008074","7.864","0.002","6.964","0.002","24.361","0.006","90","","97.74","0.02","90","","1322","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Trans-Dicarbonyl(2,3,5,6-tetrafluorophenyl)bromo((5-cyclopentadienyl)rhenium (III)","","- C13 H6 Br F4 O2 Re -","- C13 H6 Br F4 O2 Re -","- C52 H24 Br4 F16 O8 Re4 -","4","1","FR1143","María Teresa Garland; Ricardo F. Baggio; A. Hugo Klahn; Beatriz Oëlckers","<i>trans</i>-Bromodicarbonyl(η^5^-cyclopentadienyl)(2,3,5,6-tetrafluorophenyl)rhenium(III)","Acta Crystallographica Section C","1999","55","1","61","62","10.1107/S0108270198011494","","","0.71073","MoKα","","0.049","0.034","","","","0.088","","","","","","1.011","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008075","21.479","0.004","10.569","0.002","16.807","0.003","90","","90","","90","","3815.4","1.2","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Trans-carbonylchlorobis(tri-p-tolylphosphine)rhodium(I)","","- C43 H42 Cl O P2 Rh -","- C43 H42 Cl O P2 Rh -","- C172 H168 Cl4 O4 P8 Rh4 -","4","1","GD1000","Otto, Stefanus; Mzamane, Sibusisiwe N.; Roodt, Andreas","<i>trans</i>-Carbonylchlorobis(tri-<i>p</i>-tolylphosphine)rhodium(I)","Acta Crystallographica Section C","1999","55","1","67","69","10.1107/S0108270198011603","","","0.71073","MoKα","","0.0416","0.0314","","","","0.0646","","","","","","1.163","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008076","8.2898","0.0002","9.752","0.0001","11.2391","0.0003","112.131","0.001","96.654","0.001","104.437","0.001","792.47","0.03","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","2,4,6-Triethyl-1,3,5-benzenetriacetonitrile","","- C18 H21 N3 -","- C18 H21 N3 -","- C36 H42 N6 -","2","1","GD1001","Walsdorff, Christian; Park, Ki-Min; Oh, Jinho; Kim, Kimoon","1,3,5-Tris(cyanomethyl)-2,4,6-triethylbenzene","Acta Crystallographica Section C","1999","55","1","108","110","10.1107/S0108270198011615","","","0.71073","MoKα","","0.0589","0.0505","","","","0.1464","","","","","","1.072","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008077","10.2979","0.0008","13.1101","0.0011","16.7038","0.0013","78.0476","0.0006","71.3989","0.0006","79.6493","0.0007","2075.2","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H58 N2 O4 -","- C22 H29 N O2 -","- C88 H116 N4 O8 -","4","2","GS1017","Elerman, Yalc̨in; Elmali, Ayhan; Kendi̇, Engin; Özbey, Süheyla","4-(2,5-Di-<i>tert</i>-butylphenylnitrilomethylidyne)-2-methoxyphenol","Acta Crystallographica Section C","1999","55","1","116","119","10.1107/S0108270198011573","","","0.71069","MoKα","","0.0833","0.0613","","0.162","0.133","","","","0.962","1.014","1.014","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008078","12.676","0.002","5.341","0.001","19.493","0.002","90","","107.42","0.01","90","","1259.2","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,3-bis(3-nitrophenyl)-1-triazene","1,3-bis(3-nitrophenyl)-1-triazene","","- C12 H9 N5 O4 -","- C12 H9 N5 O4 -","- C48 H36 N20 O16 -","4","1","HA1224","Zhang, De-Chun; Fei, Zheng-Hao; Zhang, Tian-Zhu; Zhang, Yan-Qiu; Yu, Kai-Bei","1,3-Bis(3-nitrophenyl)triazene","Acta Crystallographica Section C","1999","55","1","102","104","10.1107/S0108270198010415","","","0.71073","MoKα","","0.0658","0.0381","","0.1184","0.0923","","","","0.901","1.067","1.067","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008079","57.344","0.002","9.7802","0.0004","10.6263","0.0005","90","","90","","90","","5959.6","0.4","293","2","293","2","","","","","","","","3","F d d 2","F 2 -2d","43","","4-Methyl-7,7a,13a,14-tetrahydrobenzo[1,4]dioxino[2,3;6,7]naphtho[1,2-b] pyran-2-one.","","- C20 H16 O4 -","- C20 H16 O4 -","- C320 H256 O64 -","16","1","HA1226","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan; Ibrahim Abdul Razak","4-Methyl-7,7a,13a,14-tetrahydrobenzo[<i>e</i>]pyrano[2',3':5,6]naphtho[2,3-<i>b</i>][1,4]dioxin-2-one","Acta Crystallographica Section C","1999","55","1","91","92","10.1107/S0108270198010427","","","0.71073","MoKα","","0.1142","0.0653","","0.1547","0.1317","","","","1.042","1.134","1.134","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008080","8.0204","0.0003","27.1881","0.0011","8.942","0.0004","90","","106.332","0.001","90","","1871.21","0.13","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(3,5-dimethylpyrazole-N^2^)bis(thiocyanato-N)cobalt(II) monohydrate","","- C12 H18 Co N6 O S2 -","- C12 H18 Co N6 O S2 -","- C48 H72 Co4 N24 O4 S8 -","4","1","HA1228","Xiao-Feng Chen; Shu-Hua Liu; Xiao-Zeng You; Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak","Bis(3,5-dimethylpyrazole-<i>N</i>^2^)bis(thiocyanato-<i>N</i>)cobalt(II) monohydrate","Acta Crystallographica Section C","1999","55","1","22","24","10.1107/S0108270198010142","","","0.71073","MoKα","","0.064","0.059","","0.135","0.132","","","","1.264","1.304","1.304","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008081","13.0323","0.0003","23.9443","0.0001","3.7927","0.0001","90","","90","","90","","1183.51","0.04","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","2-Aminopyrimidine-Terephthalic acid (1:1) complex","","- C12 H11 N3 O4 -","- C12 H11 N3 O4 -","- C48 H44 N12 O16 -","4","0.5","HA1229","Shyamaprosad Goswami; Ajit Kumar Mahapatra; Kumaresh Ghosh; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun","2-Aminopyrimidine–terephthalic acid (1:1) complex","Acta Crystallographica Section C","1999","55","1","87","89","10.1107/S0108270198010749","","","0.71073","MoKα","","0.0532","0.0384","","0.1055","0.0939","","","","1.073","1.098","1.098","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008082","5.3172","0.0001","15.3099","0.0003","15.3406","0.0001","90","","91.846","0.001","90","","1248.17","0.03","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Hydroxy-5-methyl-3-(morpholinomethyl)benzaldehyde","","- C13 H17 N O3 -","- C13 H17 N O3 -","- C52 H68 N4 O12 -","4","1","HA1231","S.Shanmuga Sundara Raj; R.Thirumurugan; G.Shanmugam; Hoong-Kun Fun; J.Manonmani; M.Kandaswamy","2-Hydroxy-5-methyl-3-(morpholinomethyl)benzaldehyde, (I), and 4,4'-dimethyl-6,6'-bis(morpholinomethyl)-2,2'-(ethylenedinitrilodimethylidyne)diphenol, (II)","Acta Crystallographica Section C","1999","55","1","94","97","10.1107/S0108270198010750","","","0.71073","MoKα","","0.0667","0.049","","0.1487","0.1355","","","","1.07","1.143","1.143","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008083","11.1356","0.0005","9.5825","0.0005","12.4721","0.0006","90","","98.828","0.002","90","","1315.09","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,4'-Dimethyl-6,6'-bis(morpholinomethyl)-2,2'-ethylene dinitrilodimethylidyne)diphenol","","- C28 H38 N4 O4 -","- C28 H38 N4 O4 -","- C56 H76 N8 O8 -","2","0.5","HA1231","S.Shanmuga Sundara Raj; R.Thirumurugan; G.Shanmugam; Hoong-Kun Fun; J.Manonmani; M.Kandaswamy","2-Hydroxy-5-methyl-3-(morpholinomethyl)benzaldehyde, (I), and 4,4'-dimethyl-6,6'-bis(morpholinomethyl)-2,2'-(ethylenedinitrilodimethylidyne)diphenol, (II)","Acta Crystallographica Section C","1999","55","1","94","97","10.1107/S0108270198010750","","","0.71073","MoKα","","0.1268","0.0646","","0.1749","0.1392","","","","1.037","1.135","1.135","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008084","7.797","0.0006","9.4921","0.0007","9.7074","0.0007","89.506","0.002","74.124","0.002","79.242","0.002","678.21","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","o-Chlorobenzaldehyde Nicotinoylhydrazone Dihydrate","","- C13 H14 Cl N3 O3 -","- C13 H14 Cl N3 O3 -","- C26 H28 Cl2 N6 O6 -","2","1","HA1232","Zhong-lin Lu; Bei-sheng Kang; Hoong-Kun Fun; Ibrahim Abdul Razak; Kandasamy Chinnakali","<i>o</i>-Chlorobenzaldehyde nicotinoylhydrazone dihydrate","Acta Crystallographica Section C","1999","55","1","89","91","10.1107/S010827019801138X","","","0.71073","MoKα","","0.0798","0.0535","","","","0.1506","","","","","","1.043","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008085","9.3876","0.0001","12.4039","0.0002","12.755","0.0003","104.807","0.001","99.431","0.001","110.927","0.001","1286.54","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1,2-bis(4-tert-butyl-pyridine-2-carboxamido)-4,5-dichlorobenzene","","- C26 H28 Cl2 N4 O2 -","- C26 H28 Cl2 N4 O2 -","- C52 H56 Cl4 N8 O4 -","2","1","HA1233","Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak; Zhen Shen; Jing-Lin Zuo; Xiao-Zeng You","<i>N</i>,<i>N</i>'-(4,5-Dichloro-<i>o</i>-phenylene)bis(4-<i>tert</i>-butylpyridine-2-carboxamide)","Acta Crystallographica Section C","1999","55","1","99","100","10.1107/S0108270198011445","","","0.71073","MoKα","","0.129","0.075","","","","0.176","","","","","","1.074","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008086","13.3256","0.0005","6.9775","0.0003","13.9402","0.0006","90","","113.881","0.002","90","","1185.19","0.09","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","3-Methyl-4-amino-5-mercapto-1,2,4-triazole derivative of p-nitro phenylaldehyde","","- C10 H9 N5 O2 S -","- C10 H9 N5 O2 S -","- C40 H36 N20 O8 S4 -","4","1","HA1234","Yuan-Fang Liu; Suchada Chantrapromma; S. Shanmuga Sundara Raj; Hoong-Kun Fun; Yin-Han Zhang; Fu-Xin Xie; Yu-Peng Tian; Shi-Sheng Ni","4-Amino-3-methyl-1,2,4-triazole-5-thione derivative of <i>p</i>-nitrophenylaldehyde","Acta Crystallographica Section C","1999","55","1","93","94","10.1107/S0108270198010762","","","0.71073","MoKα","","0.1853","0.0773","","0.1687","0.1301","","","","1.036","1.23","1.23","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008087","17.174","0.003","8.9483","0.0016","22.132","0.004","90","","99.313","0.013","90","","3356.4","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","octacarbonyl-1κ^3^C,2κ^3^C,3κ^2^C-bis(μ~3~-3,3-diphenylallenylidene -1:2κ^2^C^1^:3(1,2-η^2^))-triangulo-triiron(0)(3 Fe‒Fe)","","- C38 H20 Fe3 O8 -","- C38 H20 Fe3 O8 -","- C152 H80 Fe12 O32 -","4","1","JZ1302","Zachara, Janusz; Zimniak, Andrzej","A new polymorph of a carbonyliron complex from tetraphenylhexapentaene: bis(μ~3~,η^2^,σ^2^-diphenylallenylidene)octacarbonyltriiron","Acta Crystallographica Section C","1999","55","1","58","60","10.1107/S010827019801107X","","","0.71073","MoKα","","0.037","0.029","","0.074","0.071","0.074","","","1.033","","","1.033","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008088","10.2987","0.0008","10.1307","0.0006","11.1151","0.0008","90","","115.338","0.007","90","","1048.11","0.14","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,3,-Diamino-5-ammonio-1,3,5-trideoxy-cis-inositol iodide","","- C6 H16 I N3 O3 -","- C6 H16 I N3 O3 -","- C24 H64 I4 N12 O12 -","4","1","JZ1311","Guido J. Reiß; Kaspar Hegetschweiler; Jürgen Sander","1,3-Diamino-5-ammonio-1,3,5-trideoxy-<i>cis</i>-inositol iodide","Acta Crystallographica Section C","1999","55","1","123","126","10.1107/S0108270198009974","","","0.71073","MoKα","","0.027","0.025","","","","0.058","","","","","","1.079","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008089","15.0798","0.0016","7.5653","0.0005","12.6522","0.0014","90","","114.212","0.011","90","","1316.4","0.2","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Polymeric aqua(N-ethylurea-O)(N-pyruvidene-β-alaninato-O,N,O')copper(II)","","- C9 H17 Cu N3 O6 -","- C9 H17 Cu N3 O6 -","- C36 H68 Cu4 N12 O24 -","4","1","JZ1313","Warda, Salam A.","Polymeric aqua(<i>N</i>-ethylurea-<i>O</i>)(<i>N</i>-pyruvidene-β-alaninato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1999","55","1","52","54","10.1107/S0108270198010166","","","0.71073","MoKα","","","0.029","","","","0.059","","","","","","0.903","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008090","8.0916","0.0009","8.0916","0.0009","30.078","0.004","90","","90","","90","","1969.3","0.4","293","2","","","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","2-(2-Pyrrolyl)-benzothiazole","","- C11 H8 N2 S -","- C11 H8 N2 S -","- C88 H64 N16 S8 -","8","1","KA1289","Davidović, Naka; Matković-Čalogović, Dubravka; Popović, Zora; Fišer-Jakić, Lelja","2-(2-Pyrrolyl)-1,3-benzothiazole","Acta Crystallographica Section C","1999","55","1","119","120","10.1107/S0108270198011731","","","0.71073","MoKα","","0.2326","0.0552","","","","0.0865","","","","","","0.899","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008091","21.331","0.004","12.203","0.002","20.881","0.004","90","","92.26","0.03","90","","5431.1","1.7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","(FN2O4)2","35,44-difluoro-6,9,23,26,38,41,47,50-octaoxa-3,12,20,29-tetraaza- pentacyclo[29.8(3,12)8(20,29)3(1,31)1(1,31)1(14,18)]dopentaconta -14,16,18(44),31,33,1(35)-hexene","","- C42 H62 Cs2 F8 N4 O14 S2 -","- C42 H62 Cs2 F8 N4 O14 S2 -","- C168 H248 Cs8 F32 N16 O56 S8 -","4","0.5","KA1299","Plenio, Herbert; Hermann, Jorg","A cylindrical macrocycle with two caesium cations sandwiched between two diaza-18-crown-6 macrocycles","Acta Crystallographica Section C","1999","55","1","62","64","10.1107/S0108270198011755","","","0.71069","MoKα","","0.0588","0.0365","","","","0.107","","","","","","1.046","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008092","7.3502","0.0013","12.0783","0.0015","12.476","0.007","80.28","0.03","79.53","0.03","72.713","0.013","1032.1","0.6","293","","","","","","","","","","","6","P -1","-P 1","2","","Chloro-(N,N'-bis(2-methylpyridyl)-1,5-diazacyclooctane) nickel(II) perchlorate","","- C18 H24 Cl2 N4 Ni O4 -","- C18 H24 Cl2 N4 Ni O4 -","- C36 H48 Cl4 N8 Ni2 O8 -","2","1","LN1060","Bu, Xian-He; Fang, Ya-Yin; Shang, Zhi-Liang; Zhang, Ruo-Hua; Zhu, Hong-Ping; Liu, Qiu-Tian","[1,5-Bis(2-pyridylmethyl-<i>N</i>)-1,5-diazacyclooctane-<i>N</i>,<i>N</i>']chloronickel(II) perchlorate","Acta Crystallographica Section C","1999","55","1","39","41","10.1107/S0108270198010841","","","0.71073","MoKα","","","0.0481","","","0.0609","","","","","","","1.21","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008093","7.532","0.005","13.278","0.002","23.7103","0.001","90","","90","","90","","2371.3","1.6","122","0.5","122","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-(2-nitrophenyl)-4-phenylbutadiyne","","- C16 H9 N O2 -","- C16 H9 N O2 -","- C128 H72 N8 O16 -","8","1","LN1068","Hanne Skov Bengaard; Sine Larsen; Henning Osholm Sørensen; Kathryn J. Robinson; John D. Wallis","Interaction between an oxygen and an alkynyl-carbon atom in 1-(2-nitrophenyl)-4-phenylbutadiyne","Acta Crystallographica Section C","1999","55","1","106","108","10.1107/S0108270198010853","","","1.5418","CuKα","","0.0385","0.0364","","0.0888","0.0885","","","","3.456","3.572","3.572","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008094","8.956","0.002","11.76","0.003","8.781","0.002","103.2","0.03","108.6","0.04","91.4","0.03","848.6","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-Methylpiperazinium Trichloro(N-methylpiperazine-N^1^)cobaltate(II)","","- C10 H25 Cl3 Co N4 -","- C10 H25 Cl3 Co N4 -","- C20 H50 Cl6 Co2 N8 -","2","1","NA1379","Marzotto, Armando; Clemente, Dore Augusto; Valle, Giovanni","Cobalt(II) complexes of piperazine and derivatives: 1-methylpiperazin-4-ium trichloro(1-methylpiperazine-<i>N</i>^4^)cobaltate(II)","Acta Crystallographica Section C","1999","55","1","43","46","10.1107/S0108270198009603","","","0.7107","MoKα","","0.055","0.033","","0.097","0.086","","","","1.073","1.097","1.097","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008095","12.406","0.002","14.313","0.002","15.299","0.002","90","","90","","90","","2716.6","0.7","300","","","","","","","","","","","4","C 2 2 21","C 2c 2","20","(R)-1,1'-binaphthyl-2,2'-diol-(R,R)-1,2-cyclohexanediamine-toluene (1/1/1)","","","- C33 H36 N2 O2 -","- C33 H44 N2 O2 -","- C132 H176 N8 O8 -","4","0.5","OA1035","Fukushima, Shigeru; Hosomi, Hiroyuki; Ohba, Shigeru; Kawashima, Masatoshi","Diastereomeric complexes of 1,1'-binaphthyl-2,2'-diol and (<i>R</i>,<i>R</i>)-1,2-cyclohexanediamine","Acta Crystallographica Section C","1999","55","1","120","123","10.1107/S010827019800105X","","","0.71073","MoKα","","","0.076","","","","0.086","","","","","","1.41","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008096","8.056","0.001","13.552","0.001","10.822","0.001","90","","111.53","0.01","90","","1099.1","0.2","300","","","","","","","","","","","4","P 1 21 1","P 2yb","4","(S)-2,2'-dihydroxy-1,1'-binaphthyl (R,R)-1,2-cyclohexanediamine","","","- C26 H28 N2 O2 -","- C26 H28 N2 O2 -","- C52 H56 N4 O4 -","2","1","OA1035","Fukushima, Shigeru; Hosomi, Hiroyuki; Ohba, Shigeru; Kawashima, Masatoshi","Diastereomeric complexes of 1,1'-binaphthyl-2,2'-diol and (<i>R</i>,<i>R</i>)-1,2-cyclohexanediamine","Acta Crystallographica Section C","1999","55","1","120","123","10.1107/S010827019800105X","","","0.71073","MoKα","","","0.056","","","","0.065","","","","","","1","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008097","12.146","0.003","12.682","0.006","10.842","0.008","115.26","0.04","93.17","0.04","86.49","0.03","1506.7","1.5","295","","295","","","","","","","","","6","P 1","P 1","1","","","","- C27 H37 N3 O4 S3 Zn -","- C27 H37 N3 O4 S3 Zn -","- C54 H74 N6 O8 S6 Zn2 -","2","2","OA1049","Nakai, Hiroshi; Kobayashi, Shinobu; Ozaki, Mamoru; Hayase, Yoshio; Takeda, Reiji","Micacocidin A","Acta Crystallographica Section C","1999","55","1","54","56","10.1107/S0108270198010920","","","0.7107","MoKα","","0.055","0.055","","","","0.065","","","","","","1","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008098","15.146","0.006","10.936","0.004","4.328","0.001","90","","97.5","0.02","90","","710.7","0.4","296","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C7 H6 N4 -","- C7 H6 N4 -","- C28 H24 N16 -","4","1","OA1063","Takehiro Matsunaga; Yoshio Ohno; Yoshiaki Akutsu; Mitsuru Arai; Masamitsu Tamura; Mitsuaki Iida","1-Phenyltetrazole","Acta Crystallographica Section C","1999","55","1","129","131","10.1107/S0108270198009718","","","0.71073","MoKα","","","0.053","","","","0.041","","","","","","1.406","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008099","19.87","0.007","4.731","0.007","14.813","0.007","90","","121.98","0.04","90","","1181","2","296.2","","296.2","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","β phthalocyanine","","- C32 H18 N8 -","- C32 H18 N8 -","- C64 H36 N16 -","2","0.5","OA1066","Shinya Matsumoto; Keiji Matsuhama; Jin Mizuguchi","β Metal-free phthalocyanine","Acta Crystallographica Section C","1999","55","1","131","133","10.1107/S0108270198011020","","","0.7107","MoKα","","0.1018","0.0552","","0.0688","0.0592","","","","1.124","1.182","1.182","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008100","4.1662","0.0003","4.1662","0.0003","8.2085","0.0007","90","","90","","90","","142.477","0.019","293","2","293","2","","","","","","","","4","P 4/m m m","-P 4 2","123","","","","- Ba Nb3.47 O6 Ti0.53 -","- Ba Nb3.466 O6 Ti0.534 -","- Ba Nb3.466 O6 Ti0.534 -","1","0.0625","OS1024","Svensson, Gunnar; Eriksson, Lars","BaNb~4-<i>x~</i>Ti~<i>x~</i>O~6~ (<i>x</i> = 0.53)","Acta Crystallographica Section C","1999","55","1","17","19","10.1107/S0108270198010932","","","0.71073","MoKα","","0.021","0.016","","0.028","","0.027","","","1.128","","","1.185","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008101","8.2535","0.0001","9.2084","0.0001","5.161","0.0001","90","","90","","90","","392.244","0.01","293","","293","","","","","","","","","4","I m m 2","I 2 -2","44","","","","- Ba Ca Ga4 O8 -","- Ba Ca Ga4 O8 -","- Ba2 Ca2 Ga8 O16 -","2","0.25","OS1030","Shun-ich Kubota; Hisanori Yamane; Masahiko Shimada","A powder diffraction study of BaCaGa~4~O~8~","Acta Crystallographica Section C","1999","55","1","14","17","10.1107/S0108270198010178","","","1.54056","CuKα","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008102","27.447","0.009","20.311","0.006","18.718","0.005","90","","90","","90","","10435","5","193","2","193","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","aquatetrakis[(4-chlorobenzoato)-μ~3~-(2-dimethylaminoethanolato)- copper(II)] hydrate","","- C44 H60 Cl4 Cu4 N4 O14 -","- C44 H60 Cl4 Cu4 N4 O14 -","- C352 H480 Cl32 Cu32 N32 O112 -","8","1","OS1032","Turpeinen, Urho; Hämälänen, Reijo; Mutikainen, Ilpo","Aquatetrakis[(4-chlorobenzoato)(μ~3~-2-dimethylaminoethanolato)copper(II)] hydrate","Acta Crystallographica Section C","1999","55","1","50","52","10.1107/S0108270198011457","","","0.71073","MoKα","","0.114","0.075","","","0.133","0.147","","","","","","1.031","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008103","12.3698","0.0005","12.3698","0.0005","49.306","0.003","90","","90","","90","","7544.4","0.6","100","2","100","2","","","","","","","","6","P 41","P 4w","76","Ru-bis(terpyridine)(PF~6~)~2~","Bis(2,2',6':2''-terpyridine)Ru(II)(PF~6~)~2~ acetonitrile solvate","","- C34 H28 F12 N8 P2 Ru -","- C34 H28 F12 N8 P2 Ru -","- C272 H224 F96 N64 P16 Ru8 -","8","2","OS1037","Kianosh Lashgari; Mikael Kritikos; Rolf Norrestam; Thomas Norrby","Bis(terpyridine)ruthenium(II) bis(hexafluorophosphate) diacetonitrile solvate","Acta Crystallographica Section C","1999","55","1","64","67","10.1107/S0108270198011378","","","0.71073","MoKα","","0.0579","0.0543","","","","0.1481","","","","","","1.064","","","","has coordinates,has disorder","301791","2025-08-18","23:15:32",""
"2008104","10.794","0.003","5.054","0.002","27.143","0.01","90","","90.26","0.05","90","","1480.7","0.9","193","2","193","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","(2SR,5RR,6RR,9SR)-1,2,5,6,9,10-hexachlorodecane","","- C10 H16 Cl6 -","- C10 H16 Cl6 -","- C40 H64 Cl24 -","4","0.5","QA0048","Frenzen, Gerlinde; Sippel, Heike; Coelhan, Mehmet","The relative configuration of a stereoisomer of 1,2,5,6,9,10-hexachlorodecane","Acta Crystallographica Section C","1999","55","1","IUC9800079","","10.1107/S0108270199099965","","","0.71073","MoKα","","0.068","0.051","","","","0.146","","","","","","1.062","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008105","7.0459","0.0014","9.3399","0.0014","12.913","0.003","90","","92.72","0.02","90","","848.8","0.3","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","m-Azidobenzensulfonyl chloride","","- C6 H4 Cl N3 O2 S -","- C6 H4 Cl N3 O2 S -","- C24 H16 Cl4 N12 O8 S4 -","4","1","QA0068","Ziemer, Burkhard; Sauer, Erika","<i>m</i>-Azidobenzenesulfonyl chloride","Acta Crystallographica Section C","1999","55","1","IUC9800074","","10.1107/S0108270199099953","","","0.71073","MoKα","","0.037","0.032","","0.094","0.086","","","","1.037","1.079","1.079","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008106","11.329","0.003","6.6648","0.0016","12.995","0.003","90","","112.821","0.016","90","","904.4","0.4","120","2","120","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","6,7-Dimethyltricyclo[3.2.2.0]non-6-ene","","- C11 H16 -","- C11 H16 -","- C44 H64 -","4","1","QA0072","Boese, Roland; Roth, Wolfgang R.; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","6,7-Dimethyltricyclo[3.2.2.0]non-6-ene at 120 K, a [3.2.2]propellane derivative","Acta Crystallographica Section C","1999","55","1","IUC9800075","","10.1107/S0108270199099941","","","0.71073","MoKα","","0.0546","0.0467","","","","0.1347","","","","","","1.056","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008107","13.455","0.005","30.61","0.01","6.694","0.005","90","","90","","90","","2757","2","293","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(1R,2R,5S,7R,8R)-2,6,6,8-tetramethyl-8-hydroxy tricyclo[5.3.1^1,7^.0^1,5^]undecan-9-one","","- C30 H48 O4 -","- C30 H48 O4 -","- C120 H192 O16 -","4","1","QA0073","Ai, Hui; Song, Yi-Lin; Tao, Feng-Gang","8-Hydroxycedran-9-one","Acta Crystallographica Section C","1999","55","1","IUC9800080","","10.1107/S010827019909993X","","","0.7107","MoKα","","","0.056","","","0.057","","","","","1.73","1.73","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008108","8.649","0.002","9.679","0.002","15.721","0.002","90","","94.82","0.01","90","","1311.4","0.4","293.2","","293.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H4 O2 S5 -","- C12 H4 O2 S5 -","- C48 H16 O8 S20 -","4","1","QA0074","Ueda, Kazumasa; Iwamatsu, Masaki; Sugimoto, Toyonari","1,3,4,6-Tetrathiapentalene-5-spiro-2'-indan-2,1',3'-trione and its 2-thione analogue","Acta Crystallographica Section C","1999","55","1","IUC9800077","","10.1107/S0108270199099928","","","1.5418","CuKα","","0.041","0.041","","","","0.061","","","","","","1.272","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008109","7.946","0.004","10.2","0.003","15.638","0.003","90","","104.3","0.02","90","","1228.2","0.8","293.2","","293.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H4 O3 S4 -","- C12 H4 O3 S4 -","- C48 H16 O12 S16 -","4","1","QA0074","Ueda, Kazumasa; Iwamatsu, Masaki; Sugimoto, Toyonari","1,3,4,6-Tetrathiapentalene-5-spiro-2'-indan-2,1',3'-trione and its 2-thione analogue","Acta Crystallographica Section C","1999","55","1","IUC9800077","","10.1107/S0108270199099928","","","1.5418","CuKα","","0.039","0.039","","","","0.06","","","","","","1.312","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008110","11.15","0.002","9.028","0.002","25.637","0.005","90","","91.37","0.03","90","","2579.9","0.9","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","(ClN2O4)2 - 2AgCF3SO3","μ-[35,44-dichloro-6,9,23,26,38,41,47,50-octaoxa-3,12,20,29-tetraaza- pentacyclo[29.8^3,12^.8^20,29^.3^1,31^.1^1,31^.1^14,18^]dopentaconta -14,16,18(44),31,33,1(35)-hexene]disilver(I) bis(triflate)","","- C42 H62 Ag2 Cl2 F6 N4 O14 S2 -","- C42 H62 Ag2 Cl2 F6 N4 O14 S2 -","- C84 H124 Ag4 Cl4 F12 N8 O28 S4 -","2","0.5","QA0077","Plenio, Herbert; Diodone, Ralph","A cylindrical macrocycle with two diaza-18-crown-6 macrocycles encapsulating two silver cations","Acta Crystallographica Section C","1999","55","1","IUC9800081","","10.1107/S0108270199099990","","","0.71069","MoKα","","0.038","0.028","","","","0.072","","","","","","1.042","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:32",""
"2008111","12.2502","0.0016","6.5155","0.0011","12.415","0.002","90","","108.866","0.011","90","","937.7","0.3","120","2","120","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","Tricarbonyl(2,3,6,7-η)-(2,3-diylidenfurane)-iron(0)","","- C9 H6 Fe O4 -","- C9 H6 Fe O4 -","- C36 H24 Fe4 O16 -","4","1","QA0078","Boese, Roland; Roth, Wolfgang R.; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","Tricarbonyl[(2,3,6,7-η)-2,3-dimethylene-2,3-dihydrofuran]iron(0) at 120K","Acta Crystallographica Section C","1999","55","1","IUC9800082","","10.1107/S0108270199099989","","","0.71073","MoKα","","0.031","0.03","","","","0.081","","","","","","1.154","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008112","8.146","0.001","8.927","0.001","9.29","0.001","101.14","0.01","100.95","0.01","102.78","0.01","627.01","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-phenoxymethanesulfonanilide","","- C13 H13 N O3 S -","- C13 H13 N O3 S -","- C26 H26 N2 O6 S2 -","2","1","QB0069","Chandramohan, Kattamuri; Ravikumar, Krishnan","A nimesulide intermediate","Acta Crystallographica Section C","1999","55","1","IUC9800078","","10.1107/S0108270199099916","","","0.71073","MoKα","","0.051","0.04","","0.116","0.108","","","","1.036","1.06","1.06","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008113","15.193","0.002","15.193","0.002","17.273","0.003","90","","90","","90","","3987.1","1","100","","100","","","","","","","","","5","I -4 c 2","I -4 -2c","120","","Bis(μ-hydroxo)tris(trimethyltin) iodide","","- C9 H29 I O2 Sn3 -","- C9 H29 I O2 Sn3 -","- C72 H232 I8 O16 Sn24 -","8","0.5","QB0070","Saurage, Andrea S.; Billodeaux, Damon R.; Hammer, Robert P.; Fronczek, Frank R.","Di-μ-hydroxo-tris(trimethyltin) iodide at 100K","Acta Crystallographica Section C","1999","55","1","IUC9800076","","10.1107/S0108270199099977","","","0.71073","MoKα","","0.061","0.034","","","","0.072","","","","","","1.004","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008114","9.0306","0.001","6.6484","0.001","12.8","0.002","90","","96.88","0.01","90","","762.97","0.19","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Potassium bromoaurate","Potassium tetrabromoaurate III","","- Au Br4 K -","- Au Br4 K -","- Au4 Br16 K4 -","4","1","SK1203","Omrani, Hedi; Welter, Richard; Vangelisti, Rene","Potassium tetrabromoaurate(III)","Acta Crystallographica Section C","1999","55","1","13","14","10.1107/S010827019801110X","","","0.5608","AgKα","","0.09","0.042","","","","0.101","","","","","","1.032","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008115","14.936","0.001","14.936","0.001","9.913","0.001","90","","90","","120","","1915.2","0.3","293","","293","","","","","","","","","5","P -3","-P 3","147","","(1,4,7-Tris(3-tert-butyl-5-methyl-2-hydroxybenzyl)-1,4, 7-triazacyclononanato-N,N',N'',O,O',O'')chromium(III)","","- C42 H60 Cr N3 O3 -","- C42 H60 Cr N3 O3 -","- C84 H120 Cr2 N6 O6 -","2","0.333333","SK1214","Martin, Lisandra L.; Taylor, Max R.; Bei Wu","[1,4,7-Tris(3-<i>tert</i>-butyl-5-methyl-2-hydroxybenzyl)-1,4,7-triazacyclononanato-<i>N</i>,<i>N</i>',<i>N</i>'',<i>O</i>,<i>O</i>',<i>O</i>'']chromium(III)","Acta Crystallographica Section C","1999","55","1","41","43","10.1107/S0108270198010956","","","0.71073","MoKα","","0.074","0.062","","0.095","0.091","","","","1.237","1.247","1.247","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008116","9.202","0.001","18.87","0.003","19.138","0.002","90","","90","","90","","3323.2","0.7","298","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H19 N O2 S2 -","- C18 H19 N O2 S2 -","- C144 H152 N8 O16 S16 -","8","1","SK1227","Hökelek, Tuncer; Patır, Süleyman; Uludağ, Nesi̇mi̇","9-Acetonyl-3-ethylidene-1,2,3,4-tetrahydrospiro[carbazole-1,2'-[1,3]dithiolan]-4-one","Acta Crystallographica Section C","1999","55","1","114","116","10.1107/S0108270198011019","","","0.71073","MoKα","","","0.038","","","0.048","","","","","1.22","1.22","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008117","13.7343","0.0002","6.1274","0.0002","25.2459","0.0007","90","","92.277","0.001","90","","2122.91","0.1","203","2","203","2","","","","","","","","3","C 1 2 1","C 2y","5","Scalarolide","12β-hydroxyscalar-17-en-20,19-olide","","- C25 H38 O3 -","- C25 H38 O3 -","- C100 H152 O12 -","4","1","SX1072","Cambie, Richard C.; Rickard, Clifton E. F.; Rutledge, P. Stewart; Yang, Xiao-Shuang","Scalarolide and scalarin, sesterterpenes from Cacospongia and Ircinia sponges","Acta Crystallographica Section C","1999","55","1","112","114","10.1107/S0108270198011305","","","0.71073","MoKα","","0.1057","0.085","","","0.226","0.2453","","","","","","1.072","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008118","6.3833","0.0003","10.9108","0.0006","37.2967","0.0019","90","","90","","90","","2597.6","0.2","203","2","203","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Scalarin","12α-acetoxy-19α-hydroxyscalar-19,20-olide methanol solvate","","- C28 H44 O6 -","- C28 H44 O6 -","- C112 H176 O24 -","4","1","SX1072","Cambie, Richard C.; Rickard, Clifton E. F.; Rutledge, P. Stewart; Yang, Xiao-Shuang","Scalarolide and scalarin, sesterterpenes from Cacospongia and Ircinia sponges","Acta Crystallographica Section C","1999","55","1","112","114","10.1107/S0108270198011305","","","0.71073","MoKα","","0.0934","0.0565","","","","0.1346","","","","","","1.076","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008119","9.233","0.005","12.952","0.003","13.943","0.005","90","0.3","105.93","0.01","90","","1603.4","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-isobutyl-2,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-3-indoleacetic acid","","- C17 H25 N O3 -","- C17 H25 N O3 -","- C68 H100 N4 O12 -","4","1","VJ1085","S. Deepthi; Vasantha Pattabhi; K.Nagarajan","1-Isobutyl-2,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-3-indoleacetic acid","Acta Crystallographica Section C","1999","55","1","100","102","10.1107/S0108270198010373","","","1.5418","CuKα","","0.0421","0.0361","","0.108","0.1031","","","","1.102","1.142","1.142","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008120","7.713","0.002","8.674","0.001","28.325","0.006","90","","90","","90","","1895","0.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Ter-butoxy carbonyl L-Leucyl-L-Threonyl amide","","- C15 H29 N3 O5 -","- C15 H28 N3 O5 -","- C60 H112 N12 O20 -","4","1","VJ1089","S. Banumathi; D. Velmurugan; E. Subramanian; N. Ashish; R. Kishore","<i>tert</i>-Butoxycarbonyl-<small>L</small>-leucyl-<small>L</small>-threoninamide","Acta Crystallographica Section C","1999","55","1","78","79","10.1107/S0108270198010385","","","1.5418","CuKα","","0.0619","0.059","","","","0.1759","","","","","","1.008","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008121","6.462","0.001","33.014","0.007","10.457","0.002","90","","93.3","0.03","90","","2227.2","0.7","183","2","183","2","","","","","","","","3","P 1 21 1","P 2yb","4","isoavarol diacetate","2-(perhydro-1,2,4a-trimethyl-5-methylene-1-naphthylmethyl)-p-phenylene diacetate","","- C25 H34 O4 -","- C25 H34 O4 -","- C100 H136 O16 -","4","2","AV1024","Ilyin, Sergey G.; Shubina, Larisa K.; Stonik, Valentine A.; Antipin, Michael Yu.","Isoavarol diacetate","Acta Crystallographica Section C","1999","55","2","266","268","10.1107/S0108270198010993","","","0.71069","MoKα","","0.084","0.05","","0.076","","0.066","","","3.555","","","3.385","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008122","5.621","0.001","8.766","0.001","4.797","0.001","90","","90","","90","","236.37","0.07","293","2","293","2","","","","","","","","5","P m n 21","P 2ac -2","31","","cobalt ammonium hydrate phosphate","","- Co H6 N O5 P -","- Co H6 N O5 P -","- Co2 H12 N2 O10 P2 -","2","0.5","AV1025","Yakubovich, Olga V.; Karimova, Oksana V.; Dimitrova, Olga V.; Massa, Werner","Layer structure of (NH~4~)CoPO~4~","Acta Crystallographica Section C","1999","55","2","151","153","10.1107/S0108270198011639","","","0.71073","MoKα","","0.0152","0.0145","","","","0.0368","","","","","","1.145","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2008123","14.348","0.006","11.493","0.006","13.936","0.006","90","","95.43","0.04","90","","2287.8","1.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","(4,4'-bipyridine)bis(1,3-diaminopropane)nickel(II) perchlorate","","- C16 H28 Cl2 N6 Ni O8 -","- C16 H28 Cl2 N6 Ni O8 -","- C64 H112 Cl8 N24 Ni4 O32 -","4","0.5","BK1408","Tong, Ye-Xiang; Tong, Ming-Liang; Yu, Xiao-Lan; Chen, Xiao-Ming","<i>catena</i>-Poly[[[bis(1,3-diaminopropane-<i>N</i>,<i>N</i>')nickel(II)]-μ-(4,4'-bipyridine-<i>N</i>:<i>N</i>')] diperchlorate]","Acta Crystallographica Section C","1999","55","2","180","182","10.1107/S0108270198011482","","","0.71073","MoKα","","0.046","0.035","","0.091","0.084","","","","1.07","1.106","1.106","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008124","9.2836","0.0012","11.4842","0.0013","13.7777","0.0012","106.896","0.002","90.436","0.003","93.93","0.002","1401.6","0.3","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H28 N12 O41 Sm2 -","- C42 H30 N12 O42 Sm2 -","- C42 H30 N12 O42 Sm2 -","1","0.5","BM1246","Arici, Cengiz; Ülkü, Dinçer; Tahir, M. Nawaz; Ünaleroḡlu, Canan","Samarium 3,5-dinitrobenzoate dihydrate","Acta Crystallographica Section C","1999","55","2","198","200","10.1107/S0108270198012323","","","0.71073","MoKα","","","0.035","","","0.038","","","","","1.12","1.12","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008125","9.088","0.002","8.108","0.002","10.505","0.002","90","","102.14","0.01","90","","756.8","0.3","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C5 H10 N2 O3 S -","- C5 H10 N2 O3 S -","- C20 H40 N8 O12 S4 -","4","1","BM1255","Kennedy, Alan R.; Skellern, Graham G.; Pfirrmann, Rolf W.; Smail, Gordon A.; Shankland, Norman; Florence, Alastair J.","Two new compounds by reaction of taurolidine with methylene glycol","Acta Crystallographica Section C","1999","55","2","232","234","10.1107/S0108270198008415","","","0.71069","MoKα","","0.111","0.048","","0.058","0.051","","","","","1.578","1.578","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008126","14.53","0.001","8.0567","0.0008","15.928","0.002","90","","101.642","0.008","90","","1826.2","0.3","295","","295","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 N6 O6 S3 -","- C12 H24 N6 O6 S3 -","- C48 H96 N24 O24 S12 -","4","1","BM1255","Kennedy, Alan R.; Skellern, Graham G.; Pfirrmann, Rolf W.; Smail, Gordon A.; Shankland, Norman; Florence, Alastair J.","Two new compounds by reaction of taurolidine with methylene glycol","Acta Crystallographica Section C","1999","55","2","232","234","10.1107/S0108270198008415","","","0.71069","MoKα","","0.067","0.038","","0.058","0.054","","","","","1.972","1.972","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008127","10.6849","0.0002","15.7703","0.0004","17.7065","0.0004","89.543","0.001","72.857","0.001","71.607","0.001","2693.49","0.11","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Trichloro(1,1'-bis(diphenylphosphine oxide)methane-p',p'')antimony(III)","","- C25 H22 Cl3 O2 P2 Sb -","- C25 H22 Cl3 O2 P2 Sb -","- C100 H88 Cl12 O8 P8 Sb4 -","4","2","BM1263","Ibrahim Abdul Razak; Hoong-Kun Fun; Bohari M. Yamin; Kandasamy Chinnakali; Hasbullah Zakaria; Norismaliza Binti Ismail","Trichloro[methylenebis(diphenylphosphine oxide-<i>O</i>)]antimony(III)","Acta Crystallographica Section C","1999","55","2","172","174","10.1107/S0108270198012335","","","0.71073","MoKα","","0.045","0.035","","","","0.081","","","","","","1.095","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008128","12.316","0.002","9.606","0.002","18.296","0.003","90","","103.77","0.02","90","","2102.3","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Flemiculosin","6-cinnamoyl-5-hydroxy-2,2,8,8-tetramethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran","","- C25 H24 O4 -","- C25 H24 O4 -","- C100 H96 O16 -","4","1","BM1267","Bhattacharyya, Kinkini; Mazumdar, Sunil Kumar; Bocelli, Gabriele; Cantoni, Andrea; Ray, Anil B; Neogi, Partha; Mazumdar, Gauri","Flemiculosin, a novel chalcone","Acta Crystallographica Section C","1999","55","2","215","217","10.1107/S0108270198011421","","","1.54178","CuKα","","0.0814","0.0583","","0.2302","0.1838","","","","1.003","1.103","1.103","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008129","7.2264","0.0009","8.025","0.0018","16.5902","0.0012","90","","92.052","0.008","90","","961.5","0.3","295","","295","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H11 N O3 -","- C10 H11 N O3 -","- C40 H44 N4 O12 -","4","1","BM1270","Finnie, Stuart; Kennedy, Alan R.; Prasad, Korlakunte V. R.; Ristic, Radoljub I.; Sheen, David B.; Sherwood, John N.","<i>para</i>-Acetoxyacetanilide","Acta Crystallographica Section C","1999","55","2","234","236","10.1107/S0108270198012852","","","0.71069","MoKα","","0.1146","0.0436","","","","0.1467","","","","","","0.997","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008130","7.3402","0.0013","8.7066","0.0013","11.179","0.002","70.591","0.016","81.513","0.018","71.158","0.017","637.1","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H14 Cu O12 -","- C7 H14 Cu O12 -","- C14 H28 Cu2 O24 -","2","1","BM1282","Manojlović-Muir, Ljubica; Muir, Kenneth W.; Campbell, Robert A.; McKendrick, John E.; Robins, David J.","Pentaaqua(chelidonato-<i>O</i>^4^)copper(II) monohydrate","Acta Crystallographica Section C","1999","55","2","178","180","10.1107/S0108270198011895","","","0.71073","MoKα","","0.034","0.032","","","","0.088","","","","","","1.089","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008131","10.857","0.003","11.2892","0.0009","18.5162","0.0009","90","","90","","90","","2269.5","0.7","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2-benzyl-2-hydroxycyclohexanone","","- C13 H16 O2 -","- C13 H16 O2 -","- C104 H128 O16 -","8","1","BM1297","McCullough, Kevin J.; Perner, Iris; Rosair, Georgina M.","2-Benzyl-2-hydroxycyclohexanone","Acta Crystallographica Section C","1999","55","2","268","270","10.1107/S0108270198013869","","","0.71073","MoKα","","0.0882","0.0493","","","","0.135","","","","","","1.015","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008132","5.710728","0.000016","5.710728","0.000016","21.44383","0.0001","90","","90","","120","","605.642","0.004","295","","295","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- Ba3 Mn2 O8 -","- Ba3 Mn2 O8 -","- Ba9 Mn6 O24 -","3","0.0833333","BR1210","Weller, Mark T.; Skinner, Stephen J.","Ba~3~Mn~2~O~8~ determined from neutron powder diffraction","Acta Crystallographica Section C","1999","55","2","154","156","10.1107/S0108270198011871","","neutron","","neutron","","","0.064","","","0.07","","","","","1.7","1.7","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008133","6.777","0.001","4.915","0.001","8.455","0.002","90","","91.11","0.03","90","","281.57","0.1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","ammonium oxovanadium(IV) phosphate ammonia","ammonium oxovanadium(IV) phosphate ammonia","","- H7 N2 O5 P V -","- H7 N2 O5 P V -","- H14 N4 O10 P2 V2 -","2","1","BR1216","Fratzky, Dietmar; Worzala, Horst; Goetze, Thomas; Meisel, Manfred","NH~4~VO(NH~3~)PO~4~","Acta Crystallographica Section C","1999","55","2","156","157","10.1107/S0108270198011123","","","0.71073","MoKα","","0.05","0.034","","","","0.07","","","","","","1.035","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008134","7.756","0.006","17.107","0.002","6.09","0.002","90","","90","","90","","808","0.7","296","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C6 H10 N2 O4 -","- C6 H10 N2 O4 -","- C24 H40 N8 O16 -","4","1","CF1254","Okabe, Nobuo; Adachi, Yukari","(<i>S</i>)-2-Hydroxy-3-(1<i>H</i>-imidazol-5-yl)propanoic acid hydrate","Acta Crystallographica Section C","1999","55","2","217","218","10.1107/S0108270198012542","","","0.71069","MoKα","","","0.06","","","0.107","","","","","1.44","1.44","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008135","20.745","0.002","9.921","0.001","9.232","0.001","90","","101.15","0.01","90","","1864.2","0.3","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 N8 O2 -","- C20 H18 N8 O2 -","- C80 H72 N32 O8 -","4","1","CF1258","Nieuwenhuyzen, M.; Keirse, R.; Shaw, B.; Vos, J. G.","A 2:1 co-crystal of 5-(2-pyridyl)-1<i>H</i>-1,2,4-triazole and 1,4-dihydroxybenzene","Acta Crystallographica Section C","1999","55","2","264","266","10.1107/S0108270198012359","","","0.71073","MoKα","","0.053","0.038","","0.095","0.085","","","","1.04","1.062","1.062","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008136","7.442","0.001","18.29","0.001","10.284","0.001","90","","104.74","0.01","90","","1353.7","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","trans-diaquabis(nicotinamide-N)bis(salicylato-O)copper(II)","","- C26 H26 Cu N4 O10 -","- C26 H26 Cu N4 O10 -","- C52 H52 Cu2 N8 O20 -","2","1","CF1276","Petrovčič, Nina; Kozlevčar, Bojan; Golič, Ljubo; Leban, Ivan; Šegedin, Primož","<i>trans</i>-Diaquabis(nicotinamide-<i>N</i>)bis(salicylato-<i>O</i>)copper(II)","Acta Crystallographica Section C","1999","55","2","176","178","10.1107/S0108270198011640","","","0.71073","MoKα","","0.0555","0.034","","","","0.0972","","","","","","1.034","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008137","24.1291","0.0003","8.4281","0.0001","20.6083","0.0003","90","","90","","90","","4190.95","0.09","173","2","173","2","","","","","","","","6","P n a 21","P 2c -2n","33","","Tetra(acetonitrile-N)lithium perchlorate","","- C8 H12 Cl Li N4 O4 -","- C8 H12 Cl Li N4 O4 -","- C96 H144 Cl12 Li12 N48 O48 -","12","3","DA1013","Yokota, Yasuno; Young Jr, Victor G.; Verkade, John G.","The homoleptic lithium complex [Li(CH~3~CN)~4~]ClO~4~","Acta Crystallographica Section C","1999","55","2","196","198","10.1107/S0108270198011834","","","0.71073","MoKα","","0.083","0.057","","","","0.116","","","","1.113","1.113","1.053","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008138","21.1645","0.0001","21.1645","0.0001","28.9378","0.0001","90","","90","","120","","11225.7","0.08","298","2","298","2","","","","","","","","6","R -3 :H","-R 3","148","cuprous bromide triphenylphosphite cubane tetramer","tetra-μ~3~-bromo-tetrakis[(triphenyl phosphite-P)copper(I)]","","- C72 H60 Br4 Cu4 O12 P4 -","- C72 H60 Br4 Cu4 O12 P4 -","- C432 H360 Br24 Cu24 O72 P24 -","6","0.333333","DA1019","Pike, Robert D.; Starnes, William H. Jr; Carpenter, Gene B.","Cubane tetrameric complexes of copper(I) chloride and bromide with triphenyl phosphite","Acta Crystallographica Section C","1999","55","2","162","165","10.1107/S0108270198012451","","","0.71073","MoKα","","0.08","0.048","","0.147","","0.147","","","","","","1.131","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008139","14.6643","0.0002","22.6409","0.0003","22.6645","0.0001","90","","107.434","0.001","90","","7179.23","0.15","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","cuprous chloride triphenylphosphite cubane tetramer","tetra-μ~3~-chloro-tetrakis[(triphenyl phosphite-P)copper(I)]","","- C72 H60 Cl4 Cu4 O12 P4 -","- C72 H60 Cl4 Cu4 O12 P4 -","- C288 H240 Cl16 Cu16 O48 P16 -","4","1","DA1019","Pike, Robert D.; Starnes, William H. Jr; Carpenter, Gene B.","Cubane tetrameric complexes of copper(I) chloride and bromide with triphenyl phosphite","Acta Crystallographica Section C","1999","55","2","162","165","10.1107/S0108270198012451","","","0.71073","MoKα","","0.1","0.049","","","","0.111","","","","","","1.013","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008140","9.31","0.002","11.341","0.004","11.887","0.003","102.01","0.02","97.05","0.02","104.81","0.02","1166.1","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","μ-[1,1'-(1,2-Ethanediyl)bis(1,2,4-1H-triazole)]-N^4^:N^4^'-bis{[1,1,1- trifluoro-3-(2-thenoyl)acetonato-O,O']copper(II)}","","- C38 H24 Cu2 F12 N6 O8 S4 -","- C38 H24 Cu2 F12 N6 O8 S4 -","- C38 H24 Cu2 F12 N6 O8 S4 -","1","0.5","DA1029","Baolong Li; Jianzhong Zou; Chunying Duan; Yongjiang Liu; Xianwen Wei; Zheng Xu","μ-[1,1'-(1,2-Ethanediyl)bis(1<i>H</i>-1,2,4-triazole)]-<i>N</i>^4^:<i>N</i>^4'^-bis{bis[1,1,1-trifluoro-3-(2-thenoyl)acetonato-<i>O</i>,<i>O</i>']copper(II)}","Acta Crystallographica Section C","1999","55","2","165","167","10.1107/S0108270198011846","","","0.71073","MoKα","","0.051","0.038","","0.123","0.109","","","","1.013","1.022","1.022","","","","","has coordinates,has disorder","301791","2025-08-18","23:15:32",""
"2008141","8.038","0.002","20.482","0.004","13.677","0.003","90","","91.76","0.02","90","","2250.6","0.9","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C28 H18 Cr O4 -","- C28 H18 Cr O4 -","- C112 H72 Cr4 O16 -","4","1","DA1035","Hannesschlager, Patrick; Brun, Pierre; Pèpe, Gérard","Tricarbonyl[(6a,7,8,9,10,10a-η)-3,3-diphenyl-3<i>H</i>-benzo[<i>f</i>]chromene]chromium","Acta Crystallographica Section C","1999","55","2","200","202","10.1107/S0108270198012104","","","0.71073","MoKα","","0.0441","0.0397","","0.0789","0.0773","","","","0.808","0.987","0.987","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008142","6.866","0.003","9.101","0.004","9.927","0.004","100.62","0.02","90.85","0.03","109.34","0.02","573.4","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","[Ni(Me6trans[14]teteneN4)](ClO4)2","[Nickel(II)(5,5,7,12,12,14-hexamethyl-1,4,8,11-tetraazacyclotetradeca- -1,4,8,11-tetraene)]diperchlorate","","- C16 H28 Cl2 N4 Ni O8 -","- C16 H28 Cl2 N4 Ni O8 -","- C16 H28 Cl2 N4 Ni O8 -","1","0.5","DA1042","Gómez-Lara, Jacobo; Basiuk, Elena V.; Basiuk, Vladimir A.; Hernández-Ortega, Simon","(5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradeca-1,4,8,11-tetraene-<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')nickel(II) diperchlorate","Acta Crystallographica Section C","1999","55","2","160","162","10.1107/S0108270198012116","","","0.71073","MoKα","","0.0747","0.0562","","","","0.1564","","","","","","0.943","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008143","6.229","0.002","7.3544","0.0007","15.137","0.003","90.8","0.01","97.34","0.02","113.63","0.01","628.5","0.3","293","1","293","1","","","","","","","","3","P 1","P 1","1","Taraxerone","Taraxerone","","- C30 H48 O -","- C30 H48 O -","- C30 H48 O -","1","1","DA1044","Parvez, Masood; Gul, Waseem; Yousaf, Mohammad; Choudhary, M. Iqbal; Atta-ur-Rahman; Khan, M. Riaz","Taraxerone","Acta Crystallographica Section C","1999","55","2","213","215","10.1107/S0108270198012463","","","1.54178","CuKα","","0.059","0.055","","","","0.148","","","","","","1.06","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008144","6.685","0.002","13.2357","0.0011","14.8763","0.0019","93.677","0.009","98.114","0.016","90.359","0.014","1300.2","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","4-Heptamethyleneimino-7-nitrobenzo-2-oxa-1,3-diazole","4-Heptamethyleneimino-7-nitrobenzo-2-oxa-1,3-diazole","","- C13 H16 N4 O3 -","- C13 H16 N4 O3 -","- C52 H64 N16 O12 -","4","2","DE1090","Satyen Saha; Anunay Samanta","4-Heptamethyleneimino-7-nitrobenzo-2-oxa-1,3-diazole","Acta Crystallographica Section C","1999","55","2","252","254","10.1107/S0108270198012128","","","0.71073","MoKα","","0.083","0.05","","","","0.148","","","","","","0.998","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008145","24.772","0.005","10.165","0.002","15.362","0.003","90","","120.68","0.03","90","","3326.8","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(MALONATE)(AQUA)(5,6-DIMETHYL-1,10'PHENANTHROLINE) COPPER (II) HYDRATE","","- C34 H36 Cu2 N4 O12 -","- C17 H18 Cu N2 O6 -","- C136 H144 Cu8 N16 O48 -","8","1","FR1113","Gasque, Laura; Moreno-Esparza, Rafael; Mollins, Elies; Briansó-Penalva, José Luis; Ruiz-Ramírez, Lena; Medina-Dickinson, Gerardo","Aqua(5,6-dimethyl-1,10-phenanthroline-<i>N</i>,<i>N</i>')(malonato-<i>O</i>,<i>O</i>')copper(II) hydrate","Acta Crystallographica Section C","1999","55","2","158","160","10.1107/S0108270198009937","","","0.71073","MoKα","","0.056","0.032","","","","0.096","","","","","","1.057","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008146","6.5453","0.0006","7.5995","0.0008","24.855","0.003","90","","95.46","0.02","90","","1230.7","0.2","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 N2 O6 -","- C12 H10 N2 O6 -","- C48 H40 N8 O24 -","4","1","FR1126","Moreno-Fuquen, Rodolfo; Valderrama-Naranjo, Jaime; Montaño, Angela Marcela","A 1:1 complex of 4-nitropyridine <i>N</i>-oxide and 3-hydroxybenzoic acid","Acta Crystallographica Section C","1999","55","2","218","220","10.1107/S0108270198009949","","","0.71073","MoKα","","0.083","0.038","","0.117","0.084","","","","1.114","1.028","1.028","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008147","10.253","0.001","11.2035","0.0009","8.008","0.001","90","","90","","90","","919.87","0.16","296","","296","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","4-aminohippuric acid","","","- C9 H10 N2 O3 -","- C9 H10 N2 O3 -","- C36 H40 N8 O12 -","4","1","FR1150","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding in 4-aminohippuric acid","Acta Crystallographica Section C","1999","55","2","206","208","10.1107/S0108270198011767","","","0.71073","MoKα","","","0.036","","","0.059","","","","","1.76","1.76","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008148","7.0863","0.0005","4.3394","0.0006","13.2126","0.0006","90","","90.147","0.005","90","","406.29","0.07","296","","296","","","","","","","","","3","I 1 2 1","I 2y","5","(+)-tartaric acid dimethyl ether","(2R,3R)-(+)-2,3-dimethoxybutanedioic acid","","- C6 H10 O6 -","- C6 H10 O6 -","- C12 H20 O12 -","2","0.5","FR1158","Gerkin, Roger E.","Hydrogen bonding in (2<i>R</i>,3<i>R</i>)-(+)-2,3-dimethoxybutanedioic acid [(+)-tartaric acid dimethyl ether]","Acta Crystallographica Section C","1999","55","2","209","211","10.1107/S0108270198012694","","","0.71073","MoKα","","","0.031","","","0.056","","","","","1.9","1.9","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008149","14.4077","0.0011","8.0758","0.0007","19.0278","0.0008","90","","92.95","0.005","90","","2211","0.3","293","","298","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","dibenzobarrelene","[2,3:5,6]Dibenzo[2.2.2]octa-2,5,7-triene","","- C16 H12 -","- C16 H12 -","- C128 H96 -","8","1","FR1160","Burrows, Lary; Masnovi, John; Baker, Ronald J.","[2,3:5,6]Dibenzo[2.2.2]octa-2,5,7-triene (<i>C</i>2/<i>c</i>) and [2,3:5,6]dibenzo[2.2.2]octa-2,5-diene","Acta Crystallographica Section C","1999","55","2","236","239","10.1107/S010827019801275X","","","0.7093","MoKα","","0.038","0.038","","0.042","0.042","","","","","","","2.06","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008150","10.688","0.001","6.3449","0.0006","16.978","0.003","90","","104.62","0.01","90","","1114.1","0.3","293","","298","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","9,10-ethano-9,10-dihydroanthracene","[2,3:5,6]Dibenzo[2.2.2]octa-2,5-diene","","- C16 H14 -","- C16 H14 -","- C64 H56 -","4","1","FR1160","Burrows, Lary; Masnovi, John; Baker, Ronald J.","[2,3:5,6]Dibenzo[2.2.2]octa-2,5,7-triene (<i>C</i>2/<i>c</i>) and [2,3:5,6]dibenzo[2.2.2]octa-2,5-diene","Acta Crystallographica Section C","1999","55","2","236","239","10.1107/S010827019801275X","","","0.7093","MoKα","","0.035","0.035","","0.042","0.042","","","","","","","2.03","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008151","9.5974","0.0013","18.9323","0.0011","7.2881","0.001","90","","94.229","0.012","90","","1320.6","0.3","293","","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","tetrabenzo-24-crown-8","","","- C32 H32 O8 -","- C32 H32 O8 -","- C64 H64 O16 -","2","0.5","FR1161","Bryan, Jeffrey C.; Bunick, Gerard J.; Sachleben, Richard A.","Tetrabenzo-24-crown-8","Acta Crystallographica Section C","1999","55","2","250","252","10.1107/S0108270198012700","","","1.5418","CuKα","","0.046","0.038","","","","0.111","","","1.02","1.04","1.04","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008152","13.658","0.001","11.388","0.001","22.178","0.002","90","","106.951","0.008","90","","3299.6","0.5","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","4,4',6,6'-tetramethylbiphenyl-2,2'-dicarboxylic acid","","","- C18 H18 O4 -","- C18 H18 O4 -","- C144 H144 O32 -","8","2","FR1167","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding in 4,4',6,6'-tetramethylbiphenyl-2,2'-dicarboxylic acid","Acta Crystallographica Section C","1999","55","2","203","206","10.1107/S0108270198012761","","","0.71073","MoKα","","","0.074","","","","0.097","","","","","","1.21","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008153","11.777","0.0011","9.3742","0.0005","17.0675","0.0015","90","","106.623","0.007","90","","1805.5","0.3","296","2","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-chloro-2-(N,N-dimethylaminomethyleneamino)-1-(2,2-pivaloyloxymethyl) pteridin-4-one","","- C15 H19 Cl N6 O3 -","- C15 H19 Cl N6 O3 -","- C60 H76 Cl4 N24 O12 -","4","1","GD1002","Helliwell, Madeleine; Dinsmore, Andrew; Garner, C. David; Joule, John A.","A 1-alkylated pteridine, C~15~H~19~ClN~6~O~3~","Acta Crystallographica Section C","1999","55","2","254","256","10.1107/S0108270198011883","","","1.5418","CuKα","","0.114","0.055","","","","0.167","","","","","","1.073","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008154","8.792","0.002","12.481","0.002","18.44","0.004","90","","90","","90","","2023.5","0.7","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H30 O7 S -","- C18 H30 O7 S -","- C72 H120 O28 S4 -","4","1","GS1019","Alayrac, Carole; Saint-Clair, Jean-François; Lemarié, Margareth; Metzner, Patrick; Averbuch-Pouchot, Marie-Thérèse","1,2:5,6-Di-<i>O</i>-isopropylidene-α-<small>D</small>-glucofuranosyl (<i>S</i>)-cyclohexanesulfinate","Acta Crystallographica Section C","1999","55","2","262","264","10.1107/S0108270198012384","","","0.7107","MoKα","","0.04","0.04","","0.045","0.045","","","","1.854","1.854","1.854","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008155","13.13","0.009","5.149","0.002","18.166","0.003","90","","90.92","0.03","90","","1228","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(Z)-3-(p-methoxy)benzylideneisoindolin-1-one","(Z)-3-(p-methoxy)benzylideneisoindolin-1-one","","- C16 H13 N O2 -","- C16 H13 N O2 -","- C64 H52 N4 O8 -","4","1","HA1225","Kundu, Nitya G.; Khan, M. Wahab; Guha, Subhadra; Mukherjee, Alok K.","Two (<i>Z</i>)-3-aryl(alkyl)ideneisoindolin-1-ones","Acta Crystallographica Section C","1999","55","2","239","241","10.1107/S0108270198009962","","","1.5418","CuKα","","0.057","0.049","","0.128","0.121","","","","1.068","1.108","1.108","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008156","9.426","0.002","9.795","0.002","9.909","0.002","68.7","0.02","81.17","0.02","70","0.02","800.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","(Z)-3-(2'-hydroxy-2'-methyl)propylidene-N-p-tolyl isoindolin-1-one","(Z)-3-(2'-hydroxy-2'-methyl)propylidene-N-p-tolyl isoindolin-1-one","","- C19 H19 N O2 -","- C19 H19 N O2 -","- C38 H38 N2 O4 -","2","1","HA1225","Kundu, Nitya G.; Khan, M. Wahab; Guha, Subhadra; Mukherjee, Alok K.","Two (<i>Z</i>)-3-aryl(alkyl)ideneisoindolin-1-ones","Acta Crystallographica Section C","1999","55","2","239","241","10.1107/S0108270198009962","","","0.71073","MoKα","","0.24","0.055","","0.125","0.104","","","","0.771","1.272","1.272","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008157","13.322","0.001","5.167","0.001","20.938","0.001","90","","90","","90","","1441.3","0.3","173","2","173","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","3a,4,7,7a-Tetrahydro-isobenzofuran-1,3-dione","","- C8 H8 O3 -","- C8 H8 O3 -","- C64 H64 O24 -","8","2","HA1235","Bolte, Michael; Bauch, Christian","<i>cis</i>-1,2,3,6-Tetrahydrophthalic anhydride at 173K","Acta Crystallographica Section C","1999","55","2","226","228","10.1107/S0108270198012402","","","0.71073","MoKα","","0.0397","0.0323","","","","0.0853","","","","","","1.056","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008158","6.1925","0.0001","10.2272","0.0003","24.8189","0.0006","90","","90","","90","","1571.83","0.06","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-(3-furyl)-1,4,6,6a,7,10,10a,10b-octahydro-6a,10b-dimethyl-2H-naptho [2,1-c]pyran-7,4-dione","","- C19 H20 O4 -","- C19 H20 O4 -","- C76 H80 O16 -","4","1","HA1236","Nor Aziyah Bakhari; Sam Teng Wah; Kandasamy Chinnakali; Hoong-Kun Fun; Ibrahim Abdul Razak","Δ^8,9^-Decarboxyfibleucin from <i>Fibraurea chloroleuca</i> Miers","Acta Crystallographica Section C","1999","55","2","228","230","10.1107/S0108270198011962","","","0.71073","MoKα","","0.086","0.054","","","","0.113","","","","","","1.086","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008159","9.327","0.005","17.472","0.008","7.296","0.004","90","","115.51","0.04","90","","1073.1","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Ethyl mustard oil sulphide Hydrochloride","4-Ethyl-5-ethyliminium-1,2,4-dithiazolidine-3-thione chloride","","- C6 H11 Cl N2 S3 -","- C6 H11 Cl N2 S3 -","- C24 H44 Cl4 N8 S12 -","4","1","JZ1288","Beck, Johannes; Walter, Jörg","Ethyl mustard oil sulfide hydrochloride","Acta Crystallographica Section C","1999","55","2","260","262","10.1107/S0108270198011184","","","0.71073","MoKα","","0.0426","0.037","","","0.1034","0.1101","","","","1.068","1.068","1.063","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008160","26.174","0.007","5.5429","0.0007","15.727","0.004","90","","116.6","0.02","90","","2040.2","0.9","150","1","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Cu~2(DAB)~2","Bis(μ-diazoaminobenzene)dicooper(I)","","- C24 H20 Cu2 N6 -","- C24 H20 Cu2 N6 -","- C96 H80 Cu8 N24 -","4","0.5","JZ1296","Falvello, Larry R.; Urriolabeitia, Esteban P.; Mukhopadhyay, U.; Ray, D.","Redetermination of (diazoaminobenzene)copper(I) at 150K","Acta Crystallographica Section C","1999","55","2","170","172","10.1107/S0108270198011706","","","0.71073","MoKα","","0.0453","0.0308","","","","0.0812","","","","","","1.056","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008161","11.495","0.001","11.495","0.001","19.134","0.003","90","","90","","90","","2528.3","0.5","150","","150","","","","","","","","","5","I -4 2 m","I -4 2","121","","Bis(tetramethylammonium)tetra-μ~3~-sulfido-tetrakis [(2,2-dimethylpropanethiolato-S)iron(III)]","","- C28 H68 Fe4 N2 S8 -","- C28 H84 Fe4 N2 S8 -","- C56 H168 Fe8 N4 S16 -","2","0.125","JZ1305","Ralf Hauptmann; Jörg Schneider; Martin Köckerling; Gerald Henkel","Bis(tetramethylammonium) tetra-μ~3~-sulfido-tetrakis[(2,2-dimethylpropanethiolato-<i>S</i>)iron]: a heterocubane complex anion with crystallographically imposed øverline{4}2<i>m</i> symmetry","Acta Crystallographica Section C","1999","55","2","190","192","10.1107/S0108270198011718","","","0.71073","MoKα","","","0.055","","","","0.151","","","","1.167","1.167","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008162","10.696","0.005","11.305","0.005","13.301","0.005","90","0.005","110.06","0.005","90","0.005","1510.8","1.1","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","tert-butyl N-(1-aminocarbonyl-1-isopropylbut-3-enyl)carbamate","","- C13 H24 N2 O3 -","- C13 H24 N2 O3 -","- C52 H96 N8 O12 -","4","1","JZ1318","Badorrey, Ramón; Cativiela, Carlos; Díaz-de-Villegas, María D.; Gálvez, José A.; Lapeña, Yolanda","2-<i>tert</i>-Butoxycarbonylamino-2-isopropyl-4-pentenamide, a new conformationally restricted α,α-dialkylglycine derivative","Acta Crystallographica Section C","1999","55","2","241","243","10.1107/S010827019801172X","","","0.71069","MoKα","","","0.054","","","","0.154","","","","","","1.006","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008163","8.111","0.001","13.449","0.002","24.09","0.005","90","","90","","90","","2627.9","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[2S,2(1R),2(2R),4R]-2-ethyl-2-(2-hydroxy-1-methyl-2-phenylpropyl- 3-tosyl-4-phenyl-1,3-oxazolidine","","- C28 H33 N O4 S -","- C28 H33 N O4 S -","- C112 H132 N4 O16 S4 -","4","1","JZ1328","Bolte, Michael; Monz, Sabine; Wagner, Kerstin","Three 3-arylsulfonyl-1,3-oxazolidines","Acta Crystallographica Section C","1999","55","2","222","226","10.1107/S010827019801258X","","","1.5418","CuKα","","0.032","0.031","","","","0.085","","","","","","1.051","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008164","8.901","0.001","11.935","0.002","25.898","0.002","90","","90","","90","","2751.2","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","[2S,2(1R),4R]-2-[1-(3-ethoxy-3-oxo)-1-hydroxy-1-phenylpropyl]-2-ethyl- 3-tosyl-4-phenyl-1,3-oxazolidine","","- C29 H33 N O6 S -","- C29 H33 N O6 S -","- C116 H132 N4 O24 S4 -","4","1","JZ1328","Bolte, Michael; Monz, Sabine; Wagner, Kerstin","Three 3-arylsulfonyl-1,3-oxazolidines","Acta Crystallographica Section C","1999","55","2","222","226","10.1107/S010827019801258X","","","1.5418","CuKα","","0.046","0.042","","","","0.109","","","","","","1.048","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008165","11.054","0.001","14.824","0.003","15.25","0.003","90","","90","","90","","2498.9","0.7","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-(2,3,4,5)-tetrahydro-3-methylen-2-oxo-5-phenyl-furan-5-yl)- 1,3-oxazolidine","","- C28 H27 N O5 S -","- C28 H27 N O5 S -","- C112 H108 N4 O20 S4 -","4","1","JZ1328","Bolte, Michael; Monz, Sabine; Wagner, Kerstin","Three 3-arylsulfonyl-1,3-oxazolidines","Acta Crystallographica Section C","1999","55","2","222","226","10.1107/S010827019801258X","","","1.5418","CuKα","","0.03","0.029","","0.084","0.081","","","","1.06","1.06","1.06","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008166","10.236","0.001","22.433","0.003","12.188","0.002","90","","104.89","0.01","90","","2704.7","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-Methyl-(p-chorophenacyl)aniline","","- C15 H14 Cl N O -","- C15 H14 Cl N O -","- C120 H112 Cl8 N8 O8 -","8","2","KA1278","M. Paz Martínez-Alcázar; Isabel Fonseca; Felix H. Cano; J. Gonzalo Rodríguez","<i>N</i>-(<i>p</i>-Chlorobenzoyl)-<i>N</i>-methylaniline","Acta Crystallographica Section C","1999","55","2","256","258","10.1107/S0108270198010774","","","1.5418","CuKα","","0.077","0.0535","","","","0.1415","","","","","","0.932","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008167","18.3481","0.0016","8.3075","0.0007","13.2995","0.0009","90","","113.96","0.006","90","","1852.5","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","cis-Bis(2-aminobenzothiazole-N)-bis(formato-O,O')copper(II)","","- C16 H14 Cu N4 O4 S2 -","- C16 H14 Cu N4 O4 S2 -","- C64 H56 Cu4 N16 O16 S8 -","4","0.5","KA1298","Sieroń, Lesław; Bukowska-Strzyżewska, Maria","<i>cis</i>-Bis(2-amino-1,3-benzothiazole-<i>N</i>^3^)bis(formato-<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1999","55","2","167","169","10.1107/S0108270198011743","","","0.71073","MoKα","","0.0387","0.0325","","","","0.0801","","","","","","1.142","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008168","24.49","0.005","39.314","0.008","11.808","0.002","90","","90","","90","","11369","4","150","","150","","","","","","","","","6","F d d 2","F 2 -2d","43","","Tris(tetraethylammonium)tetrakis(thiophenolato-μ~3~- selenido-iron)","","- C48 H80 Fe4 N3 S4 Se4 -","- C48 H80 Fe4 N3 S4 Se4 -","- C384 H640 Fe32 N24 S32 Se32 -","8","0.5","LN1065","Hauptmann, Ralf; Schneider, Jörg; Chen, Changneng; Henkel, Gerald","Tris(tetraethylammonium) tetra-μ~3~-selenido-tetrakis[(thiophenolato-<i>S</i>)iron]","Acta Crystallographica Section C","1999","55","2","192","194","10.1107/S0108270198012190","","","0.71073","MoKα","","","0.0366","","","","0.0824","","","","1.08","1.08","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008169","8.744","0.004","14.219","0.007","19.552","0.009","90","","98.63","0.04","90","","2403","2","293","1","293","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Aquabis(2,2'-bipyridine-N,N')(perchlorato-O)-manganese(II) perchlorate","","- C20 H18 Cl2 Mn N4 O9 -","- C20 H16 Cl2 Mn N4 O9 -","- C80 H64 Cl8 Mn4 N16 O36 -","4","1","LN1066","Rodríguez-Martín, Yolanda; González-Platas, Javier; Ruiz-Pérez, Catalina","Aquabis(2,2'-bipyridine-<i>N</i>,<i>N</i>')(perchlorato-<i>O</i>)manganese(II) perchlorate","Acta Crystallographica Section C","1999","55","2","186","188","10.1107/S0108270198012049","","","1.54179","CuKα","","0.121","0.068","","","","0.211","","","","","","1.079","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008170","9.024","0.003","11.442","0.002","17.506","0.003","86.12","0.01","79.1","0.02","68.33","0.02","1649.5","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H12 N2 O4 -","- C20 H12 N2 O4 -","- C80 H48 N8 O16 -","4","2","LN1070","Elmali, Ayhan; Kabak, Mehmet; Elerman, Yalc̨in","2-Salicylideneamino-4,5-bis(2-furyl)furan-3-carbonitrile","Acta Crystallographica Section C","1999","55","2","258","260","10.1107/S0108270198012268","","","0.71069","MoKα","","0.0773","0.0467","","0.1618","0.1162","","","","1.092","0.987","0.987","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008171","10.118","0.002","9.705","0.003","11.919","0.003","90","","97.32","0.01","90","","1160.8","0.5","292","","292","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-(tert-Butyl)-3-(2-pyridyl)thiourea","","- C10 H15 N3 S -","- C10 H15 N3 S -","- C40 H60 N12 S4 -","4","1","NA1341","Angelova, Olyana; Kossev, Krasimir; Atanasov, Vladimir","1-(<i>tert</i>-Butyl)-3-(2-pyridyl)thiourea","Acta Crystallographica Section C","1999","55","2","220","222","10.1107/S0108270198009615","","","0.71073","MoKα","","0.063","0.043","","","","0.128","","","","","","1.02","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008172","6.5118","0.0004","8.1702","0.0006","13.9142","0.0008","72.501","0.005","75.962","0.005","71.093","0.006","659.22","0.08","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H9 Cl3 N2 -","- C14 H9 Cl3 N2 -","- C28 H18 Cl6 N4 -","2","1","NA1364","Kendi̇, Engi̇n; Özbey, Süheyla; Göker, Hakan","2,5-Dichloro-1-(<i>p</i>-chlorobenzyl)-1<i>H</i>-benzimidazole","Acta Crystallographica Section C","1999","55","2","243","245","10.1107/S0108270198011196","","","0.71073","MoKα","","","0.03","","","0.031","","","","","1.37","1.37","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008173","15.684","0.003","16.17","0.003","17.222","0.003","90","","116.75","0.01","90","","3900.2","1.3","296.2","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]chromium(0)","","- C14 H27 Cr O3 P3 -","- C14 H27 Cr O3 P3 -","- C112 H216 Cr8 O24 P24 -","8","2","OA1069","Suzuki, Takayoshi; Imamura, Takeshi; Kaizaki, Sumio","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]chromium(0), -molybdenum(0) and -tungsten(0) complexes","Acta Crystallographica Section C","1999","55","2","182","186","10.1107/S0108270198012414","","","0.7107","MoKα","","","0.0572","","","","0.0595","","","","","","1.53","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2008174","8.601","0.002","16.324","0.004","14.422","0.002","90","","96.59","0.02","90","","2011.5","0.7","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]molybdenum(0)","","- C14 H27 Mo O3 P3 -","- C14 H27 Mo O3 P3 -","- C56 H108 Mo4 O12 P12 -","4","1","OA1069","Suzuki, Takayoshi; Imamura, Takeshi; Kaizaki, Sumio","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]chromium(0), -molybdenum(0) and -tungsten(0) complexes","Acta Crystallographica Section C","1999","55","2","182","186","10.1107/S0108270198012414","","","0.7107","MoKα","","","0.0408","","","","0.0502","","","","","","1.746","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2008175","8.566","0.001","16.281","0.002","14.41","0.002","90","","96.77","0.01","90","","1995.6","0.4","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]tungsten(0)","","- C14 H27 O3 P3 W -","- C14 H27 O3 P3 W -","- C56 H108 O12 P12 W4 -","4","1","OA1069","Suzuki, Takayoshi; Imamura, Takeshi; Kaizaki, Sumio","Tricarbonyl[1,1,1-tris(dimethylphosphinomethyl)ethane]chromium(0), -molybdenum(0) and -tungsten(0) complexes","Acta Crystallographica Section C","1999","55","2","182","186","10.1107/S0108270198012414","","","0.7107","MoKα","","","0.0268","","","","0.0347","","","","","","1.382","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2008176","7.2454","0.0003","9.1927","0.0004","15.6539","0.0007","92.418","0.001","99.687","0.001","112.666","0.001","941.79","0.07","203","2","203","2","","","","","","","","5","P -1","-P 1","2","SN 18071.Ts","1,4-bis[4-(1-pyridinium)styryl)]benzene ditosylate","","- C46 H40 N2 O6 S2 -","- C46 H40 N2 O6 S2 -","- C46 H40 N2 O6 S2 -","1","0.5","OS1035","Clark, George R.; Denny, William A.; Squire, Christopher J.","1,4-Bis[4-(1-pyridinium)styryl]benzene ditosylate","Acta Crystallographica Section C","1999","55","2","230","232","10.1107/S0108270198012396","","","0.71073","MoKα","","0.049","0.04","","","","0.107","","","","","","1.021","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008177","11.36","0.003","12.237","0.002","11.717","0.002","90","","93.63","0.03","90","","1625.5","0.6","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichloro[1-(thiomethyl)-2-(diphenylphosphino)ethane]palladium(II)","","- C15 H17 Cl2 P Pd S -","- C15 H17 Cl2 P Pd S -","- C60 H68 Cl8 P4 Pd4 S4 -","4","1","OS1039","Adnan S. Abu-Surrah; Kristian Lappalainen; Martti Klinga; Markku Leskelä; Hamdallah A. Hodali; Bernhard Rieger","A dichloropalladium(II) complex with a mixed-donor bidentate ligand: dichloro[2-(diphenylphosphino)-1-(methylthio)ethane-<i>P</i>,<i>S</i>]palladium(II)","Acta Crystallographica Section C","1999","55","2","188","190","10.1107/S0108270198012773","","","0.71073","MoKα","","0.05","0.037","","0.077","0.073","","","","1.03","1.07","1.07","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008178","14.901","0.002","15.785","0.001","8.012","0.002","90","","98.67","0.02","90","","1863","0.6","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H24 N2 O3 -","- C10.5 H12 N O1.5 -","- C84 H96 N8 O12 -","8","1","OS1040","Hökelek, Tuncer; Kılıç, Zeynel; Bilge, Selen","2,5,8-Trioxa-16,20-diazatricyclo[20.4.0.0^9,14^]hexacosa-9,11,13,15,20,22,24,26-octaene","Acta Crystallographica Section C","1999","55","2","248","250","10.1107/S0108270198012281","","","0.71069","MoKα","","","0.0691","","","0.075","","","","","1.15","1.15","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008179","9.557","0.001","16.14","0.001","13.688","0.001","90","0.001","100.978","0.001","90","0.001","2072.7","0.3","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 N4 O3 -","- C23 H24 N4 O3 -","- C92 H96 N16 O12 -","4","1","QA0067","Aatif, A.; Baouid, A.; Hasnaoui, A.; Benharref, A.; Alilou, E. H.; Pierrot, M.","Ethyl 7-oxo-3-(4-tolyl)-4,5,6,6a,7,8-hexahydro-3<i>H</i>-cyclopenta[<i>b</i>][1,2,4]triazolo[4,3-<i>a</i>][1,5]benzodiazepine-1-carboxylate and ethyl 3-(4-chlorophenyl)-8-methyl-7-oxo-4,5,6,6a,7,8-hexahydro-3<i>H</i>-cyclopenta[<i>b</i>][1,2,4]triazolo[4,3-<i>a</i>][1,5]benzodiazepine-1-carboxylate","Acta Crystallographica Section C","1999","55","2","IUC9900010","","10.1107/S0108270199099849","","","0.71073","MoKα","","","0.061","","","0.087","","","","","1.506","1.506","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008180","9.942","0.001","16.184","0.001","13.787","0.001","90","0.001","107.64","0.001","90","0.001","2114","0.3","298","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 Cl N4 O3 -","- C23 H23 Cl N4 O3 -","- C92 H92 Cl4 N16 O12 -","4","1","QA0067","Aatif, A.; Baouid, A.; Hasnaoui, A.; Benharref, A.; Alilou, E. H.; Pierrot, M.","Ethyl 7-oxo-3-(4-tolyl)-4,5,6,6a,7,8-hexahydro-3<i>H</i>-cyclopenta[<i>b</i>][1,2,4]triazolo[4,3-<i>a</i>][1,5]benzodiazepine-1-carboxylate and ethyl 3-(4-chlorophenyl)-8-methyl-7-oxo-4,5,6,6a,7,8-hexahydro-3<i>H</i>-cyclopenta[<i>b</i>][1,2,4]triazolo[4,3-<i>a</i>][1,5]benzodiazepine-1-carboxylate","Acta Crystallographica Section C","1999","55","2","IUC9900010","","10.1107/S0108270199099849","","","0.71073","MoKα","","","0.069","","","0.093","","","","","1.56","1.56","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008181","14.84","0.001","7.0447","0.0007","4.2585","0.0004","81.292","0.008","84.988","0.008","84.837","0.008","437.05","0.07","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Potassium 2,4-dichloro-6-nitrophenolate","potassium 2,4-dichloro-6-nitrophenolate","","- C6 H2 Cl2 K N O3 -","- C6 H2 Cl2 K N O3 -","- C12 H4 Cl4 K2 N2 O6 -","2","1","QA0075","Vasiliev, Alexander D.; Solovyov, Leonid A.","Potassium 2,4-dichloro-6-nitrophenolate","Acta Crystallographica Section C","1999","55","2","IUC9900004","","10.1107/S0108270199099904","","","1.54051","CuKα","","0.053","0.051","","","","0.13","","","","","","1.099","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008182","7.242","0.007","10.01","0.007","10.962","0.006","115.96","0.05","90.89","0.03","107.84","0.07","669.6","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","phenanthridine hydrogenselenate monohydrate","9-azaphenathrenium(1+) hydrogenselenate(1-) monohydrate","","- C13 H13 N O5 Se -","- C13 H13 N O5 Se -","- C26 H26 N2 O10 Se2 -","2","1","QA0076","Slouf, Miroslav; Cisarova, Ivana","Phenathridinium hydrogenselenate monohydrate","Acta Crystallographica Section C","1999","55","2","IUC9900003","","10.1107/S0108270199099874","","","0.71073","MoKα","","0.065","0.055","","","","0.148","","","","","","1.077","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008183","5.2326","0.0003","16.766","0.002","6.613","0.0005","90","","106.983","0.005","90","","554.86","0.09","298","","298","","","","","","","","","5","P 1 21 1","P 2yb","4","","3-(3-bromopropyl)-5-nitro-1H-indole","","- C11 H11 Br N2 O2 -","- C11 H11 Br N2 O2 -","- C22 H22 Br2 N4 O4 -","2","1","QA0079","Garcia, J. Gabriel; Billodeaux, Damon R.; Fronczek, Frank R.","Two 3-substituted 5-nitroindoles","Acta Crystallographica Section C","1999","55","2","IUC9900007","","10.1107/S0108270199099783","","","1.54184","CuKα","","","0.025","","","0.036","","","","","1.978","1.978","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008184","10.3272","0.0007","13.962","0.001","7.4435","0.0006","90","","99.489","0.006","90","","1058.58","0.14","299","","299","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(3-hydroxypropyl)-5-nitro-1H-indole","","- C11 H12 N2 O3 -","- C11 H12 N2 O3 -","- C44 H48 N8 O12 -","4","1","QA0079","Garcia, J. Gabriel; Billodeaux, Damon R.; Fronczek, Frank R.","Two 3-substituted 5-nitroindoles","Acta Crystallographica Section C","1999","55","2","IUC9900007","","10.1107/S0108270199099783","","","1.54184","CuKα","","0.052","0.047","","0.056","0.056","","","","1.851","1.848","1.848","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008185","9.952","0.002","11.767","0.002","6.206","0.002","90","","90","","90","","726.8","0.3","125","2","125","2","","","","","","","","3","I b a m","-I 2 2c","72","","2-Propenoic Acid","","- C3 H4 O2 -","- C3 H4 O2 -","- C24 H32 O16 -","8","0.5","","Boese, R.; Bläser, D.; Steller, I.; Latz, R.; Bäumen, A.","Redetermination of 2-propenoic acid at 125K","Acta Crystallographica Section C","1999","55","2","IUC9900006","","10.1107/S0108270199099850","","","0.71073","MoKα","","0.05","0.04","","","","0.118","","","","","","1.074","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008186","13.129","0.003","19.201","0.004","27.672","0.006","90","","90","","90","","6976","3","133","2","133","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(+)-(1R,5S,6R)-1-[3-(9,9-Dimethyl-4,4-dioxo-4λ^6^-thiatricyclo[6.1.1.0^2,6^]- dec-2-en-5-yl)-2-tert-butyldimethylsilyloxy-4,6-dimethoxy-phenyl]-3-methyl- butan-1-one","","- C32.5 H52 O6.5 S Si -","- C32.5 H52 O6.5 S Si -","- C260 H416 O52 S8 Si8 -","8","2","QA0081","Bats, Jan W.; Berger, Bernd; Gerlach, Matthias; Reggelin, Michael","(+)-(1<i>R</i>,5<i>S</i>,6<i>R</i>)-1-[3-(9,9-Dimethyl-4,4-dioxo-4λ^6^-thiatricyclo[6.1.1.0^2,6^]dec-2-en-5-yl)-2-<i>tert</i>-butyldimethylsilyloxy-4,6-dimethoxyphenyl]-3-methylbutan-1-one methyl <i>tert</i>-butyl ethersolvate at 133K","Acta Crystallographica Section C","1999","55","2","IUC9900002","","10.1107/S0108270199099837","","","0.71073","MoKα","","0.103","0.061","","","","0.114","","","","","","1.096","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008187","13.151","0.003","3.923","0.001","5.762","0.001","90","","90","","90","","297.27","0.11","40","2","40","2","","","","","","","","3","P n a 21","P 2c -2n","33","Acetic acid","Ethanoic acid","","- C2 H4 O2 -","- C2 H4 O2 -","- C8 H16 O8 -","4","1","QA0082","Boese, Roland; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","Acetic acid at 40K","Acta Crystallographica Section C","1999","55","2","IUC9900001","","10.1107/S0108270199099862","","","0.71073","MoKα","","0.0413","0.0397","","","","0.0986","","","","","","1.131","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008188","7.0377","0.0001","25.6325","0.0002","8.7769","0.0001","90","","108.731","0.001","90","","1499.44","0.03","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,5-Di(2-chlorophenyl)-1,2,4-triazole-3-thione.","","- C14 H9 Cl2 N3 S -","- C14 H9 Cl2 N3 S -","- C56 H36 Cl8 N12 S4 -","4","1","QA0084","Kandasamy Chinnakali; Hoong-Kun Fun; Annamalai Senthilvelan; Vayalakkavoor T. Ramakrishnan","3,4-Bis(2-chlorophenyl)-1,2,4-1<i>H</i>-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section C","1999","55","2","IUC9900005","","10.1107/S0108270199099813","","","0.71073","MoKα","","0.114","0.07","","","","0.207","","","","","","1.029","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:32",""
"2008189","14.436","0.003","28.732","0.003","8.592","0.002","90","","106.34","0.02","90","","3419.8","1.2","297","","297","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(N,N'-disalicylideneethylenediamine)(isothiocyanato)oxovanadium(V)","","","- C17 H14 N3 O3 S V -","- C17 H14 N3 O3 S V -","- C136 H112 N24 O24 S8 V8 -","8","2","QA0085","Tsuchimoto, Masanobu; Ohba, Shigeru","[<i>N</i>,<i>N</i>'-Bis(salicylidene)ethylenediamine](isothiocyanato)oxovanadium(V)","Acta Crystallographica Section C","1999","55","2","IUC9900008","","10.1107/S0108270199099898","","","0.71073","MoKα","","0.123","0.051","","","","0.081","","","","","","1.095","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008190","8.0436","0.0002","8.7719","0.0003","8.9585","0.0003","73.188","0.001","63.829","0.001","73.398","0.002","533.76","0.03","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","9-hydroxy-4-methyl-9,10-dihydro-7,8-benzocoumarin","","- C14 H12 O3 -","- C14 H12 O3 -","- C28 H24 O6 -","2","1","QA0086","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan","9-Hydroxy-4-methyl-9,10-dihydrobenzo[<i>h</i>]coumarin","Acta Crystallographica Section C","1999","55","2","IUC9900011","","10.1107/S0108270199099825","","","0.71073","MoKα","","0.095","0.072","","","","0.231","","","","","","1.059","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008191","4.1458","0.0002","12.5203","0.0004","11.1023","0.0004","90","","100.06","0.002","90","","567.42","0.04","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","E-1,2-(Di-2'-chlorocyclopentenyl)ethylene","","- C12 H14 Cl2 -","- C12 H14 Cl2 -","- C24 H28 Cl4 -","2","0.5","QA0087","Susmita Gupta; Jayanta Kumar Ray; Kandasamy Chinnakali; Hoong-Kun Fun","(<i>E</i>)-1,2-Bis(2-chlorocyclopentenyl)ethene","Acta Crystallographica Section C","1999","55","2","IUC9900012","","10.1107/S0108270199099801","","","0.71073","MoKα","","0.088","0.064","","","","0.172","","","","","","0.923","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008192","12.8316","0.0002","13.5924","0.0002","23.8128","0.0004","79.5365","0.0009","88.225","0.0008","63.4592","0.0008","3647.83","0.1","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","1,3,5-tri-tertbutyldimethylsilyloxymethyl-2,4,6-triiodbenzene","","- C27 H51 I3 O3 Si3 -","- C27 H51 I3 O3 Si3 -","- C108 H204 I12 O12 Si12 -","4","2","QA0088","Løiten, Marianne Sveaas; Gløgård, Christian; Dalhus, Bjørn; Fjartoft, Berit; Klaveness, Jo","2,4,6-Triiodo-1,3,5-tris(<i>tert</i>-butyldimethylsilyloxymethyl)benzene","Acta Crystallographica Section C","1999","55","2","IUC9900009","","10.1107/S0108270199099795","","","0.71073","MoKα","","0.068","0.057","","0.151","0.136","","","","1.997","2.074","2.074","","","","","has coordinates,has disorder","301791","2025-08-18","23:15:32",""
"2008193","8.486","0.001","9.571","0.001","19.68","0.002","90","","101.54","0.01","90","","1566.1","0.3","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,4-Dimethoxyl-6,7,9,10,11-pentahydro-2-hydroxyl-2-methyl-1H-cyclopenta[jk] pyrrolo[2,1-b][3]benzazepine-1-one","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C72 H84 N4 O16 -","4","1","QA0092","Zhong, Sanbao; Deng, Yijian; Yu, Kaibei; Zhu, Jin; Mi, Aiqiao; Jiang, Yaozhong; Zhang, Guoling","2-Hydroxy-3,4-dimethoxy-2-methyl-1,2,6,7,10,11-hexahydro-9<i>H</i>-cyclopenta[<i>jk</i>]pyrrolo[2,1-<i>b</i>][3]benzazepin-1-one","Acta Crystallographica Section C","1999","55","2","IUC9900013","","10.1107/S0108270199099886","","","0.71073","MoKα","","0.049","0.034","","0.142","0.083","","","","0.952","1.071","1.071","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008194","13.524","0.002","11.221","0.001","18.41","0.002","90","","96.06","0.01","90","","2778.2","0.6","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C9 H15 Cu Na O12 -","- C9 H15 Cu Na O12 -","- C72 H120 Cu8 Na8 O96 -","8","1","SK1164","Chui, Stephen Sin Yin; Siu, Alvin; Williams, Ian D.","Sodium copper(II) trimesate, [NaCu{C~6~H~3~(COO)~3~}(H~2~O)~4~].2H~2~O, a double-sheet coordination polymer with bridging aqua ligands","Acta Crystallographica Section C","1999","55","2","194","196","10.1107/S0108270198010944","","","0.71073","MoKα","","0.0391","0.0317","","0.0848","0.0788","","","","1.064","1.084","1.084","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008195","11.6017","0.001","11.2268","0.0011","16.752","0.0015","90","","108.936","0.008","90","","2063.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","A Binuclear Cadmium(II) complex: Bis(diisopropyldithiocarbamate) Cadmium(II)","","- C28 H56 Cd2 N4 S8 -","- C28 H56 Cd2 N4 S8 -","- C56 H112 Cd4 N8 S16 -","2","0.5","SK1201","Fang-fang Jian; Zuo-xiang Wang; Hoong-Kun Fun; Zhi-ping Bai; Xiao-zeng You","A binuclear cadmium(II) complex: bis[bis(<i>N,N</i>-diisopropyldithiocarbamato)cadmium(II)]","Acta Crystallographica Section C","1999","55","2","174","176","10.1107/S0108270198012062","","","0.71073","MoKα","","0.0586","0.0411","","0.1056","0.0989","","","","0.95","1.045","1.045","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008196","21.935","0.001","11.4354","0.0007","9.9743","0.0006","90","","90","","90","","2501.9","0.2","295","","295","","","","","","","","","5","P b c n","-P 2n 2ab","60","","2-[2-(dimethylamino)ethylaminomethyl]-4-chlorophenol","","- C11 H17 Cl N2 O -","- C11 H17 Cl N2 O -","- C88 H136 Cl8 N16 O8 -","8","1","SK1230","Lian Ee Khoo; Hong Juan Hu; Alan Hazell","4-Chloro-2-[2-(dimethylamino)ethylaminomethyl]phenol and 2-[2-(dimethylamino)ethylaminomethyl]-6-methoxyphenol","Acta Crystallographica Section C","1999","55","2","245","248","10.1107/S0108270198012050","","","0.71073","MoKα","","","0.041","","","0.046","","","","","","","1.295","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008197","15.9034","0.0008","10.5054","0.0005","16.1559","0.0008","90","","90","","90","","2699.2","0.2","298","","298","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-[2-dimethylamino)ethylaminomethyl]-6-methoxyphenol","","- C12 H20 N2 O2 -","- C12 H20 N2 O2 -","- C96 H160 N16 O16 -","8","1","SK1230","Lian Ee Khoo; Hong Juan Hu; Alan Hazell","4-Chloro-2-[2-(dimethylamino)ethylaminomethyl]phenol and 2-[2-(dimethylamino)ethylaminomethyl]-6-methoxyphenol","Acta Crystallographica Section C","1999","55","2","245","248","10.1107/S0108270198012050","","","0.71073","MoKα","","","0.048","","","0.056","","","","","","","1.569","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008198","14.283","0.002","17.083","0.004","7.723","0.003","90","","90","","90","","1884.4","0.9","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","3-(3-indolyl)acrylamide","","- C11 H10 N2 O -","- C11 H10 N2 O -","- C88 H80 N16 O8 -","8","1","SX1071","Leopoldo Suescun; Raúl A. Mariezcurrena; Alvaro W. Mombrú; Danilo Davyt; Eduardo Manta","3-(3-Indolyl)acrylamide","Acta Crystallographica Section C","1999","55","2","211","213","10.1107/S0108270198012505","","","0.71069","MoKα","","0.159","0.041","","","","0.132","","","","","","0.98","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008199","7.0518","0.0001","5.851","0.0001","10.3799","0.0002","90","","108.22","0.001","90","","406.803","0.012","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","silver(I) diammino-disulfito-palladat(II)","disilver(I) diamminedisulfitopalladium(II)","","- Ag2 H6 N2 O6 Pd S2 -","- Ag2 H6 N2 O6 Pd S2 -","- Ag4 H12 N4 O12 Pd2 S4 -","2","0.5","AV1026","Solovyov, Leonid A.; Blokhin, Alexander I.; Mulagaleev, Ruslan F.; Kirik, Sergei D.","Ag~2~[Pd(NH~3~)~2~(SO~3~)~2~] powder","Acta Crystallographica Section C","1999","55","3","293","296","10.1107/S0108270198012724","","","1.5418","CuKα","","","","","","","","","","1.66","","","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008200","7.72","0.006","13.72","0.001","15.161","0.003","63.3","0.01","88.1","0.05","86.56","0.05","1432","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Nickel(II) Thiocyanate complex of Bis( 3 - Aminopropyl) methylamine","Nickel(II) Thiocyanate complex of Bis( 3 - Aminopropyl) methylamine","","- C18 H38 N10 Ni2 S4 -","- C18 H38 N10 Ni2 S4 -","- C36 H76 N20 Ni4 S8 -","2","1","BK1416","Mukherjee, Alok K.; Nayak, Nirmalya P.; Mondal, Arunendu; Chaudhuri, Nirmalendu Ray","A dimeric form of the nickel(II) thiocyanate complex of bis(3-aminopropyl)methylamine","Acta Crystallographica Section C","1999","55","3","365","368","10.1107/S010827019801419X","","","0.71073","MoKα","","0.05","0.039","","0.099","0.095","","","","1.216","1.277","1.277","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008201","16.991","0.002","12.307","0.001","9.5","0.002","90","","107.5","0.02","90","","1894.6","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(dihydrogen phosphato-O)[(1RS,4RS,8SR,10SR)-1,4,8,10- tetraazacyclotetradecane-κ^4^N]nickel(II) monohydrate","","- C10 H30 N4 Ni O9 P2 -","- C10 H28 N4 Ni O9 P2 -","- C40 H112 N16 Ni4 O36 P8 -","4","0.5","BK1417","Namouchi-Cherni, Saoussen; Driss, Ahmed; Jouini, Tahar","Bis(dihydrogen phosphato-<i>O</i>)[(1<i>RS</i>,4<i>RS</i>,8<i>SR</i>,11<i>SR</i>)-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>]nickel(II) monohydrate","Acta Crystallographica Section C","1999","55","3","345","347","10.1107/S0108270198014620","","","0.71069","MoKα","","0.0301","0.025","","0.067","0.0638","","","","1.077","1.084","1.084","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008202","12.932","0.002","11.273","0.002","14.921","0.003","90","","100.16","0.014","90","","2141.1","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(μ~2~-Hydrydo)-(μ~2~-N-methylcarboxamido-C,O)-trimethylamine)- nonacarbonyl- tri-osmium","","- C14 H14 N2 O10 Os3 -","- C14 H14 N2 O10 Os3 -","- C56 H56 N8 O40 Os12 -","4","1","BK1418","Andrés Vega; Evgenia Spodine; Alejandro Arce; Jorge Manzur; Ana María García; María Teresa Garland","Nonacarbonyl-μ~2~-hydrido-μ~2~-(<i>N</i>-methylcarboxamido)-<i>C</i>:<i>O</i>-(<i>N</i>-trimethylamine)triosmium(3 <i>Os</i>—<i>Os</i>)","Acta Crystallographica Section C","1999","55","3","322","323","10.1107/S0108270198012839","","","0.71073","MoKα","","0.0659","0.0362","","0.0787","0.0671","","","","1.016","1.059","1.059","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008203","7.268","0.002","12.747","0.002","13.357","0.004","90","","90","","90","","1237.5","0.5","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","5-(4-pyridyl)-5-phenylhydantoin","","- C14 H11 N3 O2 -","- C14 H11 N3 O2 -","- C56 H44 N12 O8 -","4","1","BK1423","Eknoian, Michael W.; Webb, Thomas R.; Worley, S. Davis; Braswell, Anthony; Hadley, Johnathan","5-(4-Pyridyl)-5-phenylhydantoin","Acta Crystallographica Section C","1999","55","3","405","407","10.1107/S0108270198014528","","","0.71073","MoKα","","0.0338","0.0306","","0.0784","0.076","","","","1.111","1.12","1.12","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008204","16.734","0.003","10.267","0.002","17.173","0.004","90","","110.34","0.02","90","","2766.5","1","294","2","294","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","dioxo-di-μ-dioxo-bis(difluoroacetato)-bis-(2,2 -bipyridine)-dimolybdenum(V)","","- C24 H22 F4 Mo2 N4 O10 -","- C24 H22 F4 Mo2 N4 O10 -","- C96 H88 F16 Mo8 N16 O40 -","4","0.5","BK1424","Webb, Thomas R.; Talbott, E. Shane","Di-μ-oxo-bis[(2,2'-bipyridine)(difluoroacetato)oxomolybdenum(V)] dihydrate","Acta Crystallographica Section C","1999","55","3","370","372","10.1107/S0108270198014206","","","0.71073","MoKα","","0.03","0.024","","0.06","0.056","","","","1.12","1.129","1.129","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008205","11.688","0.002","12.561","0.004","3.945","0.001","90","","90","","90","","579.2","0.3","296","","","","","","","","","","","5","C m m m","-C 2 2","65","","μ-4,4'-bipyridylium di-μ-bromide-mercury(II)","","- C10 H8 Br2 Hg N2 -","- C10 H8 Br2 Hg N2 -","- C20 H16 Br4 Hg2 N4 -","2","0.125","BM1222","Pan, Long; Zheng, Nengwu; Wu, Yonggang; Yu, Shichun; Huang, Xiaoying","Poly[mercury(II)-μ-4,4'-bipyridine-di-μ-bromo]","Acta Crystallographica Section C","1999","55","3","343","345","10.1107/S0108270198006325","","","0.71073","MoKα","","","0.031","","","","0.038","","","","","","1.25","","","","has coordinates","198516","2020-10-21","18:00:00",""
"2008206","9.257","0.001","10.947","0.003","11.911","0.001","96.86","0.01","108.997","0.007","96.59","0.01","1117.8","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","{3-[(1-protonated-4-amino-2-methyl-5-pyrimidinyl)methyl]-5-(2-hydroxyethyl)-4- methylthiazolium}{3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-5- (2-hydroxyethyl)-4-methylthiazolium} heptaiododimercurate dihydrate","","- C24 H39 Hg2 I7 N8 O4 S2 -","- C24 H28 Hg2 I7 N8 O4 S2 -","- C24 H28 Hg2 I7 N8 O4 S2 -","1","0.5","BM1259","Hu, Ning-Hai; Liu, Yong-Sheng; Aoki, Katsuyuki","Interactions of thiamine with anions: (Hthiamine)(thiamine) heptaiododimercurate dihydrate and its dimethanol monohydrate","Acta Crystallographica Section C","1999","55","3","304","308","10.1107/S0108270198013407","","","0.71073","MoKα","","0.101","0.042","","0.147","0.108","","","","0.87","","","0.924","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008207","11.797","0.001","19.238","0.002","22.012","0.004","90","","98.57","0.01","90","","4939.9","1.1","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","{3-[(1-protonated-4-amino-2-methyl-5-pyrimidinyl)methyl]-5-(2-hydroxyethyl)-4- methylthiazolium}{3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-5- (2-hydroxyethyl)-4-methylthiazolium} heptaiododimercurate dimethanol-monohydrate","","- C26 H45 Hg2 I7 N8 O5 S2 -","- C26 H40 Hg2 I7 N8 O5 S2 -","- C104 H160 Hg8 I28 N32 O20 S8 -","4","0.5","BM1259","Hu, Ning-Hai; Liu, Yong-Sheng; Aoki, Katsuyuki","Interactions of thiamine with anions: (Hthiamine)(thiamine) heptaiododimercurate dihydrate and its dimethanol monohydrate","Acta Crystallographica Section C","1999","55","3","304","308","10.1107/S0108270198013407","","","0.71073","MoKα","","0.105","0.053","","0.161","0.131","","","","0.998","","","1.108","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008208","7.4875","0.0006","14.4756","0.0014","12.1879","0.0012","90","","92.702","0.007","90","","1319.5","0.2","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4,6-Trymethylpyridine benzoic acid","","- C15 H17 N O2 -","- C15 H17 N O2 -","- C60 H68 N4 O8 -","4","1","BM1262","Foces-Foces, C.; Llamas-Saiz, A.L.; Lorente, P; Golubev, N.S.; Limbach, H.-H.","Three 2,4,6-trimethylpyridine–benzoic acid complexes at 150K","Acta Crystallographica Section C","1999","55","3","377","381","10.1107/S0108270198013766","","","1.5418","CuKα","","0.083","0.068","","0.103","0.091","","","","0.992","1","1","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008209","25.732","0.003","7.8359","0.0004","13.954","0.001","90","","90","","90","","2813.6","0.4","150","","150","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2,4,6-Trymethylpyridinium ortho-nitro-benzoate","","- C15 H16 N2 O4 -","- C15 H16 N2 O4 -","- C120 H128 N16 O32 -","8","1","BM1262","Foces-Foces, C.; Llamas-Saiz, A.L.; Lorente, P; Golubev, N.S.; Limbach, H.-H.","Three 2,4,6-trimethylpyridine–benzoic acid complexes at 150K","Acta Crystallographica Section C","1999","55","3","377","381","10.1107/S0108270198013766","","","1.5418","CuKα","","0.068","0.059","","0.077","0.07","","","","0.944","0.947","0.947","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008210","7.5078","0.0004","7.319","0.0004","27.632","0.008","90","","92.06","0.009","90","","1517.4","0.5","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,4,6-Trymethylpyridinium 3,5-dinitro-benzoate","","- C15 H15 N3 O6 -","- C15 H15 N3 O6 -","- C60 H60 N12 O24 -","4","1","BM1262","Foces-Foces, C.; Llamas-Saiz, A.L.; Lorente, P; Golubev, N.S.; Limbach, H.-H.","Three 2,4,6-trimethylpyridine–benzoic acid complexes at 150K","Acta Crystallographica Section C","1999","55","3","377","381","10.1107/S0108270198013766","","","1.5418","CuKα","","0.048","0.044","","0.054","0.052","","","","0.964","0.977","0.977","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008211","6.834","0.001","9.672","0.001","11.317","0.001","91.72","0.01","96.56","0.01","97.27","0.01","736.41","0.15","293","2","293","2","","","","","","","","3","P -1","-P 1","2","1D1CC","4'-propen-1-ylbicyclohexyl-4-carbonitrile","","- C16 H25 N -","- C16 H25 N -","- C32 H50 N2 -","2","1","BM1266","Gupta, Sakuntala; Bhattacharyya, Kinkini; SenGupta, S.P.; Paul, Sukla; Alajos, Kalman; Laszlo, Parkanyi","A mesogenic alkenyl compound","Acta Crystallographica Section C","1999","55","3","403","405","10.1107/S0108270198013791","","","0.7107","MoKα","","0.0882","0.0445","","0.1511","0.1376","","","","1.03","1.307","1.307","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008212","11.8241","0.0005","11.8241","0.0005","19.8441","0.0011","90","","90","","120","","2402.7","0.2","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","Hexa(dimethylsulfoxide-O)nickel(II) tetraiodide(2-)","","- C12 H36 I4 Ni O6 S6 -","- C12 H36 I4 Ni O6 S6 -","- C36 H108 I12 Ni3 O18 S18 -","3","0.166667","BM1277","De-Liang Long; Huai-Ming Hu; Jiu-Tong Chen; Jin-Shun Huang","[Ni{(CH~3~)~2~SO}~6~]I~4~, a redetermination and reinterpretation","Acta Crystallographica Section C","1999","55","3","339","341","10.1107/S0108270198013055","","","0.71073","MoKα","","0.024","0.019","","0.041","0.039","","","","1.131","1.159","1.159","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008213","7.3648","0.0005","8.1825","0.0006","32.657","0.002","90","","90","","90","","1968","0.2","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)-(2S)-2-[(dimethylaminium)methyl]-1-[(5,6,7,8-tetrahydro-5-oxo-2-naphtyl) acetyl]piperidine chloride","","- C20 H29 Cl N2 O2 -","- C20 H29 Cl N2 O2 -","- C80 H116 Cl4 N8 O8 -","4","1","BM1280","Peeters, Oswald M.; Jamroz, Dorota; Norbert M. Blaton; Camiel J. De Ranter","Novel selective κ-opioid ligands","Acta Crystallographica Section C","1999","55","3","458","461","10.1107/S0108270198012736","","","1.54184","CuKα","","0.041","0.0375","","0.1208","","0.1208","","","1.136","","","1.136","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008214","7.2011","0.0008","7.63","0.0006","41.223","0.003","90","","90","","90","","2265","0.3","293","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(-)-(2S)-2-[(Methylethylaminium)methyl]-1-[(5,6,7,8-tetrahydro-5-oxo-2- naphthyl)acetyl]piperidine chloride dihydrate","","- C21 H35 Cl N2 O4 -","- C21 H35 Cl N2 O4 -","- C84 H140 Cl4 N8 O16 -","4","1","BM1280","Peeters, Oswald M.; Jamroz, Dorota; Norbert M. Blaton; Camiel J. De Ranter","Novel selective κ-opioid ligands","Acta Crystallographica Section C","1999","55","3","458","461","10.1107/S0108270198012736","","","1.54184","CuKα","","0.0819","0.05","","0.1302","","0.1302","","","1.062","","","1.062","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008215","12.2516","0.0008","13.2439","0.0009","10.1913","0.0007","90","","90.291","0.002","90","","1653.61","0.19","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2,3,4,6,7-hexahydro-10-methyl-naphtho[2,3-c]acridine","","- C22 H21 N -","- C22 H21 N -","- C88 H84 N4 -","4","1","BM1281","Jayanta Kumar Ray; Manas Kumar Haldar; Susmita Gupta; Kandasamy Chinnakali; Hoong-Kun Fun","7,8,10,11,12,13-Hexahydro-4-methylnaphtho[2,3-<i>c</i>]acridine","Acta Crystallographica Section C","1999","55","3","397","399","10.1107/S0108270198013225","","","0.71073","MoKα","","0.163","0.074","","","","0.241","","","","","","1.021","","","","has coordinates,has disorder","301791","2025-08-18","23:15:32",""
"2008216","8.4793","0.0002","22.5318","0.001","9.7774","0.0003","90","","90","","90","","1868.01","0.11","293","","293","","","","","","","","","3","P n a 21","P 2c -2n","33","","Tris(2-aminobenzyl)amine","","- C21 H24 N4 -","- C21 H24 N4 -","- C84 H96 N16 -","4","1","BM1283","Foces-Foces, C.; Llamas-Saiz, A.L.; Alajarín, M.; López-Lázaro, A.; Molina, P.","Two <i>C</i>~3~-symmetrical tris(<i>ortho</i>-substituted) tribenzylamines","Acta Crystallographica Section C","1999","55","3","373","377","10.1107/S0108270198013857","","","1.5418","CuKα","","0.03","0.029","","0.031","0.03","","","","0.901","","","0.891","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008217","18.1459","0.0006","18.1459","0.0006","12.2532","0.0005","90","","90","","120","","3494.1","0.2","150","","150","","","","","","","","","7","R 3 :H","R 3","146","","N-Methyl-N,N,N-tris[2-(triethoxyphosphoranylideneamino)benzyl] ammonium","","- C40 H66 B F4 N4 O9 P3 -","- C40 H66 B F4 N4 O9 P3 -","- C120 H198 B3 F12 N12 O27 P9 -","3","0.333333","BM1283","Foces-Foces, C.; Llamas-Saiz, A.L.; Alajarín, M.; López-Lázaro, A.; Molina, P.; N-Methyl-N,N,N-tris[2-(triethoxyphosphoranylideneamino)benzyl] ammonium","Two <i>C</i>~3~-symmetrical tris(<i>ortho</i>-substituted) tribenzylamines","Acta Crystallographica Section C","1999","55","3","373","377","10.1107/S0108270198013857","","","1.5418","CuKα","","0.042","0.042","","0.048","0.048","","","","1.518","","","1.517","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008218","12.9598","0.0016","53.6","0.003","8.2907","0.0012","90","","90","","90","","5759.1","1.1","293","2","180","2","","","","","","","","4","F d d 2","F 2 -2d","43","","2-[5-(3-Bromophenyl)pyrazol-3-yl]-3-(pyrrol-2-yl)acrylonitrile","","- C16 H11 Br N4 -","- C16 H11 Br N4 -","- C256 H176 Br16 N64 -","16","1","BM1286","Kumar, A.; Parmar, V. S.; Errington, W.","(<i>E</i>)-2-[5-(3-Bromophenyl)pyrazol-3-yl]-3-(pyrrol-2-yl)acrylonitrile","Acta Crystallographica Section C","1999","55","3","456","457","10.1107/S0108270198013067","","","0.71073","MoKα","","0.0679","0.0457","","","","0.0986","","","","","","0.994","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008219","17.882","0.005","6.8049","0.0009","11.712","0.006","90","","90","","90","","1425.2","0.9","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C6 H13 Ca2 N O11 -","- C6 H13 Ca2 N O11 -","- C24 H52 Ca8 N4 O44 -","4","0.5","BM1288","Cooksey, Brian G.; Gibson, Lorraine T.; Kennedy, Alan R.; Littlejohn, David; Stewart, Lesley; Tennent, Norman H.","Dicalcium triacetate nitrate dihydrate","Acta Crystallographica Section C","1999","55","3","324","326","10.1107/S0108270198012864","","","0.71069","MoKα","","0.085","0.035","","","","0.106","","","","","","1.023","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008220","7.733","0.002","6.295","0.002","34.222","0.005","90","","95.32","0.03","90","","1658.7","0.7","143","2","143","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-(1'-N,N-dimethylaminophen-4'-yl)-3,4,4a,5,6,10,10a-heptahydroanthracen-2-one","","- C22 H25 N O -","- C22 H25 N O -","- C88 H100 N4 O4 -","4","1","BM1290","Lawrentz, Ulf; Grahn, Walter; Dix, Ina; Jones, Peter G.","Bond-length alternation in rigidized merocyanines","Acta Crystallographica Section C","1999","55","3","446","450","10.1107/S0108270198013778","","","0.71073","MoKα","","0.1311","0.0637","","0.1498","0.1177","","","","1.028","1.107","1.107","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008221","32.972","0.007","8.046","0.002","19.647","0.004","90","","122.371","0.015","90","","4402.2","1.8","143","2","143","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-dicyanomethylene-7-(2'-piperidinothien-5'-yl)-3,4,4a,5,6,10,10a- heptahydroanthracene","","- C26 H27 N3 S -","- C26 H27 N3 S -","- C208 H216 N24 S8 -","8","1","BM1290","Lawrentz, Ulf; Grahn, Walter; Dix, Ina; Jones, Peter G.","Bond-length alternation in rigidized merocyanines","Acta Crystallographica Section C","1999","55","3","446","450","10.1107/S0108270198013778","","","0.71073","MoKα","","0.1185","0.0632","","0.1452","0.1194","","","","1.026","1.096","1.096","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008222","8.2103","0.0001","25.6785","0.0006","11.6874","0.0002","90","","105.004","0.001","90","","2380.03","0.08","203","2","203","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(2'R,6'R)-1-Methoxy-4-(2""-methylprop-2""-enyloxy)-2-(4',4',6'-trimethyl- 1',3'-dioxan-2'-yl)anthraquinone","","- C26 H28 O6 -","- C26 H28 O6 -","- C104 H112 O24 -","4","2","BM1293","Cambie, Richard C.; Lorimer, Rachel M.; Rickard, Clifton E. F.; Rutledge, P. Stewart","Two dioxane derivatives of anthraquinone","Acta Crystallographica Section C","1999","55","3","436","439","10.1107/S0108270198014541","","","0.71073","MoKα","","0.06","0.043","","","","0.11","","","","","","1.051","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008223","6.793","0.0001","14.0076","0.0002","22.277","0.0001","90","","90","","90","","2119.74","0.04","203","2","203","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(2'R,6'R)-4-Hydroxy-3-(2""methylprop-2""-enyloxo)-2-(4',4',6'-trimethyl- 1',3'-dioxan-2'-yl)anthraquinone.","","- C25 H26 O5 -","- C25 H26 O5 -","- C100 H104 O20 -","4","1","BM1293","Cambie, Richard C.; Lorimer, Rachel M.; Rickard, Clifton E. F.; Rutledge, P. Stewart","Two dioxane derivatives of anthraquinone","Acta Crystallographica Section C","1999","55","3","436","439","10.1107/S0108270198014541","","","0.71073","MoKα","","0.044","0.034","","","","0.086","","","","","","1.035","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008224","14.984","0.008","14.437","0.005","25.361","0.009","90","0.02","107.39","0.03","90","0.03","5235","4","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Diaquanonaphenyltristiboxane diperchlorate","","- C54 H49 Cl2 O12 Sb3 -","- C54 H49 Cl2 O12 Sb3 -","- C216 H196 Cl8 O48 Sb12 -","4","0.5","BM1295","Baker, L-J; Rickard, Clifton E. F.; Taylor, Michael J.","Diaquanonaphenyltristiboxane diperchlorate","Acta Crystallographica Section C","1999","55","3","335","337","10.1107/S0108270198014632","","","0.71069","MoKα","","0.051","0.034","","","","0.098","","","","","","1.052","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008225","10.2981","0.0008","10.8896","0.0009","12.1733","0.0007","90","","90","","90","","1365.14","0.17","294","1","294","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2S,4S,5R)-(-)-2-(1,3-thiazol-2-yl)-3,4-dimethyl-5-phenyl-1,3-oxazolidine","","- C14 H16 N2 O S -","- C14 H16 N2 O S -","- C56 H64 N8 O4 S4 -","4","1","BM1296","Fitzsimons, Lavelle M.; Gallagher, John F.","Intermolecular C—H···N and C—H···O interactions in (2<i>S</i>,4<i>S</i>,5<i>R</i>)-(–)-3,4-dimethyl-5-phenyl-2-(1,3-thiazol-2-yl)-1,3-oxazolidine","Acta Crystallographica Section C","1999","55","3","472","474","10.1107/S0108270198014103","","","0.7107","MolybdenumKα","","0.0434","0.0347","","","","0.0905","","","","","","1.024","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008226","10.422","0.005","10.422","0.005","7.467","0.003","90","","90","","120","","702.4","0.6","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","pentalead tris(vanadate) iodide","","","- I1.7 O24 Pb9.85 V6 -","- I1.704 O24 Pb9.844 V6 -","- I1.704 O24 Pb9.844 V6 -","1","0.0833333","BR1208","Fabienne Audubert; Jean-Michel Savariault; Jean-Louis Lacout","Pentalead tris(vanadate) iodide, a defect vanadinite-type compound","Acta Crystallographica Section C","1999","55","3","271","273","10.1107/S0108270198005034","","","0.71073","MoKα","","0.0526","0.0364","","","0.0783","0.0705","","","","","","0.834","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008227","15.181","0.009","5.0319","0.0008","20.76","0.004","90","","109.07","0.03","90","","1498.8","1","293","2","293","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","sodium vanadate","","- Na4.5 O17.5 V7 -","- Na4.5 O17.5 V7 -","- Na18 O70 V28 -","4","1","BR1224","Millet, Patrice; Henry, Jean-Yves; Galy, Jean","The vanadium oxide bronze η-Na~<i>x~</i>V~2~O~5~ (<i>x</i> = 1.286)","Acta Crystallographica Section C","1999","55","3","276","279","10.1107/S010827019801587X","","","0.71069","MoKα","","0.106","0.045","","0.127","0.112","","","","0.963","1.176","1.176","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008228","17.38","0.003","11.6","0.002","13.418","0.003","90","","110.92","0.03","90","","2526.9","1","292","2","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H21 Co N7 O6 -","- C27 H21 Co N7 O6 -","- C108 H84 Co4 N28 O24 -","4","0.5","CF1249","Fu, You-Jun; Gao, Zhang-Shou; Yang, Hao; Dai, Wenning; Wang, Defen; Hu, Hongwen; Tang, Wenxia; Zhang, Zeying; Mak, Thomas C.W.","A monohelical cobalt(II) complex of a quinquepyridine ligand","Acta Crystallographica Section C","1999","55","3","349","351","10.1107/S0108270198013651","","","0.71073","MoKα","","","0.054","","","0.061","","","","","1.25","1.25","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008229","7.7544","0.0002","31.6493","0.001","13.2174","0.0004","90","","93.004","0.001","90","","3239.37","0.16","150","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(saccharinato)aquabis(2,2'-bipyridene)manganese(II)saccharinate","","- C34 H26 Mn N6 O7 S2 -","- C34 H26 Mn N6 O7 S2 -","- C136 H104 Mn4 N24 O28 S8 -","4","1","CF1256","Dillon, Keith B.; Bilton, Clair; Howard, Judith A. K.; Hoy, Vanessa J.; Deng, Robert M. K.; Sethatho, David T.","The first manganese(II) compound with the saccharinate ligand present both in the complex cation and as the counter-ion: [Mn(bipy)~2~(sac)(H~2~O)]^+^^.^sac^{-^}","Acta Crystallographica Section C","1999","55","3","330","332","10.1107/S0108270198013663","","","0.71073","MoKα","","","0.048","","","0.079","0.105","","","","1.065","1.065","1.064","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008230","16.5433","0.0004","16.4583","0.0005","12.3847","0.0002","90.0107","0.0003","103.965","0.001","90.0089","0.0011","3272.37","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-dicyano-4-thiodiphenylaminobenzene","","- C20 H11 N3 S -","- C20 H11 N3 S -","- C160 H88 N24 S8 -","8","2","CF1257","Sema Öztürk; Şamil Işık; Hoong-Kun Fun; Engin Kendi; Erbil Ag̃ar; Selami Şaşmaz; Abdul Razak İbrahim","4-(Phenothiazin-10-yl)benzene-1,2-dicarbonitrile","Acta Crystallographica Section C","1999","55","3","395","397","10.1107/S0108270198012347","","","0.71073","MoKα","","0.0515","0.036","","0.0949","0.0856","","","","1.034","1.071","1.071","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008231","8.735","0.002","9.093","0.002","15.64","0.003","82.94","0.03","85.85","0.02","81.76","0.02","1218.2","0.5","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","Sodium Aquo(1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetato)holmium(III) Tetrahydrate.","","- C16 H34 Ho N4 Na O13 -","- C16 H34 Ho N4 Na O13 -","- C32 H68 Ho2 N8 Na2 O26 -","2","1","CF1277","Benetollo, Franco; Bombieri, Gabriella; Aime, Silvio; Botta, Mauro","A holmium complex of a macrocyclic ligand (DOTA) and its isostructural europium analogue","Acta Crystallographica Section C","1999","55","3","353","356","10.1107/S0108270198014450","","","0.71073","MoKα","","0.024","0.024","","0.061","0.061","","","","1.069","1.069","1.069","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008232","8.734","0.002","9.116","0.003","15.773","0.003","82.83","0.03","85.34","0.03","81.43","0.02","1229.6","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Sodium Aquo(1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetato)europium(III) Tetrahydrate.","","- C16 H34 Eu N4 Na O13 -","- C16 H34 Eu N4 Na O13 -","- C32 H68 Eu2 N8 Na2 O26 -","2","1","CF1277","Benetollo, Franco; Bombieri, Gabriella; Aime, Silvio; Botta, Mauro","A holmium complex of a macrocyclic ligand (DOTA) and its isostructural europium analogue","Acta Crystallographica Section C","1999","55","3","353","356","10.1107/S0108270198014450","","","0.71073","MoKα","","0.019","0.019","","0.052","0.051","","","","1.109","1.109","1.109","","","","","has coordinates","199684","2020-10-21","18:00:00",""
"2008233","30.968","0.002","6.003","0.002","11.394","0.002","90","","107.26","0.01","90","","2022.8","0.8","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","Z-Proψ[CO-N(NH2)]-Ala-NH^i^Pr","","","- C19 H28 N4 O4 -","- C19 H28 N4 O4 -","- C76 H112 N16 O16 -","4","1","CF1278","Aubry, Andre; Del Duca, Valerio; Pedone, Carlo; Zerkout, Said; Marraud, Michel","Dipeptide (<i>Z</i>)-Pro-ψ[CO-N(NH~2~)]-Ala-NH^<i>i^</i>Pr","Acta Crystallographica Section C","1999","55","3","439","441","10.1107/S0108270198013675","","","1.5418","CuKα","","0.0925","0.0543","","0.1588","0.1163","","","","0.971","1.078","1.078","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008234","9.3761","0.0006","9.4407","0.0005","10.7822","0.0006","71.424","0.003","87.87","0.01","67.852","0.003","834.18","0.09","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","trans-Diiodobis(triphenylphosphine)palladium(II)","","- C36 H30 I2 P2 Pd -","- C36 H30 I2 P2 Pd -","- C36 H30 I2 P2 Pd -","1","0.5","CF1284","Cave, Gareth W. V.; Errington, William; Rourke, Jonathan P.","<i>trans</i>-Diiodobis(triphenylphosphine)palladium(II)","Acta Crystallographica Section C","1999","55","3","320","322","10.1107/S0108270198015868","","","0.71073","MoKα","","0.047","0.034","","","","0.094","","","","","","1.012","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008235","11.173","0.004","7.324","0.005","12.024","0.008","90","","97.82","0.04","90","","974.8","1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Homolycorine Hydrochloride dihydrate","(1S,5S,4aR,10bS)-8,9-diethoxy-N-methyl-(2)benzopyran(3,4-g)indolin-6-one","","- C18 H26 Cl N O6 -","- C18 H24 Cl N O6 -","- C36 H48 Cl2 N2 O12 -","2","1","CF1288","Francesc Viladomat; Jaume Bastida; Carles Codina; Xavier Solans; 'Mercè Font-Bardia","Homolycorine hydrochloride dihydrate","Acta Crystallographica Section C","1999","55","3","385","387","10.1107/S0108270198014644","","","0.71069","MoKα","","0.0439","0.0329","","","","0.0568","","","","","","0.875","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008236","15.018","0.005","18.383","0.004","14.671","0.007","98.91","0.03","117.43","0.03","97.21","0.02","3461","2","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","1-chloro-1-hydrido-2,6-di(2-hydroxyethoxy)-1,3,5-tris(triphenylphosphine)- iso-closo-1-ruthenadecaborane‒trichloromethane (1:1.2)","","- C59.2 H62.2 B9 Cl4.6 O4 P3 Ru -","- C59.2 H62.2 B9 Cl4.6 O4 P3 Ru -","- C118.4 H124.4 B18 Cl9.2 O8 P6 Ru2 -","2","1","DA1032","Hai-Jun Yao; Chun-Hua Hu; Jian-Min Dou; Jie Sun; Jing-De Wei; Ruo-Shui Jin; Zu-En Huang; Pei-Ju Zheng","A degraded glycol-substituted <i>iso</i>-<i>closo</i> ten-vertex ruthenaborane: [(PPh~3~)HClRuB~9~H~5~(OCH~2~CH~2~OH)~2~(PPh~3~)~2~]^.^1.2CHCl~3~","Acta Crystallographica Section C","1999","55","3","337","339","10.1107/S0108270198013237","","","0.71069","MoKα","","0.17","0.07","","","","0.242","","","","","","1.052","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008237","9.027","0.001","11.095","0.003","7.275","0.002","106.23","0.02","108.02","0.02","78.09","0.02","659.5","0.3","296","","","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H32 Co N2 O10 -","- C24 H32 Co N2 O10 -","- C24 H32 Co N2 O10 -","1","0.5","DA1034","Okabe, Nobuo; Makino, Tomomi","<i>trans</i>-Diaquabis(quinoline-2-carboxylato-<i>N</i>,<i>O</i>)cobalt(II)–water–ethanol (1/2/2)","Acta Crystallographica Section C","1999","55","3","300","302","10.1107/S0108270198013584","","","0.71069","MoKα","","","0.063","","","0.097","","","","","1.5","1.5","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008238","10.735","0.002","13.31","0.002","5.205","0.001","90","","90","","90","","743.7","0.2","296","","","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C12 H14 Co N4 O6 -","- C12 H14 Co N4 O6 -","- C24 H28 Co2 N8 O12 -","2","0.5","DA1037","Okabe, Nobuo; Adachi, Yukari","Bis[2-hydroxy-3-(1<i>H</i>-imidazol-4-yl)propionato]cobalt(II)","Acta Crystallographica Section C","1999","55","3","302","304","10.1107/S0108270198013614","","","0.71069","MoKα","","","0.032","","","0.048","","","","","1.25","1.25","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008239","4.906","0.003","14.838","0.005","19.488","0.003","90","","90","","90","","1418.6","1","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-(4-hydroxy-5-hydroxymethyltetrahydrofuran-2-yl)-5-methoxymethyl- 4-dimethylamino-(1H)-pyrimidin-2-one","","- C13 H21 N3 O5 -","- C13 H21 N3 O5 -","- C52 H84 N12 O20 -","4","1","DA1046","Audette, Gerald F.; Zoghaib, Wajdi M.; Gupta, Sagar V.; Quail, J. Wilson; Delbaere, Louis T. J.","<i>N</i>,<i>N</i>-Dimethyl-5-methoxymethyl-2'-deoxycytidine","Acta Crystallographica Section C","1999","55","3","427","430","10.1107/S0108270198013249","","","0.7093","MoKα","","0.046","0.037","","","","0.09","","","","","","1.065","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008240","6.5429","0.0008","9.0345","0.0009","23.894","0.004","90","0.011","90","0.011","90","0.01","1412.4","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Equilin","3-Hydroxyestra-1,3,5(10),7-tetraen-17-one","","- C18 H20 O2 -","- C18 H20 O2 -","- C72 H80 O8 -","4","1","DA1048","Sawicki, Mark W.; Li, Naiyin; Ghosh, Debashis","Equilin","Acta Crystallographica Section C","1999","55","3","425","427","10.1107/S0108270198013250","","","1.54178","CuKα","","0.052","0.05","","","","0.134","","","","","","1.071","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008241","10.115","0.003","10.757","0.004","30.986","0.004","90","","96.24","0.02","90","","3351.5","1.7","297","","297","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H50 Cl8 Cu2 N2 O18 -","- C62 H50 Cl8 Cu2 N2 O18 -","- C124 H100 Cl16 Cu4 N4 O36 -","2","0.5","DA1053","Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Matsushima, Hideaki; Noguchi, Masakazu; Tokii, Tadashi","A dimeric copper(II) bis(4-chlorophenoxy)acetate adduct with dimethylformamide","Acta Crystallographica Section C","1999","55","3","316","318","10.1107/S0108270198014899","","","0.71073","MoKα","","0.065","0.059","","","","0.062","","","","","","1.795","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008242","8.045","0.002","8.937","0.002","26.773","0.003","90","0.01","90","0.01","90","0.02","1924.9","0.7","293","2","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","5'-(toluenesulfonyl)adenosine","","- C17 H19 N5 O6 S -","- C17 H19 N5 O6 S -","- C68 H76 N20 O24 S4 -","4","1","DE1093","D. Prahadeeswaran; T. Parthasarathy Seshadri","5'-<i>O</i>-(Toluenesulfonyl)adenosine","Acta Crystallographica Section C","1999","55","3","389","391","10.1107/S0108270198013262","","","1.5418","CuKα","","0.055","0.039","","0.129","0.115","","","","1.032","1.049","1.049","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008243","4.851","0.002","13.535","0.003","14.013","0.005","90","","97.28","0.01","90","","912.7","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N^4^Anisoylcytidine Dihydrate","","- C17 H23 N3 O9 -","- C17 H23 N3 O9 -","- C34 H46 N6 O18 -","2","1","DE1095","S. Kolappan; T. P. Seshadri","<i>N</i>^4^-Anisoylcytidine dihydrate","Acta Crystallographica Section C","1999","55","3","391","392","10.1107/S0108270198013274","","","1.5418","CuKα","","0.049","0.042","","0.132","0.117","","","","1.051","1.062","1.062","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008244","16.239","0.003","11.717","0.003","11.627","0.004","90","","93.69","0.02","90","","2207.7","1","298.2","","298.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Troglitazone","5-{4-[(4a,5,6,7,8,8a-hexahydro-6-hydroxy-2,5,7,8-tetramethylchroman-2- yl)methyloxy]benzyl}thiazolidine-2,4-dione","","- C24 H27 N O5 S -","- C24 H27 N O5 S -","- C96 H108 N4 O20 S4 -","4","1","DE1099","K. Vyas; A. Sivalakshmidevi; C. Prabhakar; G. Om Reddy","Troglitazone, an euglycemic antidiabetic drug","Acta Crystallographica Section C","1999","55","3","411","413","10.1107/S010827019801467X","","","1.5418","CuKα","","0.092","0.062","","0.058","","0.056","","","1.828","","","2.039","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008245","29.501","0.002","8.5509","0.0014","7.963","0.003","90","","101.15","0.02","90","","1970.8","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(méta-anisidinium) Dihydrogénodiphosphate","","- C14 H22 N2 O9 P2 -","- C14 H22 N2 O9 P2 -","- C56 H88 N8 O36 P8 -","4","0.5","DU1178","Ould Abdellahi, Mohamed; Ben Amor, Fatma; Driss, Ahmed; Jouini, Tahar","Bis(<i>m</i>-anisidinium) dihydrogénodiphosphate","Acta Crystallographica Section C","1999","55","3","474","476","10.1107/S010827019801155X","","","0.71069","MoKα","","0.0899","0.0516","","0.1296","0.1107","","","","1.058","1.145","1.145","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008246","14.5297","0.0016","8.2314","0.0014","14.3684","0.0018","90","","90","","90","","1718.5","0.4","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C14 H16 Cl2 N2 Ni S2 -","- C14 H16 Cl2 N2 Ni S2 -","- C56 H64 Cl8 N8 Ni4 S8 -","4","0.5","FG1490","Thangarasu Pandiyan; Bernès, Sylvain; Durán de Bazúa, Carmen","Dichloro[2,2'-(2,5-dithiahexamethylene)dipyridine-<i>N</i>,<i>N</i>',<i>S</i>,<i>S</i>']nickel(II)","Acta Crystallographica Section C","1999","55","3","318","320","10.1107/S010827019801422X","","","0.71073","MoKα","","0.0445","0.03","","","0.0641","0.0694","","","","","","1.013","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008247","11.009","0.002","5.949","0.001","14.466","0.003","90","","105.66","0.01","90","","912.2","0.3","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H13 N O3 -","- C9 H13 N O3 -","- C36 H52 N4 O12 -","4","1","FG1506","Zukerman-Schpector, J.; Biaggio, Francisco C.; Rufino, Alessandra R.; Caracelli, I.","Two new spiro lactam-lactones","Acta Crystallographica Section C","1999","55","3","416","419","10.1107/S0108270198010403","","","0.71073","MoKα","","0.1783","0.074","","0.2297","","0.163","","","1.029","","","1.026","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008248","9.991","0.001","10.098","0.001","10.576","0.001","90","","108.98","0.01","90","","1008.99","0.18","293","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H15 N O3 -","- C10 H15 N O3 -","- C40 H60 N4 O12 -","4","1","FG1506","Zukerman-Schpector, J.; Biaggio, Francisco C.; Rufino, Alessandra R.; Caracelli, I.","Two new spiro lactam-lactones","Acta Crystallographica Section C","1999","55","3","416","419","10.1107/S0108270198010403","","","0.71073","MoKα","","0.1631","0.047","","0.1326","","0.104","","","0.97","","","0.97","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008249","6.9403","0.0005","9.948","0.0007","9.5931","0.0007","90","","90","","90","","662.33","0.08","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C4 H6 O6 Pb -","- C4 H6 O6 Pb -","- C16 H24 O24 Pb4 -","4","0.5","FG1511","Norberg, Stefan; Svensson, Göran; Albertsson, Jörgen","Lead(II) oxydiacetate hydrate","Acta Crystallographica Section C","1999","55","3","356","358","10.1107/S0108270198014115","","","0.71073","MoKα","","0.061","0.044","","0.129","","0.112","","","1.158","","","1.197","","","","has coordinates,has disorder","301791","2025-08-18","23:15:32",""
"2008250","10.458","0.002","7.619","0.002","13.28","0.002","90","","91.94","0.01","90","","1057.5","0.4","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","(+)-3-Oxo-5α-cholan-24-oic Acid","(+)-3-Oxo-5α-cholan-24-oic Acid","","- C24 H38 O3 -","- C24 H38 O3 -","- C48 H76 O6 -","2","1","FG1512","Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.","(+)-3-Oxo-5α-cholan-24-oic acid: catemeric hydrogen bonding in a steroidal keto acid","Acta Crystallographica Section C","1999","55","3","419","422","10.1107/S0108270198012931","","","0.71073","MoKα","","0.069","0.046","","0.122","0.101","","","","1.07","1.1","1.1","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008251","11.401","0.001","14.698","0.002","5.0903","0.0006","90","","94.53","0.009","90","","850.33","0.17","293","2","288","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-hydroxyethyl-2,2'-biimidazole","","- C8 H10 N4 O -","- C8 H10 N4 O -","- C32 H40 N16 O4 -","4","1","FG1514","Lin, Geng; Collier, Harvest; Baughman, Russell G.","1-Hydroxyethyl-2,2'-biimidazole","Acta Crystallographica Section C","1999","55","3","476","478","10.1107/S0108270198017387","","","0.71073","MoKα","","0.063","0.04","","0.113","0.095","","","","1.012","1.075","1.075","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008252","7.579","0.002","17.55","0.002","11.111","0.005","90","","90","","90","","1477.9","0.8","296","","296","","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C8 H20 N6 Ni S2 -","- C8 H20 N6 Ni S2 -","- C32 H80 N24 Ni4 S8 -","4","0.5","FR1148","Moore, Stephanie L.; Philip J. Squattrito","Bis(1,3-propanediamine-<i>N</i>,<i>N</i>')bis(thiocyanato-<i>N</i>)nickel(II)","Acta Crystallographica Section C","1999","55","3","332","334","10.1107/S0108270198013419","","","0.7107","MoKα","","","0.04","","","","0.05","","","","","","2.12","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008253","8.817","0.002","9.872","0.002","13.672","0.003","90","","90","","90","","1190","0.4","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Idazoxan hydrobromide","2-(1,4-benzodioxan-2-yl)imidazolinium bromide","","- C11 H13 Br N2 O2 -","- C11 H13 Br N2 O2 -","- C44 H52 Br4 N8 O8 -","4","1","FR1149","Brunel, Serge; Maurel, Jean Louis; Ribet, Jean Paul; Monconduit, Laure; Tillard, Monique; Belin, Claude","Absolute configuration of 2-(1,4-benzodioxan-2-yl)imidazolinium bromide","Acta Crystallographica Section C","1999","55","3","441","443","10.1107/S0108270198013286","","","0.71073","MoKα","","0.08","0.036","","","","0.089","","","","","","0.959","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008254","9.871","0.002","11.044","0.002","13.117","0.003","87.403","0.008","89.625","0.004","67.3872","0.0011","1318.6","0.5","180","","180","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H15 N3 S2 -","- C12 H15 N3 S2 -","- C48 H60 N12 S8 -","4","2","FR1159","John S. Davidson; Steven J. Rettig; James Trotter","Fromm's methylphenyldithiodimethylketuret","Acta Crystallographica Section C","1999","55","3","434","436","10.1107/S0108270198013432","","","0.71069","MoKα","","0.1182","0.04","","0.0768","0.077","","","","1.02","","","1.02","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008255","12.8953","0.0017","10.0927","0.0011","14.413","0.002","90","","106.638","0.012","90","","1797.2","0.4","153","2","153","2","","","","","","","","6","P 1 21 1","P 2yb","4","paroxetine hydrochloride hemihydrate","","","- C19 H22 Cl F N O3.5 -","- C19 H22 Cl F N O3.5 -","- C76 H88 Cl4 F4 N4 O14 -","4","2","","Ibers, James A.","Paroxetine hydrochloride hemihydrate","Acta Crystallographica Section C","1999","55","3","432","434","10.1107/S0108270198013444","","","","","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008256","8.7931","0.0005","9.2891","0.0004","13.2423","0.0009","89.657","0.004","73.646","0.007","82.804","0.005","1029.21","0.11","291","2","","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H21 F6 Na O7 -","- C15 H21 F6 Na O7 -","- C30 H42 F12 Na2 O14 -","2","1","GD1004","Farrugia, Louis J.; Watson, Ian M.","(1,1,1,5,5,5-Hexafluoro-2,4-pentanedionato-<i>O</i>,<i>O</i>')(1,4,7,10,13-pentaoxapentadecane-κ^5^<i>O</i>)sodium","Acta Crystallographica Section C","1999","55","3","326","328","10.1107/S0108270198013031","","","0.71073","MoKα","","","0.055","","","","0.175","","","","","","1.045","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008257","20.43","0.004","5.591","0.004","5.288","0.0006","90","","93.26","0.01","90","","603","0.5","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Nitrate d'Argent et de Césium: AgCs(NO~3~)~2~","","- Ag Cs N2 O6 -","- Ag Cs N2 O6 -","- Ag4 Cs4 N8 O24 -","4","0.5","GS1014","Ben Amor, Fatma; Hellali, Dalila; Zamali, Hmida","Nitrate d'argent et de césium: AgCs(NO~3~)~2~","Acta Crystallographica Section C","1999","55","3","281","282","10.1107/S0108270198013304","","","0.71069","MoKα","","0.045","0.043","","0.129","0.128","","","","1.265","1.29","1.29","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008258","10.9742","0.0007","14.467","0.001","6.731","0.001","90","","104.28","0.01","90","","1035.62","0.19","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Nickel potassium arsenate.","","- As6 K4 Ni7 O24 -","- As6 K4 Ni7 O24 -","- As12 K8 Ni14 O48 -","2","0.25","GS1015","Ben Smail, Ridha; Driss, Ahmed; Jouini, Tahar","K~4~Ni~7~(AsO~4~)~6~","Acta Crystallographica Section C","1999","55","3","284","286","10.1107/S0108270198012293","","","0.71069","MoKα","","0.0379","0.0339","","0.0812","0.0798","","","","1.264","1.306","1.306","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008259","11.992","0.003","15.932","0.002","7.222","0.002","90","","90","","90","","1379.8","0.5","293","","293","","","","","","","","","4","F d d 2","F 2 -2d","43","Strontium vanadium monophosphate","","","- O10 P2 Sr V2 -","- O10 P2 Sr V2 -","- O80 P16 Sr8 V16 -","8","0.5","GS1016","Berrah, Fadila; Leclaire, André; Borel, Marie-Madeleine; Guesdon, Anne; Raveau, Bernard","A new vanadium(IV) monophosphate, Sr(VO)~2~(PO~4~)~2~, isotypic with Ca(VO)~2~(PO~4~)~2~","Acta Crystallographica Section C","1999","55","3","288","291","10.1107/S0108270198012372","","","0.71073","Mo_Kα","","0.042","0.042","","0.041","0.041","","","","2.454","2.454","2.454","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008260","25.867","0.002","17.085","0.002","20.363","0.003","90","","106.328","0.002","90","","8636.2","1.8","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C51 H53 N3 O9 -","- C51 H53 N3 O9 -","- C408 H424 N24 O72 -","8","2","GS1018","Thuéry, Pierre; Nierlich, Martine; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques","A 2,2'-azobenzene-substituted calix[4]arene-crown-6","Acta Crystallographica Section C","1999","55","3","443","445","10.1107/S0108270198013882","","","0.71073","MoKα","","","0.0591","","0.1638","0.1015","","","","0.822","1.042","1.042","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008261","7.7385","0.0012","12.199","0.003","20.667","0.002","90","","99.735","0.018","90","","1922.9","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-ethyl-2,3-dihydro-4H-pyrido[3,2-e]-1,2,4-thiadiazine 1,1-dioxide","","- C8 H11 N3 O2 S -","- C8 H11 N3 O2 S -","- C64 H88 N24 O16 S8 -","8","2","GS1021","Dupont, Léon; Pirotte, Bernard; Podona, Tchao; Diouf, Ousmane; Delarge, Jacques; De Tullio, Pascal","4-Ethyl-2,3-dihydro-4<i>H</i>-pyrido[3,2-<i>e</i>]-1,2,4-thiadiazine 1,1-dioxide and 4-ethyl-2,3-dihydro-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-dioxide","Acta Crystallographica Section C","1999","55","3","461","464","10.1107/S0108270198013894","","","1.5418","CuKα","","0.0852","0.0453","","","","0.1317","","","","","","0.943","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008262","8.1628","0.0004","11.6259","0.0008","10.2405","0.0011","90","","97.841","0.007","90","","962.74","0.13","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-ethyl-2,3-dihydro-4H-pyrido[4,3-e]-1,2,4-thiadiazine 1,1-dioxide","","- C8 H11 N3 O2 S -","- C8 H11 N3 O2 S -","- C32 H44 N12 O8 S4 -","4","1","GS1021","Dupont, Léon; Pirotte, Bernard; Podona, Tchao; Diouf, Ousmane; Delarge, Jacques; De Tullio, Pascal","4-Ethyl-2,3-dihydro-4<i>H</i>-pyrido[3,2-<i>e</i>]-1,2,4-thiadiazine 1,1-dioxide and 4-ethyl-2,3-dihydro-4<i>H</i>-pyrido[4,3-<i>e</i>]-1,2,4-thiadiazine 1,1-dioxide","Acta Crystallographica Section C","1999","55","3","461","464","10.1107/S0108270198013894","","","1.5418","CuKα","","0.0463","0.0382","","","","0.1064","","","","","","1.06","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008263","10.313","0.004","11.871","0.002","12.713","0.002","90","","90","","90","","1556.4","0.7","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2(S)-7-methoxy-2-(3-(R)-4,5-dihydro-4,4-dimethyl-3H-2-oxo-3-oxicarbonyl)- 2,3-dihydro-1,4-benzodioxin","","- C16 H18 O7 -","- C16 H18 O7 -","- C64 H72 O28 -","4","1","GS1024","Mostafa Khouili; M. Dolors Pujol; Xavier Solans; Mercè Font-Bardia; Abdelaman Souizi; Gerard Coudert; Gerald Guillaumet","(3<i>R</i>)-4,4-Dimethyl-2-oxotetrahydrofuran-3-yl (<i>2S</i>)-7-methoxy-2,3-dihydro-1,4-benzodioxin-2-carboxylate","Acta Crystallographica Section C","1999","55","3","387","389","10.1107/S0108270198013900","","","0.71069","MoKα","","0.0631","0.0536","","","","0.152","","","","","","1.049","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008264","14.618","0.003","9.323","0.002","25.766","0.005","90","","99.31","0.03","90","","3465.2","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(Acetato-O,O')-(acetato-O)-(2,9-dimethyl-1,10-phenanthroline) zinc(ii)","","- C18 H18 N2 O4 Zn -","- C18 H18 N2 O4 Zn -","- C144 H144 N16 O32 Zn8 -","8","1","HA1237","Harvey, Miguel; Baggio, Sergio; Baggio, Ricardo; Mombrú, Alvaro W.","(Acetato-<i>O</i>,<i>O</i>')(acetato-<i>O</i>)(2,9-dimethyl-1,10-phenanthroline-<i>N</i>,<i>N</i>')zinc(II)","Acta Crystallographica Section C","1999","55","3","308","310","10.1107/S0108270198013481","","","0.71073","MoKα","","0.083","0.037","","","","0.121","","","","","","1.015","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008265","9.034","0.002","10.155","0.001","12.368","0.002","110.35","0.01","89.9","0.02","103.02","0.01","1032.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","6-[N-(2-Hydroxyphenyl)aminomethylene]cyclohexa-2,4-dien-1-one","6-[N-(2-Hydroxyphenyl)aminomethylene]cyclohexa-2,4-dien-1-one","","- C13 H11 N O2 -","- C13 H11 N O2 -","- C52 H44 N4 O8 -","4","2","HA1241","Alok K. Mukherjee; Rajib Lal De; Indrajit Banerjee; Chitra Samanta; Nirmalya P. Nayak","6-[<i>N</i>-(2-Hydroxyphenyl)aminomethylene]cyclohexa-2,4-dien-1-one","Acta Crystallographica Section C","1999","55","3","407","410","10.1107/S0108270198013912","","","1.5418","CuKα","","0.0574","0.0499","","0.1316","0.1248","","","","1.053","1.087","1.087","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008266","4.5686","0.0001","15.7687","0.0002","20.1621","0.0004","90","","90","","90","","1452.5","0.05","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","2-Aminopyrimidine and p-phenylenediacetic acid","","- C14 H15 N3 O4 -","- C14 H15 N3 O4 -","- C56 H60 N12 O16 -","4","0.5","HA1242","Kandasamy Chinnakali; Hoong-Kun Fun; Shyamaprasad Goswami; Ajit Kumar Mahapatra; Gur Dayal Nigam","2-Aminopyrimidine and <i>p</i>-phenylenediacetic acid (1:1) co-crystal","Acta Crystallographica Section C","1999","55","3","399","401","10.1107/S0108270198013626","","","0.71073","MoKα","","0.116","0.059","","","","0.161","","","","","","1.084","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008267","12.225","0.002","13.29","0.003","12.387","0.003","90","","90","","90","","2012.5","0.7","180","2","180","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Trimethylphosphonium trichlorogermanate(II)","Trimethylphosphonium trichlorogermanate(II)","","- C3 H10 Cl3 Ge P -","- C3 H10 Cl3 Ge P -","- C24 H80 Cl24 Ge8 P8 -","8","1","JZ1290","Gabriele Kociok-Köhn; Johannes G. Winter; Alexander C. Filippou","Trimethylphosphonium trichlorogermanate(II)","Acta Crystallographica Section C","1999","55","3","351","353","10.1107/S010827019801169X","","","0.71073","MoKα","","0.0365","0.0307","","","","0.0845","","","","","","1.044","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008268","9.674","0.002","8.482","0.002","17.446","0.004","90","","104.81","0.02","90","","1384","0.6","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(3,7-diethyl-3,7-diazanonane-1,9-dithiolato-S,N,N'S')nickel(II)","","- C11 H24 N2 Ni S2 -","- C11 H24 N2 Ni S2 -","- C44 H96 N8 Ni4 S8 -","4","1","JZ1315","Jörg Schneider; Ralf Hauptmann; Frank Osterloh; Gerald Henkel","(3,7-Diethyl-3,7-diazanonane-1,9-dithiolato-<i>S</i>,<i>N</i>,<i>N</i>',<i>S</i>')nickel(II)","Acta Crystallographica Section C","1999","55","3","328","330","10.1107/S0108270198012578","","","0.71073","MoKα","","","0.024","","","","0.058","","","","1.086","1.086","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008269","9.304","0.002","10.9792","0.0013","13.685","0.003","107.896","0.01","107.812","0.014","96.383","0.011","1233.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(triphenylphosphine)-1κP,2κP-dicopper(I) Di(triphenylphosphine) Diquinoline Bis(μ-Iodine) Dicopper","","- C54 H44 Cu2 I2 N2 P2 -","- C54 H44 Cu2 I2 N2 P2 -","- C54 H44 Cu2 I2 N2 P2 -","1","0.5","JZ1317","Jin, Qiong-Hua; Wang, Yu-Xian; Xin, Xiu-Lan","Di-μ-iodo-1:2κ^4^<i>I</i>-bis(quinoline)-1κ<i>N</i>,2κ<i>N</i>-bis(triphenylphosphine)-1κ<i>P</i>,2κ<i>P</i>-dicopper(I)","Acta Crystallographica Section C","1999","55","3","341","343","10.1107/S010827019801333X","","","0.71073","MoKα","","","0.029","","","","0.065","","","","","","1.023","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008270","8.8005","0.0003","11.1","0.0005","11.628","0.0005","89.746","0.002","69.678","0.003","75.414","0.003","1026.53","0.08","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H17 Gd N6 O12 -","- C15 H17 Gd N6 O12 -","- C30 H34 Gd2 N12 O24 -","2","1","JZ1321","Leverd, Pascal C.; Charbonnel, Marie-Christine; Dognon, Jean-Pierre; Lance, Monique; Nierlich, Martine","Triaquabis(nitrato-<i>O</i>,<i>O</i>')(2,2':6',2''-terpyridine-κ^3^<i>N</i>)gadolinium(III) nitrate","Acta Crystallographica Section C","1999","55","3","368","370","10.1107/S0108270198013316","","","0.71073","MoKα","","0.033","0.027","","0.07","0.062","","","","0.963","0.972","0.972","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008271","13.59","0.002","6.581","0.0011","9.9321","0.0014","90","","90","","90","","888.3","0.2","293","2","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Guanine dihydrochloride","","- C5 H7 Cl2 N5 O -","- C5 H7 Cl2 N5 O -","- C20 H28 Cl8 N20 O4 -","4","0.5","JZ1324","Matković-Čalogović, Dubravka; Sanković, Krešimir","Guaninium dichloride","Acta Crystallographica Section C","1999","55","3","467","469","10.1107/S0108270198014607","","","0.71073","MoKα","","0.098","0.039","","","","0.108","","","","","","1.016","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008272","11.687","0.002","7.576","0.001","24.153","0.003","90","","95.91","0.01","90","","2127.2","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[1-(4-methylphenylazo)-2-oxo-2-phenylethyl)-(4-acetanilide) sulfone","","- C23 H21 N3 O4 S -","- C23 H21 N3 O4 S -","- C92 H84 N12 O16 S4 -","4","1","KA1293","Wojciech M. Wolf","X-ray investigations of sulfur-containing fungicides. I. 4'-{[Benzoyl(4-tolylhydrazono)methyl]sulfonyl}acetanilide","Acta Crystallographica Section C","1999","55","3","469","472","10.1107/S0108270198013559","","","0.71073","MoKα","","0.0598","0.0417","","","","0.1711","","","","","","1.02","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008273","9.7172","0.0006","10.2638","0.0005","10.5991","0.0004","89.996","0.004","102.938","0.004","110.121","0.004","963.96","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","calcium hydronium decavanadate hexadecahydrate","","- Ca2 H38 O46 V10 -","- Ca2 H38 O46 V10 -","- Ca2 H38 O46 V10 -","1","0.5","KA1295","Strukan, Neven; Cindrić, Marina; Kamenar, Boris","Ca~2~(H~3~ O)~2~[V~10~O~28~]^.^16H~2~O","Acta Crystallographica Section C","1999","55","3","291","293","10.1107/S0108270198013468","","","0.7107","MoKα","","0.048","0.03","","","","0.081","","","","","","1.006","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008274","8.001","0.001","15.639","0.001","16.405","0.001","90","","94.15","0.01","90","","2047.3","0.3","298","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C22 H26 N2 O3 -","- C22 H26 N2 O3 -","- C88 H104 N8 O12 -","4","1","KA1300","Hökelek, Tuncer; Kılıç, Zeynel; Bi̇lge, Selen","5,6,7,8,9,10,11,12,18,19,21,22-Dodecahydro-8,9:18,19-dibenzo-1,4,7-trioxa-11,16-diazacyclononadeca-10,16-diene","Acta Crystallographica Section C","1999","55","3","381","383","10.1107/S0108270198013687","","","0.71073","MoKα","","","0.064","","","0.06","","","","","1.06","1.06","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008275","7.894","0.001","13.892","0.001","9.556","0.001","90","","103.28","0.02","90","","1019.9","0.2","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H7 N3 O2 -","- C12 H7 N3 O2 -","- C48 H28 N12 O8 -","4","1","KA1302","Hökelek, Tuncer; Kılıç, Emine; Aktan, Selami","1-Nitrobenzo[<i>c</i>]cinnoline","Acta Crystallographica Section C","1999","55","3","383","385","10.1107/S0108270198013560","","","0.71073","MoKα","","","0.048","","","0.06","","","","","1.68","1.68","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008276","6.1818","0.001","13.008","0.003","13.605","0.009","105","0.03","92.46","0.03","101.74","0.02","1029.3","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H2 F28 N4 -","- C44 H2 F28 N4 -","- C44 H2 F28 N4 -","1","0.5","LN1059","Leroy, Jacques; Bondon, Arnaud; Toupet, Loic","2,3,7,8,12,13,17,18-Octafluoro-5,10,15,20-tetrakis(pentafluorophenyl)porphyrin","Acta Crystallographica Section C","1999","55","3","464","466","10.1107/S0108270198014000","","","0.71073","MoKα","","0.083","0.0421","","","","0.1267","","","","","","1.024","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"2008277","9.3138","0.0008","10.1641","0.0008","18.0633","0.0015","90","","90","","90","","1710","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H22 Cr O3 -","- C18 H22 Cr O3 -","- C72 H88 Cr4 O12 -","4","1","","Bahija Abouhamza; Larbi El Firdoussi; Smaïl Allaoud; Abdellah Karim; Alejandro F. Barrero; Miguel Quirós","(η^6^-Arylhimachalene)tricarbonylchromium(0)","Acta Crystallographica Section C","1999","55","","361","363","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2008278","17.46","0.004","14.33","0.003","10.25","0.002","90","","96.73","0.03","90","","2546.9","0.9","223","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Hexacesium-hexatellurodistannate(III)","Hexacesium-hexatellurodistannate(III)","","- Cs6 Sn2 Te6 -","- Cs6 Sn2 Te6 -","- Cs24 Sn8 Te24 -","4","0.5","LN1072","Friede, Bernd; Jansen, Martin","Cs~6~Sn~2~Te~6~, a new telluridodistannate(III)","Acta Crystallographica Section C","1999","55","3","282","284","10.1107/S0108270198014681","","","0.71073","MoKα","","0.0345","0.0265","","","","0.0613","","","","","","1.199","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008279","6.039","0.002","9.587","0.003","12.598","0.006","80.32","0.03","77.51","0.02","89.48","0.03","701.7","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","4-cyclohexyl-5-cyclohexylamine-tetrazole","","- C13 H23 N5 -","- C13 H23 N5 -","- C26 H46 N10 -","2","1","NA1380","Govindasamy, L.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Hoong-Kun Fun","1-Cyclohexyl-5-cyclohexylaminotetrazole","Acta Crystallographica Section C","1999","55","3","393","395","10.1107/S0108270198012888","","","0.71073","MoKα","","0.0693","0.0547","","0.1557","0.1447","","","","1.021","1.104","1.104","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008280","10.19","0.009","19.104","0.009","12.808","0.009","90","","110.67","0.06","90","","2333","3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 S Sn -","- C27 H24 S Sn -","- C108 H96 S4 Sn4 -","4","1","NA1382","Bruhn, Clemens; Steinborn, Dirk; Lébl, Tomáš; Holeček, Jaroslav","(<i>Z</i>)- and (<i>E</i>)-1-methylthio-1-triphenylstannyl-2-phenylethene","Acta Crystallographica Section C","1999","55","3","363","365","10.1107/S0108270198015200","","","0.71073","MoKα","","0.048","0.044","","0.098","0.094","","","","1.16","1.167","1.167","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008281","9.5512","0.0008","11.0433","0.0008","12.3793","0.001","83.38","0.008","81.737","0.008","67.018","0.007","1187.1","0.18","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H24 S Sn -","- C27 H24 S Sn -","- C54 H48 S2 Sn2 -","2","1","NA1382","Bruhn, Clemens; Steinborn, Dirk; Lébl, Tomáš; Holeček, Jaroslav","(<i>Z</i>)- and (<i>E</i>)-1-methylthio-1-triphenylstannyl-2-phenylethene","Acta Crystallographica Section C","1999","55","3","363","365","10.1107/S0108270198015200","","","0.71073","MoKα","","0.077","0.051","","0.189","0.132","","","","1.239","1.008","1.008","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008282","8.3987","0.0015","6.89","0.004","17.8585","0.0015","90","","90.868","0.011","90","","1033.3","0.6","296.2","","296.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H16 N2 O4 -","- C28 H16 N2 O4 -","- C56 H32 N4 O8 -","2","0.5","OA1075","Okuyama, Kenji; Rozhanskii, Igor; Goto, Kohei","Bilayered structure of <i>N</i>,<i>N</i>'-diphenyl-4,4'-biphthalimide","Acta Crystallographica Section C","1999","55","3","424","425","10.1107/S0108270198013080","","","0.7107","MoKα","","","0.0487","","","0.0668","","","","","1.145","1.145","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008283","5.4508","0.0012","10.2229","0.0012","8.883","0.0017","90","","91.5","0.02","90","","494.82","0.16","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","indium phosphate dihydrate","Indium phosphate dihydrate","","- H4 In O6 P -","- H4 In O6 P -","- H16 In4 O24 P4 -","4","1","OH1113","Sugiyama, Kazumasa; Yu, Jihong; Hiraga, Kenji; Terasaki, Osamu","Monoclinic InPO~4~^.^2H~2~O","Acta Crystallographica Section C","1999","55","3","279","281","10.1107/S010827019801292X","","","0.71069","MoKα","","0.04","0.028","","","","0.068","","","","","","1.071","","","","has coordinates","282548","2023-04-10","20:38:56",""
"2008284","7.118","0.001","20.894","0.001","7.768","0.002","90","","92.2","0.03","90","","1154.4","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C13 H15 N3 -","- C13 H15 N3 -","- C52 H60 N12 -","4","1","OS1029","S. Selladurai; R. Chandrasekaran; L. Govindasamy; P. Murugan; V. T. Ramakrishnan","2-[3-(Pyrrolidin-1-yl)cyclohex-2-en-1-ylidene]propanedinitrile","Acta Crystallographica Section C","1999","55","3","401","403","10.1107/S0108270198009627","","","1.5418","CuKα","","0.0629","0.059","","0.1881","0.172","","","","0.994","1.013","1.013","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008285","5.776","0.008","12.599","0.005","15.288","0.005","90","","90","","90","","1112.5","1.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H15 N O2 -","- C12 H15 N O2 -","- C48 H60 N4 O8 -","4","1","QA0083","Kumar, G. Biju; Shah, Amrish C.; Cardin, Christine J.; Trenkle, Markus","A substituted isoindolin-1-one derived from (<i>R</i>)-(–)-2-amino-1-butanol","Acta Crystallographica Section C","1999","55","3","IUC9900019","","10.1107/S0108270199099758","","","0.71073","MoKα","","0.056","0.04","","0.135","0.092","","","","1","1.018","1.018","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008286","17.836","0.004","9.805","0.002","5.813","0.001","90","","90","","90","","1016.6","0.4","103","2","103","2","","","","","","","","2","P n m a","-P 2ac 2n","62","","2,2,5,5-tetramethyl-hex-3-yne","","- C10 H18 -","- C10 H18 -","- C40 H72 -","4","0.5","QA0089","Boese, Roland; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","2,2,5,5-Tetramethylhex-3-yne at 281K","Acta Crystallographica Section C","1999","55","3","IUC9900016","","10.1107/S0108270199099746","","","0.71073","MoKα","","0.063","0.05","","","","0.145","","","","","","1.046","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008287","7.5623","0.0002","19.8757","0.0006","21.2828","0.0006","90","","90","","90","","3198.93","0.16","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Ethyl-1-(2-chlorophenyl)-4,6-dimethyl-1,2,3,4-tetrahydropyrimidine-2-thione- 5-carboxylate","","- C15 H17 Cl N2 O2 S -","- C15 H17 Cl N2 O2 S -","- C120 H136 Cl8 N16 O16 S8 -","8","1","QA0090","Kandasamy Chinnakali; Hoong-Kun Fun; Annamalai Senthilvelan; Kamaraj Sriraghavan; Vayalakkavoor T. Ramakrishnan","Ethyl 1-(2-chlorophenyl)-4,6-dimethyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate","Acta Crystallographica Section C","1999","55","3","IUC9900017","","10.1107/S0108270199099734","","","0.71073","MoKα","","0.071","0.06","","","","0.15","","","","","","1.211","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008288","11.078","0.001","11.078","0.001","16.231","0.001","90","","90","","90","","1991.9","0.3","173","2","173","2","","","","","","","","5","I 4/m","-I 4","87","","","","- C8 H24 Ca Cu O14 -","- C8 H24 Ca Cu O14 -","- C32 H96 Ca4 Cu4 O56 -","4","0.25","QA0093","El-Bali, Brahim; Bolte, Michael","Redetermination of [CaCu(C~2~H~3~O~2~)~4~(H~2~ O)~2~]^.^6H~2~O at 173 K","Acta Crystallographica Section C","1999","55","3","IUC9900015","","10.1107/S0108270199099771","","","0.71073","MoKα","","0.025","0.02","","","","0.056","","","","","","1.073","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008289","9.789","0.007","12.754","0.003","24.586","0.009","90","","90","","90","","3070","3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","C14-oxygenated taxoid","Taxa-4(20),11-diene-2α,5α,10β,14β-tetrayl 2α,5α,10β-triacetate 14β-(2-methylbutyrate)","","- C31 H46 O8 -","- C31 H46 O8 -","- C124 H184 O32 -","4","1","QA0094","Chattopadhyay, Sunil K.; Sarkhel, Sanjay; Kulshrestha, Manish; Maulik, Prakas R.","A C-14 oxygenated taxoid from the heartwood of <i>Taxus wallichiana</i>","Acta Crystallographica Section C","1999","55","3","IUC9900014","","10.1107/S0108270199099722","","","0.71073","MoKα","","0.1324","0.0665","","0.2701","0.1886","","","","0.731","0.805","0.805","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008290","19.263","0.002","11.285","0.002","30.361","0.005","90","","104.96","0.01","90","","6376.3","1.7","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","μ-oxobis[(trimethylphosphine-P)(trimethylphosphine oxide-O)dichloro- oxomolybdenum(V)] diethylether semisolvate","","- C14 H41 Cl4 Mo2 O5.5 P4 -","- C14 H41 Cl4 Mo2 O5.5 P4 -","- C112 H328 Cl32 Mo16 O44 P32 -","8","2","QB0081","Cotton, F. Albert; Daniels, Lee M.; Herrero, Santiago","μ-Oxo-bis[dichlorooxo(trimethylphosphine-<i>P</i>)(trimethylphosphine oxide-<i>O</i>)molybdenum(V)] diethyl ether hemisolvate","Acta Crystallographica Section C","1999","55","3","IUC9900018","","10.1107/S010827019909976X","","","0.71073","MoKα","","0.093","0.062","","0.147","0.117","","","","1.203","1.137","1.137","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008291","9.83","0.003","23.121","0.002","15.701","0.001","90","","105.95","0.01","90","","3431.1","1.1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Chloro{rac,trans-[1-(chloro{piperidin-1-yl})phosphino-2-bis(piperidin-1-yl)- phosphino]cyclopentane}neopentylplatinum(II) Acetone Solvate","","- C28 H55 Cl2 N3 O P2 Pt -","- C28 H55 Cl2 N3 O P2 Pt -","- C112 H220 Cl8 N12 O4 P8 Pt4 -","4","1","SK1171","Dahlenburg, Lutz; Mertel, Stefan","Chiral bisphosphanes. V. Chloro{<i>rac</i>,<i>trans</i>-1-[chloro(piperidin-1-yl)phosphino]-2-[bis(piperidin-1-yl)phosphino]cyclopentane-<i>P</i>,<i>P</i>'}neopentylplatinum(II) acetone solvate","Acta Crystallographica Section C","1999","55","3","347","349","10.1107/S010827019801498X","","","0.7107","MoKα","","","0.061","","0.103","","0.1","","","1.041","","","1.015","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008292","14.91","0.002","10.299","0.001","15.184","0.001","90","0.01","92.93","0.01","90","0.01","2328.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","5-ethoxycarbonylmethyl-1-ethyl-2,3,4,6,7,12-hexahydroindolo[2,3-a] quinolizin-5-ium trifluoromethanesulfonate","","- C22 H27 F3 N2 O5 S -","- C22 H27 F3 N2 O5 S -","- C88 H108 F12 N8 O20 S4 -","4","1","SK1208","Bombicz, Petra; Kálmán, Alajos","Crystallographic evidence of the formation of an <i>N</i>-alkylated enammonium salt: 5-ethoxycarbonylmethyl-1-ethyl-2,3,6,7-tetrahydro-4<i>H</i>,12<i>H</i>-indolo[2,3-<i>a</i>]quinolizin-5-ium trifluoromethanesulfonate","Acta Crystallographica Section C","1999","55","3","454","455","10.1107/S0108270198013936","","","1.54178","CuKα","","0.0635","0.0505","","0.1609","","0.1543","","","1.083","","","1.116","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2008293","7.862","0.0008","19.526","0.002","10.469","0.001","90","0.009","105.15","0.01","90","0.009","1551.3","0.3","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","N N'-bis(2-methoxyethyl)pyromellitimide","2,6-bis(3oxabutyl)pyrrolo[3,4f]isoindole-1,3,5,7 tetraone","","- C16 H16 N2 O6 -","- C16 H16 N2 O6 -","- C64 H64 N8 O24 -","4","1","SK1219","Bernadette Suchod; Jean-Pierre Curtet; David Djurado; Michel Armand","<i>N,N</i>'-Bis(2-methoxyethyl)pyromellitimide","Acta Crystallographica Section C","1999","55","3","445","446","10.1107/S0108270198013997","","","0.71073","MoKα","","0.072","0.044","","0.04","0.036","","","","1.345","","","1.526","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008294","14.465","0.001","8.3997","0.0004","9.4614","0.0004","90","","97.74","0.01","90","","1139.1","0.11","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","dicesium trimolybdate","","- Cs2 Mo3 O10 -","- Cs2 Mo3 O10 -","- Cs8 Mo12 O40 -","4","0.5","SK1225","Enjalbert, Renée; Guinneton, Frédéric; Galy, Jean","Cs~2~Mo~3~O~10~","Acta Crystallographica Section C","1999","55","3","273","276","10.1107/S0108270198012979","","","0.71069","MoKα","","0.042","0.028","","0.079","0.075","","","","1.079","1.165","1.165","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008295","10.3121","0.0004","11.3409","0.0007","12.7787","0.0008","113.224","0.005","101.056","0.004","102.401","0.004","1276.1","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis(diisopropylammonium) bis(oxalatotriphenylstannate)","","- C26 H31 N O4 Sn -","- C26 H31 N O4 Sn -","- C52 H62 N2 O8 Sn2 -","2","1","SK1232","Ng, Seik Weng; Hook, James M.","Diisopropylammonium oxalatotriphenylstannate","Acta Crystallographica Section C","1999","55","3","310","312","10.1107/S0108270198011858","","","0.71073","MoKα","","0.0377","0.0275","","","","0.0656","","","","","","0.999","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008296","9.6433","0.0006","21.545","0.002","25.366","0.002","101.73","0.006","93.312","0.005","96.534","0.006","5108.8","0.7","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Aquatriphenyl-μ-(N,N-3-oxapentamethylenethiocarbamoylthioacetato)tin- triphenyl(N,N-3-oxapentametheylenethiocarbamoylthioacetato)tin","","- C50 H52 N2 O7 S4 Sn2 -","- C50 H52 N2 O7 S4 Sn2 -","- C200 H208 N8 O28 S16 Sn8 -","4","2","SK1237","Ng, Seik Weng; Hook, James M.","Bis[(<i>N</i>,<i>N</i>-3-oxapentamethylenethiocarbamoylthioacetato)triphenyltin] hydrate and bis(dicyclohexylammonium) bis(3-oxapentamethylenethiocarbamoylthioacetate)","Acta Crystallographica Section C","1999","55","3","312","316","10.1107/S0108270198013092","","","0.71073","MoKα","","0.084","0.048","","","","0.116","","","","","","0.994","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008297","20.771","0.001","9.1734","0.0006","22.756","0.002","90","","90","","90","","4335.9","0.5","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","Bis(dicyclohexylammonium) bis(3-oxapentamethylenethiocarbomylthioacetate)","","- C19 H34 N2 O3 S2 -","- C19 H34 N2 O3 S2 -","- C152 H272 N16 O24 S16 -","8","1","SK1237","Ng, Seik Weng; Hook, James M.","Bis[(<i>N</i>,<i>N</i>-3-oxapentamethylenethiocarbamoylthioacetato)triphenyltin] hydrate and bis(dicyclohexylammonium) bis(3-oxapentamethylenethiocarbamoylthioacetate)","Acta Crystallographica Section C","1999","55","3","312","316","10.1107/S0108270198013092","","","0.71073","MoKα","","0.107","0.052","","","","0.131","","","","","","1.012","","","","has coordinates,has Fobs","196234","2020-10-21","18:00:00",""
"2008298","7.506","0.001","29.143","0.002","9.832","0.001","90","","99.04","0.01","90","","2124","0.4","130","","130","","","","","","","","","4","I 1 a 1","I -2ya","9","","","","- C24 H16 N2 O8 -","- C24 H16 N2 O8 -","- C96 H64 N8 O32 -","4","1","SK1240","Meetsma, Auke; Keller, Erik; Feringa, Ben L.","(±)-6,6'-Dinitro-1,1'-binaphthyl 2,2'-diacetate","Acta Crystallographica Section C","1999","55","3","450","452","10.1107/S0108270198013109","","","0.71073","MoKα","","0.0371","0.0321","","","","0.0825","","","","","","1.041","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008299","10.8952","0.0017","9.9647","0.001","16.288","0.004","90","","93.982","0.012","90","","1764.1","0.5","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2'-Biphenol–4,4'-bipyridyl (1/1)","","- C22 H18 N2 O2 -","- C22 H18 N2 O2 -","- C88 H72 N8 O8 -","4","1","SK1245","Lavender, Emma S.; Ferguson, George; Glidewell, Christopher","Self-assembled triple helices in the hydrogen-bonded structure of 2,2'-biphenol–4,4'-bipyridyl (1/1)","Acta Crystallographica Section C","1999","55","3","430","432","10.1107/S0108270198012980","","","0.71073","MolybdenumKα","","0.1111","0.0377","","","","0.1039","","","","","","0.905","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008300","4.0188","0.0003","4.0188","0.0003","9.72","0.001","90","","90","","90","","156.99","0.02","293","2","293","2","","","","","","","","3","P 4/m m m","-P 4 2","123","Potassium tetracopper triselenide","","","- Cu4 K Se3 -","- Cu4 K Se3 -","- Cu4 K Se3 -","1","0.0625","SK1247","Stoll, Petra; Näther, Christian; Jeß, Inke; Bensch, Wolfgang","KCu~4~Se~3~","Acta Crystallographica Section C","1999","55","3","286","288","10.1107/S0108270198014358","","","0.71073","MoKα","","0.028","0.024","","0.062","0.06","","","","1.17","1.186","1.186","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008301","7.716","0.002","8.597","0.002","12.54","0.003","80.19","0.03","74.83","0.03","81.74","0.03","786.8","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H16 Ge I4 N8 -","- C32 H16 Ge I4 N8 -","- C32 H16 Ge I4 N8 -","1","0.5","SK1249","Jan Janczak; Mariola Razik; Ryszard Kubiak","Diiodo[phthalocyaninato(2‒)]germanium(IV) diiodine","Acta Crystallographica Section C","1999","55","3","359","361","10.1107/S0108270198015716","","","0.71073","MoKα","","0.091","0.037","","","","0.077","","","","","","0.925","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008302","7.941","0.003","17.481","0.002","14.511","0.003","90","","90","","90","","2014.4","0.9","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","[(3R,4S,4aR,10aS)-5,10-diacetyl-3,4,4a,5,6,7,10a,10-octahydro-8-methoxy-6-oxo -2H-pyrano[3,2g]pteridin]-3,4-diyl diacetate","","- C18 H22 N4 O9 -","- C18 H22 N4 O9 -","- C72 H88 N16 O36 -","4","1","SK1253","Low, John N.; M. Dolores López; M. Luisa Quijano; Sánchez, Adolfo; Nogueras, Manuel","(3<i>R</i>,4<i>S</i>,4a<i>R</i>,10a<i>S</i>)-5,10-Diacetyl-3,4,4a,5,6,7,10,10a-octahydro-8-methoxy-6-oxo-2<i>H</i>-pyrano[3,2-<i>g</i>]pteridin-3,4-diyl diacetate","Acta Crystallographica Section C","1999","55","3","452","454","10.1107/S0108270198014371","","","0.71073","MoKα","","0.054","0.039","","","","0.084","","","","","","0.837","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008303","36.925","0.004","36.925","0.004","8.256","0.002","90","","90","","120","","9749","3","273","2","273","2","","","","","","","","6","R -3 :H","-R 3","148","","hexanoyloxymethyl 4-chloro-N-furfuryl-5-sulfamoylanthranilate","","- C19 H23 Cl N2 O7 S -","- C19 H23 Cl N2 O7 S -","- C342 H414 Cl18 N36 O126 S18 -","18","1","SX1070","Alvaro W. Mombrú; Raúl A. Mariezcurrena; Leopoldo Suescun; Helena Pardo; Eduardo Manta; Carolina Prandi","Two absorption furosemide prodrugs","Acta Crystallographica Section C","1999","55","3","413","416","10.1107/S010827019801213X","","","0.71069","MoKα","","0.1034","0.0561","","","","0.1994","","","","","","1.039","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008304","7.836","0.002","17.605","0.01","15.4951","0.0018","90","","94.026","0.016","90","","2132.3","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","benzoyloxymethyl 4-chloro-N-furfuryl-5-sulfamoylanthranilate","","- C20 H17 Cl N2 O7 S -","- C20 H17 Cl N2 O7 S -","- C80 H68 Cl4 N8 O28 S4 -","4","1","SX1070","Alvaro W. Mombrú; Raúl A. Mariezcurrena; Leopoldo Suescun; Helena Pardo; Eduardo Manta; Carolina Prandi","Two absorption furosemide prodrugs","Acta Crystallographica Section C","1999","55","3","413","416","10.1107/S010827019801213X","","","0.7107","MoKα","","0.0931","0.0633","","","","0.2155","","","","","","1.041","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008305","16.517","0.003","23.533","0.005","5.1124","0.0006","90","","90","","90","","1987.2","0.6","293","2","290","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","d[gamma]afg","Retro-enantiomeric [gammaCONH]-achatin-I, H-D-Asp-[γCONH]-D-Ala-L-Phe-Gly-OH","","- C18 H24 N4 O7 -","- C18 H24 N4 O7 -","- C72 H96 N16 O28 -","4","1","SX1074","Doi, Mitsunobu; Asano, Akiko; Ishida, Toshimasa; Minakata, Hiroyuki; Nomoto, Kyosuke","A β-turn retro-enantiomeric analogue of achatin-I, H‒<small>D</small>-Asp-[γCONH]-<small>D</small>-Ala‒<small>L</small>-Phe‒Gly‒OH","Acta Crystallographica Section C","1999","55","3","422","424","10.1107/S0108270198012141","","","1.5418","CuKα","","0.061","0.045","","","","0.143","","","","","","1.134","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008306","9.8951","0.0004","16.243","0.0007","25.0787","0.001","90","","90.444","0.001","90","","4030.7","0.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","bis(μ-benzenethiolato-S:S)hexacarbonyl-μ-iodo-dimolybdenum(I)(Mo—Mo)","","- C34 H46 I Mo2 N O6 S2 -","- C34 H46 I Mo2 N O6 S2 -","- C136 H184 I4 Mo8 N4 O24 S8 -","4","1","TA1215","Pan, Guohua; Zhuang, Botao; Chen, Jiutong","A mixed tribridging dimolybdenum(I) compound, bis(μ-benzenethiolato-<i>S</i>:<i>S</i>)hexacarbonyl-μ-iodo-dimolybdenum(I)(<i>Mo</i>—<i>Mo</i>)","Acta Crystallographica Section C","1999","55","3","297","298","10.1107/S0108270198012025","","","0.71073","MoKα","","0.09","0.051","","0.089","0.078","","","","1.054","1.124","1.124","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008307","14.4791","0.0002","12.9825","0.0002","24.4658","0.0003","90","","104.79","0.001","90","","4446.58","0.11","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","tetrabutylammonium bis(μ-benzenethiolato-S:S)hexacarbonyl-μ-pivalate-O:O'-dimolybdenum(Mo—Mo)","","- C39 H55 Mo2 N O8 S2 -","- C39 H55 Mo2 N O8 S2 -","- C156 H220 Mo8 N4 O32 S8 -","4","1","TA1216","Pan, Guohua; Zhuang, Botao; Chen, Jiutong","A dimolybdenum(I) carbonyl compound with thiolate and carboxylate bridges: tetrabutylammonium bis(μ-benzenethiolato-<i>S</i>:<i>S</i>)hexacarbonyl-μ-pivalate-<i>O</i>:<i>O</i>'-dimolybdenum(<i>Mo</i>—<i>Mo</i>)","Acta Crystallographica Section C","1999","55","3","298","300","10.1107/S0108270198012037","","","0.71073","MoKα","","0.082","0.052","","0.135","0.117","","","","1.011","1.044","1.044","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008308","12.355","0.003","11.645","0.003","12.75","0.003","90","","117.407","0.016","90","","1628.5","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N~1~,N~4~-Diformyl-t-5-methyl-r-2,t-3-diphenylpiperazine","","- C19 H20 N2 O2 -","- C19 H20 N2 O2 -","- C76 H80 N8 O8 -","4","1","VJ1091","Laavanya. P; Panchanatheswaran. K; Murugadoss. R; Jeyaraman. R","1,4-Diformyl-<i>t</i>-5-methyl-<i>r</i>-2,<i>t</i>-3-diphenylpiperazine-1,4-dicarbaldehyde","Acta Crystallographica Section C","1999","55","3","410","411","10.1107/S0108270198011779","","","1.5418","CuKα","","0.0748","0.0627","","","","0.2266","","","","","","1.09","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008309","6.698","0.001","7.171","0.001","30.604","0.005","90","","90","","90","","1470","0.4","293","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H15 N O4 S -","- C16 H15 N O4 S -","- C64 H60 N4 O16 S4 -","4","1","BK1392","Kumaradhas, P.; Kalyanam, N.; Ravikumar, K.; Chandra Mohan, K.; Sridhar, M.A.; Shashidhara Prasad, J.; Nirmala, K.A.","(+)-<i>cis</i>-3-Hydroxy-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine 1-oxide","Acta Crystallographica Section C","1999","55","4","614","615","10.1107/S0108270198012827","","","0.71073","MoKα","","","0.0438","","","0.0897","","","","","1.12","1.12","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008310","13.657","0.001","14.464","0.001","11.014","0.001","90","","112.104","0.003","90","","2015.7","0.3","293","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-N,N-dimethylamino-6-hydroxy-1,4-naphthoquinone","","- C12 H11 N O3 -","- C12 H11 N O3 -","- C96 H88 N8 O24 -","8","2","BK1411","Doriguetto, Antônio C.; Santos, Cátia A.; Raslan, Délio S.; Fernandes, Nelson G.","2-(<i>N</i>,<i>N</i>-Dimethylamino)-6-hydroxy-1,4-naphthoquinone","Acta Crystallographica Section C","1999","55","4","639","642","10.1107/S0108270198013213","","","0.71073","MoKα","","0.0949","0.054","","0.1534","","0.0958","","","0.919","1.016","1.016","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008311","22.997","0.005","8.069","0.002","20.001","0.004","90","","125","0.03","90","","3040.2","1.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1-chloro-2,4-dimorpholino-5-nitrobenzene","","- C14 H18 Cl N3 O4 -","- C14 H18 Cl N3 O4 -","- C112 H144 Cl8 N24 O32 -","8","1","BK1415","Zucco, César; Neves, Ademir; Vencato, Ivo; Szpoganicz, Bruno; Bertoldi, Fabiano C.","1-Chloro-2,4-dimorpholino-5-nitrobenzene","Acta Crystallographica Section C","1999","55","4","654","656","10.1107/S0108270198014516","","","0.71073","MoKα","","0.066","0.042","","","","0.124","","","","","","1.105","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008312","10.009","0.0013","15.472","0.002","16.216","0.002","90","","90","","90","","2511.2","0.6","160","3","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","2-(Diethylaminomethyl)phenol Nitrate","diethyl(2-hydroxybenzyl)ammonium nitrate","","- C11 H18 N2 O4 -","- C11 H18 N2 O4 -","- C88 H144 N16 O32 -","8","1","BK1426","Bouayad, Abdelouahed; Dartiguenave, Michèle; Lamandé, Lydia; El Ghadraoui, El Houssine; Beauchamp, André L.","Nitrate salt of protonated 2-(diethylaminomethyl)phenol","Acta Crystallographica Section C","1999","55","4","681","683","10.1107/S0108270198014218","","","0.71073","MoKα","","0.06","0.039","","0.087","","0.082","","","1.042","","","1.209","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008313","13.855","0.004","21.573","0.006","13.163","0.004","90","","90","","90","","3934","2","295","2","295","2","","","","","","","","6","C c c 2","C 2 -2c","37","","μ-Oxo-bis-[bis-(2,2'-bi(1H-imidazole-N^3^))-oxo-rhenium(V)]tetrachloride hexahydrate, [{ReO(C~6~H~4~N~2~)~2~}~2~O]Cl~4~^.^6H~2~O.","","- C24 H36 Cl4 N16 O9 Re2 -","- C24 H24 Cl4 N16 O9 Re2 -","- C96 H96 Cl16 N64 O36 Re8 -","4","0.5","BK1428","Bélanger, Suzanne; Beauchamp, André L.","μ-Oxo-bis{bis[2,2'-bi(1<i>H</i>-imidazole-<i>N</i>^3^)]oxorhenium(V)} tetrachloride hexahydrate","Acta Crystallographica Section C","1999","55","4","517","521","10.1107/S010827019801511X","","","1.54056","CuKα","","0.051","0.03","","0.086","0.075","","","","0.6","0.68","0.68","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008314","7.5766","0.0006","9.6207","0.0007","11.2537","0.0009","89.227","0.001","85.764","0.001","82.531","0.001","811.12","0.11","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","8-Hydroxy-1,2,3-trimethoxybenz[a]anthracene-7,12-dione","","- C21 H16 O6 -","- C21 H16 O6 -","- C42 H32 O12 -","2","1","BK1433","Ilia A. Guzei; Alex Melekhov; George A. Kraus","A new strained angularly fused ring system: 8-hydroxy-1,2,3-trimethoxybenz[<i>a</i>]anthracene-7,12-dione","Acta Crystallographica Section C","1999","55","4","620","622","10.1107/S0108270198012840","","","0.71073","MoKα","","0.063","0.053","","","","0.163","","","","","","1.05","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008315","8.8166","0.0006","9.9326","0.0006","9.9764","0.0006","76.875","0.002","76.582","0.001","74.331","0.001","805.52","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5,10-Dimethoxy-1,4-methano-1,4,4a,11a-tetrahydrobenzo[b]fluoren-11-one-oxime","","- C20 H19 N O3 -","- C20 H19 N O3 -","- C40 H38 N2 O6 -","2","1","BK1435","Kandasamy Chinnakali; Hoong-Kun Fun; Dipakranjan Mal; Nirmal Kumar Hazra; Sujit Kumar Ghorai; Gur Dayal Nigam","5,10-Dimethoxy-1,4-methano-1,4,4a,11a-tetrahydrobenzo[<i>b</i>]fluoren-11-one oxime","Acta Crystallographica Section C","1999","55","4","585","586","10.1107/S0108270198015017","","","0.71073","MoKα","","0.0862","0.0576","","","","0.1714","","","","","","1.017","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008316","5.8512","0.0002","13.041","0.0006","14.8412","0.0007","90","","90","","90","","1132.47","0.08","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","4-imino(dimethylamino)benzenesulfonic acid","","- C9 H14 N2 O4 S -","- C9 H14 N2 O4 S -","- C36 H56 N8 O16 S4 -","4","1","BK1436","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","A Schiff base formed from sulfanilic acid and dimethylformamide","Acta Crystallographica Section C","1999","55","4","697","698","10.1107/S0108270198016060","","","0.71073","MoKα","","0.0465","0.0343","","","","0.0818","","","","","","1.129","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008317","12.014","0.006","9.8","0.002","16.068","0.003","90","","93.8","0.03","90","","1887.6","1.1","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1-(2-deoxy-α-L-erythro-pentopyranosyl) 1-(S),2-(S), 4-triazolidine-3,5-dione","","- C24 H24 S -","- C24 H24 S -","- C96 H96 S4 -","4","1","BK1440","Meyers, Cal Y.; Hou, Yuqing; Robinson, Paul D.","<i>ap</i>-9-(<i>o-tert</i>-Butylphenyl)-9-methylthiofluorene, the first isolated <i>ap</i> rotamer of a 9-substituted 9-(<i>o-tert</i>-butylphenyl)fluorene","Acta Crystallographica Section C","1999","55","4","626","628","10.1107/S010827019801453X","","","0.71069","MoKα","","0.069","0.036","","","","0.102","","","","","","1","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008318","10.8956","0.0009","8.2532","0.0005","20.205","0.0012","90","","98.411","0.006","90","","1797.4","0.2","295","","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","1,2-bis(2-pyridinooxyethoxy)benzene","","","- C20 H20 N2 O4 -","- C20 H20 N2 O4 -","- C80 H80 N8 O16 -","4","1","BK1447","Bryan, Jeffrey C.; Delmau, Laetitia H.; Sachleben, Richard A.; Moyer, Bruce A.","1,2-Bis[2-(pyridin-2-yloxy)ethoxy]benzene","Acta Crystallographica Section C","1999","55","4","618","620","10.1107/S0108270198016722","","","0.71073","MoKα","","0.074","0.036","","","","0.094","","","","","","1.01","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008319","10.203","0.002","13.047","0.004","15.99","0.005","68.54","0.03","85.85","0.02","76.48","0.02","1925.9","1","170","2","170","2","","","","","","","","7","P -1","-P 1","2","","bis-triphenylphosphane silver 1-phenyltetrazolethiolate","","- C44 H39 Ag N4 O P2 S -","- C44 H39 Ag N4 O P2 S -","- C88 H78 Ag2 N8 O2 P4 S2 -","2","1","BM1275","Molloy, Kieran C.; Mahon, Mary F.; Barret, Marie C.","(1-Phenyl-1<i>H</i>-1,2,3,4-tetrazole-5-thiolato-<i>S</i>)bis(triphenylphosphine)silver(I) methanol solvate","Acta Crystallographica Section C","1999","55","4","555","557","10.1107/S0108270199000311","","","0.71069","MoKα","","0.049","0.029","","0.071","0.065","","","","1.015","1.088","1.088","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008320","10.0761","0.0012","10.6819","0.0013","10.9819","0.0012","63.847","0.002","72.015","0.003","79.359","0.002","1007.5","0.2","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C42 H46 Cu3 N4 O10 -","- C42 H46 Cu3 N4 O10 -","- C42 H46 Cu3 N4 O10 -","1","0.5","BM1276","Atakol, Orhan; Arici, Cengiz; Ercan, Filiz; Ülkü, Dinçer","Bis{(μ-acetato)[μ-bis(salicylidene)-1,3-propanediaminato]copper(II)}copper(II) dioxane solvate","Acta Crystallographica Section C","1999","55","4","511","513","10.1107/S0108270198014334","","","0.71073","MoKα","","","0.044","","","0.046","","","","","0.96","0.96","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008321","6.9693","0.0002","9.5268","0.0003","11.1032","0.0004","97.595","0.001","104.295","0.0005","95.327","0.002","702.04","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-Phenyl 5-(2-chlorophenyl) 1,2,4-triazole-3-thione","","- C14 H10 Cl N3 S -","- C14 H10 Cl N3 S -","- C28 H20 Cl2 N6 S2 -","2","1","BM1285","Kumaran,D.; Ponnuswamy,M.N.; Jayanthi,G.; Ramakrishnan, V.T.; Chinnakali, K.; Fun, H.-K.","3-(2-Chlorophenyl)-4-phenyl-1,2,4-triazole-5-thione","Acta Crystallographica Section C","1999","55","4","581","582","10.1107/S0108270198013808","","","0.71073","MoKα","","0.0691","0.0478","","0.1288","0.1126","","","","1.043","1.054","1.054","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008322","8.778","0.002","8.781","0.001","10.998","0.002","85.52","0.01","85.42","0.02","78.57","0.01","826.6","0.3","203","2","203","2","","","","","","","","3","P -1","-P 1","2","4,4'‒Bipyridyl","4,4'‒Bipyridinyl","","- C20 H16 N4 -","- C10 H8 N2 -","- C40 H32 N8 -","4","2","BM1287","Boag, Neil M.; Coward, Kathleen M.; Jones, Anthony C; Pemble, Martyn E.; Thompson, J. Robin","4,4'-Bipyridyl at 203K","Acta Crystallographica Section C","1999","55","4","672","674","10.1107/S0108270198016333","","","0.71073","MoKα","","0.0921","0.0514","","0.1341","","0.1341","","","1.01","","","1.01","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008323","8.915","0.004","10.623","0.004","17.243","0.005","90","","90","","90","","1633","1.1","190","2","190","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Diosbulbin-B","","","- C19 H20 O6 -","- C19 H20 O6 -","- C76 H80 O24 -","4","1","BM1291","Singh, Amarjit; Parmar, Virinder S.; Errington, William; Howarth, Oliver W.; Lawrie, Stephen","Diosbulbin B, a constituent of <i>Dioscorea pentaphylla</i>","Acta Crystallographica Section C","1999","55","4","559","561","10.1107/S0108270198014978","","","0.71073","MoKα","","0.064","0.044","","","","0.097","","","","","","1.106","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008324","9.022","0.003","15.576","0.002","13.489","0.003","90","","103.52","0.02","90","","1843","0.8","173","1","173","1","","","","","","","","3","P 1 21 1","P 2yb","4","","ethyl-5,7,8-tri-O-acetyl-2-deoxy-α-D-erythro-L-arabino-oct-3-ulofuranosid- 1,4-lactone","","- C16 H22 O10 -","- C16 H22 O10 -","- C64 H88 O40 -","4","2","BM1305","Linden, Anthony; Lee, C. Kuan; Li, Xiaofeng","A fused furanoside-1,4-lactone at 173K","Acta Crystallographica Section C","1999","55","4","642","644","10.1107/S0108270198016692","","","0.71073","MoKα","","0.089","0.044","","","","0.114","","","","","","1.023","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008325","18.5888","0.0012","8.1378","0.001","28.964","0.002","90","","90","","90","","4381.4","0.7","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C14 H34 N2 O11 S2 -","- C14 H34 N2 O11 S2 -","- C112 H272 N16 O88 S16 -","8","1","BM1316","Henschel, Dagmar; Wijaya, Karna; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. CX. Hydroxylammonium di(methanesulfonyl)amidate 1,4,7,10,13,16-hexaoxacyclooctadecane (1/1/1) and 2-aminopyridinium di(methanesulfonyl)amidate 1,4,7,10,13,16-hexaoxacyclooctadecane (1/1/1)","Acta Crystallographica Section C","1999","55","4","664","668","10.1107/S0108270199001274","","","0.71073","MoKα","","0.058","0.033","","","","0.074","","","","","","0.883","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008326","11.67","0.003","15.623","0.005","14.528","0.004","90","","108.74","0.03","90","","2508.3","1.3","143","2","143","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-Aminopyridinium Di(methanesulfonyl)amidate 1,4,7,1O,13,16-Hexaoxacyclooctadecane (1/1/1)","","- C19 H37 N3 O10 S2 -","- C19 H37 N3 O10 S2 -","- C76 H148 N12 O40 S8 -","4","1","BM1316","Henschel, Dagmar; Wijaya, Karna; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. CX. Hydroxylammonium di(methanesulfonyl)amidate 1,4,7,10,13,16-hexaoxacyclooctadecane (1/1/1) and 2-aminopyridinium di(methanesulfonyl)amidate 1,4,7,10,13,16-hexaoxacyclooctadecane (1/1/1)","Acta Crystallographica Section C","1999","55","4","664","668","10.1107/S0108270199001274","","","0.71073","MoKα","","0.049","0.038","","","","0.094","","","","","","1.061","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008327","9.782","0.002","10.283","0.002","10.497","0.002","90","","90","","90","","1055.9","0.4","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H13 Mn N O7 -","- C6 H13 Mn N O7 -","- C24 H52 Mn4 N4 O28 -","4","1","BR1217","Liu, Ye-Qi; Wei, Yong-Ge; Liu, Qun; Zhang, Shi-Wei; Shao, Mei-Cheng","A one-dimensional coordination polymer of manganese(II) with <i>N</i>-(2-hydroxyethyl)iminodiacetate: {[Mn(Hheidi)(H~2~O)]^.^H~2~O}~<i>n~</i>","Acta Crystallographica Section C","1999","55","4","534","536","10.1107/S0108270198016084","","","0.71073","MoKα","","0.044","0.038","","0.106","0.094","","","","1.031","1.035","1.035","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008328","5.37","0.002","8.268","0.004","12.693","0.003","90","","90.37","0.02","90","","563.5","0.4","291","2","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Strontium iron II diphosphate","","","- Fe O7 P2 Sr -","- Fe O7 P2 Sr -","- Fe4 O28 P8 Sr4 -","4","1","BR1225","Le Meins, Jean-Marc; Courbion, Georges","SrFeP~2~O~7~, a new homologue in the <i>AM</i>P~2~O~7~ series","Acta Crystallographica Section C","1999","55","4","481","483","10.1107/S0108270198017375","","","0.71073","MoKα","","0.054","0.033","","0.09","0.084","","","","1.018","1.082","1.082","","","","","has coordinates","191888","2020-10-21","18:00:00",""
"2008329","10.2357","0.0014","10.2357","0.0014","3.5425","0.0007","90","","90","","90","","371.15","0.1","293","2","293","2","","","","","","","","2","I 4/m","-I 4","87","","","","- Sb4 Ta5 -","- Sb4 Ta5 -","- Sb8 Ta10 -","2","0.125","BR1226","Kang, Sung Kwon; Miller, Gordon J.","Ta~5~Sb~4~","Acta Crystallographica Section C","1999","55","4","483","485","10.1107/S0108270198015881","","","0.71073","MoKα","","0.071","0.029","","","","0.065","","","","","","1.062","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008330","8.9928","0.0001","11.2809","0.0002","5.48116","0.00009","90","","90","","90","","556.05","0.02","293","2","293","2","","","","","","","","3","C m c 21","C 2c -2","36","gadolinium gallium oxide","","","- Ga Gd3 O6 -","- Ga Gd3 O6 -","- Ga4 Gd12 O24 -","4","0.5","BR1230","Yamane, Hisanori; Sakamoto, Takashi; Kubota, Shun-ichi; Shimada, Masahiko","Gd~3~GaO~6~ by X-ray powder diffraction","Acta Crystallographica Section C","1999","55","4","479","481","10.1107/S0108270198016096","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008331","13.8627","0.0003","12.6533","0.0003","16.6278","0.0004","90","","111.697","0.001","90","","2710.02","0.11","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(C4 H12 N)4 Ge9 H12 O26 14(H2 O)","","- C16 H88 Ge9 N4 O40 -","- C16 H88 Ge9 N4 O40 -","- C32 H176 Ge18 N8 O80 -","2","0.5","BR1237","Tripathi, Akhilesh; Young Jr., Victor G.; Johnson, Geoffrey M.; Cahill, Christopher L.; Parise, John B.","[N(CH~3~)~4~]~4~H~12~Ge~9~O~26~^.^14H~2~O","Acta Crystallographica Section C","1999","55","4","496","499","10.1107/S0108270198014838","","","0.71073","MoKα","","0.0766","0.0483","","0.1096","","0.0998","","","","1.149","1.149","1.08","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2008332","20.5254","0.0013","15.1311","0.001","6.1276","0.0004","90","","90","","90","","1903.1","0.2","180","2","180","2","","","","","","","","5","P n a 21","P 2c -2n","33","","3-Cyano-5-(4-methoxybenzyl)-6-(4-methoxyphenyl)-4-methylthio-2H-pyran-2-one","","- C22 H19 N O4 S -","- C22 H19 N O4 S -","- C88 H76 N4 O16 S4 -","4","1","CF1285","Kumar, Rajesh; Parmar, Virinder S.; Errington, William","3-Cyano-5-(4-methoxybenzyl)-6-(4-methoxyphenyl)-4-methylthio-2<i>H</i>-pyran-2-one","Acta Crystallographica Section C","1999","55","4","561","563","10.1107/S0108270198015121","","","0.71073","MoKα","","0.067","0.047","","","","0.094","","","","","","1.049","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008333","10.48","0.002","11.949","0.002","15.005","0.003","90","","90","","90","","1879","0.6","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","4–(N–Methylnitramino)-1–methylpyridinium bromide","","- C7 H10 Br N3 O2 -","- C7 H10 Br N3 O2 -","- C56 H80 Br8 N24 O16 -","8","1","CF1290","Zaleski, Jacek; Daszkiewicz, Zdzisław; Kyzioł, Janusz","1-Methyl-4-(<i>N</i>-methylnitramino)pyridinium bromide","Acta Crystallographica Section C","1999","55","4","691","693","10.1107/S0108270198014656","","","0.71073","MoKα","","0.0664","0.0293","","","","0.0823","","","","","","1","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008334","13.003","0.001","8.8836","0.0006","20.196","0.002","90","","95.065","0.008","90","","2323.8","0.3","300","2","300","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(N-phenyl benzoylhydroxamate-O,O')(acetylacetone benzoylhydrazonato-O,N,O')- oxo-vanadium(V)","","- C25 H22 N3 O5 V -","- C25 H22 N3 O5 V -","- C100 H88 N12 O20 V4 -","4","1","DA1036","Chen, Wei; Gao, Shan; Liu, Shi-Xiong","Monooxovanadium(V) complexes with bidentate <i>N</i>-phenylbenzohydroxamate","Acta Crystallographica Section C","1999","55","4","531","533","10.1107/S0108270198014875","","","0.71073","MoKα","","0.104","0.056","","0.124","0.109","","","","0.976","1.158","1.158","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008335","9.72","0.001","18.274","0.002","12.542","0.001","90","","104.868","0.009","90","","2153.2","0.4","300","2","300","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(N-phenyl benzoylhydroxamate-O,O')(N-salicylidene-L-alaninato-O,N,O')- oxo-vanadium(V)","","- C23 H19 N2 O6 V -","- C23 H19 N2 O6 V -","- C92 H76 N8 O24 V4 -","4","2","DA1036","Chen, Wei; Gao, Shan; Liu, Shi-Xiong","Monooxovanadium(V) complexes with bidentate <i>N</i>-phenylbenzohydroxamate","Acta Crystallographica Section C","1999","55","4","531","533","10.1107/S0108270198014875","","","0.71073","MoKα","","0.096","0.062","","0.145","0.129","","","","0.97","1.079","1.079","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008336","9.125","0.0007","12.769","0.001","16.428","0.002","90","","98.738","0.009","90","","1891.9","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Triphenylphosphoniopropionate dihydrate","","- C21 H23 O4 P -","- C21 H23 O4 P -","- C84 H92 O16 P4 -","4","1","DA1039","Ng, Seik Weng","3-Triphenylphosphoniopropionate dihydrate","Acta Crystallographica Section C","1999","55","4","646","648","10.1107/S0108270198014887","","","0.71073","MoKα","","0.1303","0.0729","","","","0.2145","","","","","","1.019","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008337","15.64","0.004","22.765","0.006","5.681","0.001","90","","92.663","0.005","90","","2020.5","0.8","295","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","N,N-Bis(p-nitrophenylsulfonyl)cyclohexylamine","","- C18 H19 N3 O8 S2 -","- C18 H19 N3 O8 S2 -","- C72 H76 N12 O32 S8 -","4","1","DA1049","Brunzelle, Joseph S.; Curtis-Palmer, Veronica A.; Pavkovic, Stephen F.","<i>N</i>,<i>N</i>-Bis(<i>p</i>-nitrophenylsulfonyl)cyclohexylamine","Acta Crystallographica Section C","1999","55","4","624","626","10.1107/S0108270198017612","","","0.7107","MoKα","","0.0639","0.039","","0.1043","0.0969","","","","1.004","1.132","1.132","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008338","8.984","0.003","11.912","0.004","9.548","0.003","90","","108.34","0.03","90","","969.9","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","trans-(Diaqua-O,O')(C-meso-1,5,8,12-tetramethyl-1,4,8,11- tetraazacyclotetradecane-N,N',N'',N''')Nickel(II) Chloride","","- C14 H36 Cl2 N4 Ni O2 -","- C14 H36 Cl2 N4 Ni O2 -","- C28 H72 Cl4 N8 Ni2 O4 -","2","0.5","DA1051","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Liao, Fen-Ling; Chung, Chung-Sun","<i>trans</i>-Diaqua(<i>C</i>-<i>meso</i>-1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>)nickel(II) dichloride","Acta Crystallographica Section C","1999","55","4","543","545","10.1107/S0108270198017594","","","0.71073","MoKα","","0.0506","0.045","","","","0.1436","","","","","","1.132","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008339","11.503","0.004","4.975","0.002","13.304","0.003","90","","99.86","0.02","90","","750.1","0.4","296","","296","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N-propylimidazolidinetrion","","","- C6 H8 N2 O3 -","- C6 H8 N2 O3 -","- C24 H32 N8 O12 -","4","1","DA1052","Yoshihara, Ryouko; Hosomi, Hiroyuki; Aoyama, Hiromu; Ohba, Shigeru","<i>N</i>-Propylimidazolidinetrione and <i>N</i>-methyl-<i>N</i>'-phenylethylimidazolidinetrione","Acta Crystallographica Section C","1999","55","4","594","596","10.1107/S0108270198017600","","","0.71073","MoKα","","0.106","0.047","","","","0.087","","","","","","1.07","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008340","49.87","0.02","5.406","0.003","8.471","0.003","90","","88.66","0.03","90","","2283.1","1.8","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","N-phenylethyl-N-methylimidazolidinetrione","","","- C12 H12 N2 O3 -","- C12 H12 N2 O3 -","- C96 H96 N16 O24 -","8","1","DA1052","Yoshihara, Ryouko; Hosomi, Hiroyuki; Aoyama, Hiromu; Ohba, Shigeru","<i>N</i>-Propylimidazolidinetrione and <i>N</i>-methyl-<i>N</i>'-phenylethylimidazolidinetrione","Acta Crystallographica Section C","1999","55","4","594","596","10.1107/S0108270198017600","","","0.71073","MoKα","","0.174","0.052","","","","0.116","","","","","","1.1","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008341","26.9834","0.0006","16.8216","0.0004","28.1","0.0004","90","","90.164","0.001","90","","12754.6","0.5","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","dodecamolybodtetrakis(p‒cyanophenyl)arsonate tetrabutylammonium salt","","","- C92 H160 As4 Mo12 N8 O46 -","- C92 H160 As4 Mo12 N8 O46 -","- C368 H640 As16 Mo48 N32 O184 -","4","0.5","DA1056","Johnson, Bret J.S.; Buss, Carrie E.; Young Jr., Victor G.; Stein, Andreas","Tetrakis(tetrabutylammonium) tetrakis[(<i>p</i>-cyanophenyl)trioxoarsonato]tetratriacontaoxododecamolybdate(4 ‒)","Acta Crystallographica Section C","1999","55","4","549","551","10.1107/S0108270198017636","","","0.71073","MoKα","","0.0833","0.0463","","0.1156","0.1024","","","","0.992","1.076","1.076","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008342","18.178","0.003","9.233","0.004","30.904","0.007","90","","101.3","0.01","90","","5086","3","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","Chloro(diethyl dithiophosphato-S,S')(triphenylphosphine-P)palladium(II)","","- C22 H25 Cl O2 P2 Pd S2 -","- C22 H25 Cl O2 P2 Pd S2 -","- C176 H200 Cl8 O16 P16 Pd8 S16 -","8","2","DE1097","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Tung, Shu-Fang; Narayan, Sanjay; Jain, Vimal K.","Chloro(diethyl dithiophosphato-<i>S</i>,<i>S</i>')(triphenylphosphine-<i>P</i>)palladium(II)","Acta Crystallographica Section C","1999","55","4","541","543","10.1107/S0108270198014905","","","0.71073","MoKα","","0.081","0.053","","0.217","0.159","","","","1.07","0.902","0.902","","","","","has coordinates","198633","2020-10-21","18:00:00",""
"2008343","13.9841","0.0002","16.8118","0.0002","16.8033","0.0002","90","","93.858","0.001","90","","3941.47","0.09","203","2","203","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C28 H22 Cl9 D3 N2 O6 P2 Pd -","- C28 H25 Cl9 N2 O6 P2 Pd -","- C112 H100 Cl36 N8 O24 P8 Pd4 -","4","1","FG1483","Rath, Nigam P.; Stockland Jr, Robert A.; Anderson, Gordon K.","[Bis(diphenylphosphino)methane]dinitratopalladium(II) tris(deuteriochloroform) solvate","Acta Crystallographica Section C","1999","55","4","494","496","10.1107/S0108270198016345","","","0.71073","MoKα","","0.047","0.04","","","","0.109","","","","","","1.034","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2008344","7.791","0.001","11.198","0.001","16.986","0.002","90","","90","","90","","1481.9","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Santonic Acid","(-)-octahydro-α,3a,5-trimethyl-6,8-dioxo-1,4-methano- 1H-indene-1-acetic acid","","- C15 H20 O4 -","- C15 H20 O4 -","- C60 H80 O16 -","4","1","FG1516","Brunskill, Andrew P. J.; Thompson, Hugh W.; Lalancette, Roger A.","Santonic acid: catemeric hydrogen bonding in a γ,ε-diketo carboxylic acid","Acta Crystallographica Section C","1999","55","4","566","568","10.1107/S0108270198014231","","","0.71073","MoKα","","0.077","0.053","","0.135","0.12","","","","1.08","1.12","1.12","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008345","10.3179","0.0001","13.6397","0.0001","27.183","0.0005","90","","90","","90","","3825.55","0.08","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-Leucyl-L-leucine 2-methyl-1-propanol (1:1)","","- C16 H34 N2 O4 -","- C16 H34 N2 O4 -","- C128 H272 N16 O32 -","8","2","FG1518","Görbitz, Carl Henrik","<small>L</small>-Leucyl-<small>L</small>-leucine 2-methyl-1-propanol solvate","Acta Crystallographica Section C","1999","55","4","670","672","10.1107/S0108270198016369","","","0.71073","MoKα","","0.077","0.059","","0.145","0.135","","","","1.076","1.104","1.104","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008346","9.975","0.002","9.975","0.002","10.418","0.002","90","","90","","90","","1036.6","0.4","293","2","293","2","","","","","","","","5","P 41","P 4w","76","FF-arabino-uridine","1-(2'-fluoro-2'-deoxy-β-D-arabinofuranosyl) -5-fluoro-2,4(1H,3H)-pyrimidinedione","","- C9 H10 F2 N2 O5 -","- C9 H10 F2 N2 O5 -","- C36 H40 F8 N8 O20 -","4","1","FG1521","Hempel, Andrew; Camerman, Norman; Grierson, John; Mastropaolo, Donald; Camerman, Arthur","FF-β-<small>D</small>-Arabinofuranosyluracil","Acta Crystallographica Section C","1999","55","4","632","633","10.1107/S0108270198015455","","","1.54178","CuKα","","0.029","0.0284","","","","0.0917","","","","","","0.865","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008347","9.305","0.002","12.78","0.003","10.444","0.003","90","","101.79","0.02","90","","1215.8","0.5","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","(+/-)-10a-Carboxy-1,9,10,10a-tetrahydrophenanthren-3(2H)-one","(+/-)-10a-Carboxy-1,9,10,10a-tetrahydrophenanthren-3(2H)-one","","- C15 H14 O3 -","- C15 H14 O3 -","- C60 H56 O12 -","4","1","FG1524","Miller, Alan J.; Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.","(±)-3-Oxo-1,2,3,9,10,10a-hexahydrophenanthrene-10a-carboxylic acid: catemeric hydrogen bonding in a δ-keto acid","Acta Crystallographica Section C","1999","55","4","563","566","10.1107/S0108270198017417","","","0.71073","MoKα","","0.123","0.059","","0.138","0.109","","","","1.04","1.16","1.16","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008348","8.945","0.001","10.318","0.001","10.127","0.001","90","","96.4","0.01","90","","928.84","0.17","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(±)-1-Indanone-2-acetic Acid","(+\-)-2-(carboxymethyl)-2,3-dihydro-1H-indene-1-one","","- C11 H10 O3 -","- C11 H10 O3 -","- C44 H40 O12 -","4","1","FG1525","Lalancette, Roger A.; Brunskill, Andrew P. J.; Thompson, Hugh W.","(±)-1-Indanone-2-acetic and -2-propionic acids: catemeric <i>versus</i> dimeric hydrogen bonding in homologous γ- and δ-keto acids","Acta Crystallographica Section C","1999","55","4","568","572","10.1107/S0108270198017405","","","0.71073","MoKα","","0.069","0.043","","","","0.108","","","","","","1.03","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008349","8.093","0.001","8.326","0.001","15.614","0.002","90","","96.2","0.01","90","","1046","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","(±)-1-Indanone-2-propionic Acid","(+\-)-2-(2-carboxyethyl)-2,3-dihydro-1H-inden-1-one","","- C12 H12 O3 -","- C12 H12 O3 -","- C48 H48 O12 -","4","1","FG1525","Lalancette, Roger A.; Brunskill, Andrew P. J.; Thompson, Hugh W.","(±)-1-Indanone-2-acetic and -2-propionic acids: catemeric <i>versus</i> dimeric hydrogen bonding in homologous γ- and δ-keto acids","Acta Crystallographica Section C","1999","55","4","568","572","10.1107/S0108270198017405","","","0.71073","MoKα","","0.074","0.048","","","","0.134","","","","","","1.06","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008350","13.2974","0.0006","7.9474","0.0004","27.3988","0.0014","90","","90","","90","","2895.5","0.2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","3,4-Dihydro-1H-isoquinoline-2-carbamoyl-3-methylimidazolium Iodide","","- C14 H16 I N3 O -","- C14 H16 I N3 O -","- C112 H128 I8 N24 O8 -","8","1","FG1529","Batey, Robert A.; Yoshina-Ishii, Chiaki; Lough, Alan J.","3-Methyl-1-(1,2,3,4-tetrahydroisoquinolin-2-ylcarbonyl)imidazolium iodide","Acta Crystallographica Section C","1999","55","4","615","618","10.1107/S0108270198016473","","","0.71073","MoKα","","0.086","0.041","","","","0.091","","","","","","0.981","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008351","16.38","0.003","6.536","0.002","8.514","0.002","90","","90","","90","","911.5","0.4","296.2","","296.2","","","","","","","","","5","P n m a","-P 2ac 2n","62","2,3-Dicyano-1,4-dihydroxybenzene","","","- C8 H2 Cl2 N2 O2 -","- C8 H2 Cl2 N2 O2 -","- C32 H8 Cl8 N8 O8 -","4","0.5","FG1531","Hoshina, Gakuse; Ohba, Shigeru; Tsuchimoto, Masanobu","Redetermination of 2,3-dichloro-5,6-dicyano-1,4-dihydroxybenzene","Acta Crystallographica Section C","1999","55","4","592","594","10.1107/S0108270198017399","","","0.7107","MoKα","","0.038","0.031","","","","0.058","","","","","","0.991","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008352","9.6682","0.0009","33.169","0.002","9.9711","0.0008","90","","98.82","0.01","90","","3159.8","0.4","293","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H48 O4 Si4 -","- C23 H48 O4 Si4 -","- C92 H192 O16 Si16 -","4","1","FR1141","Moreno-Fuquen, Rodolfo; Jaramillo-Gómez, Luz Marina; Martín-Franco, Jaime","(<i>E</i>)-Dimethyl 4-isopropyl-3-[tris(trimethylsilyl)silylmethylene]-1,1-cyclohexanedicarboxylate","Acta Crystallographica Section C","1999","55","4","630","632","10.1107/S010827019801378X","","","0.71073","MoKα","","0.1005","0.0534","","0.1799","0.135","","","","1.097","1.015","1.015","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008353","9.153","0.001","11.495","0.001","10.277","0.001","90","","93.161","0.004","90","","1079.64","0.18","183","2","183","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Spiro[1-azabicyclo[5.3.0]decane-6,2'(5'H)-furan]-2'10-dione","","- C12 H15 N O3 -","- C12 H14.76 N O3 -","- C48 H59.04 N4 O12 -","4","2","FR1145","Lynch, Vincent M.; Bur, Scott K.; Martin, Stephen F.","Spiro[1-azabicyclo[5.3.0]decane-6,2'(5'<i>H</i>)-furan]-5',10-dione: an example of kryptoracemic crystallization","Acta Crystallographica Section C","1999","55","4","622","624","10.1107/S0108270198012748","","","0.71073","MoKα","","0.0377","0.0337","","0.0824","0.0796","","","","1.006","1.015","1.015","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008354","7.736","0.006","11.69","0.004","14.704","0.005","82.58","0.04","79.28","0.04","88.56","0.04","1295.6","1.2","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","2-Ethylthio-9-methyl-1,4-dihydroacridine-1,4-dione","","- C16 H13 N O2 S -","- C16 H13 N O2 S -","- C64 H52 N4 O8 S4 -","4","2","FR1151","Baker, L.-J.; Clark, George R.; Copp, Brent R.; Hansen, Richard P.; Squire, Christopher J.","2-Ethylthio-9-methyl-1,4-dihydroacridine-1,4-dione and 9-methyl-2-(4-tolylthio)-1,4-dihydroacridine-1,4-dione","Acta Crystallographica Section C","1999","55","4","634","636","10.1107/S0108270198014929","","","0.71073","MoKα","","0.092","0.055","","","","0.154","","","","","","1.031","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008355","9.2792","0.0002","8.7627","0.0002","20.1726","0.0005","90","","98.445","0.001","90","","1622.47","0.07","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","9-methyl-2-(4-tolylthio)-1,4-dihydroacridine-1,4-dione","","- C21 H15 N O2 S -","- C21 H15 N O2 S -","- C84 H60 N4 O8 S4 -","4","1","FR1151","Baker, L.-J.; Clark, George R.; Copp, Brent R.; Hansen, Richard P.; Squire, Christopher J.","2-Ethylthio-9-methyl-1,4-dihydroacridine-1,4-dione and 9-methyl-2-(4-tolylthio)-1,4-dihydroacridine-1,4-dione","Acta Crystallographica Section C","1999","55","4","634","636","10.1107/S0108270198014929","","","0.71073","MoKα","","0.043","0.035","","","","0.094","","","","","","1.042","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008356","5.406","0.004","6.512","0.004","13.118","0.005","74.52","0.03","79.4","0.03","70.3","0.03","416.7","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Copper(II)diaquadi(3,6-dicarboxylatopyridazinium)dihydrate","Copper(II)diaquadi(3,6-dicarboxylatopyridazinium)dihydrate","","- C12 H14 Cu N4 O12 -","- C12 H14 Cu N4 O12 -","- C12 H14 Cu N4 O12 -","1","0.5","FR1155","Sobanska, Sophie; Lagrenee, Michel; Wignacourt, Jean-Pierre; Holt, Elizabeth M.","Diaquabis(pyridazin-1-ium-3,6-dicarboxylato-<i>N</i>^2^,<i>O</i>^3^)copper(II) dihydrate","Acta Crystallographica Section C","1999","55","4","553","555","10.1107/S0108270199000116","","","0.71069","MoKα","","0.038","0.035","","","","0.09","","","","","","1.083","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008357","27.7745","0.0012","7.327","0.0003","11.9575","0.0005","90","","91.126","0.001","90","","2432.93","0.18","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","p-Hydroxybenzaldehyde nicotinoylhydrazone monohydrate","","- C13 H13 N3 O3 -","- C13 H13 N3 O3 -","- C104 H104 N24 O24 -","8","1","FR1156","Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak; Zhong-Lin Lu; Bei-Sheng Kang","<i>p</i>-Hydroxybenzaldehyde nicotinoylhydrazone monohydrate","Acta Crystallographica Section C","1999","55","4","574","576","10.1107/S0108270198015893","","","0.71073","MoKα","","0.1211","0.0639","","","","0.146","","","","","","1.058","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008358","9.9152","0.0006","11.0521","0.0007","13.763","0.001","69.6","0.005","73.969","0.006","65.035","0.005","1266.67","0.16","295","","","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H27 N O6 -","- C28 H27 N O6 -","- C56 H54 N2 O12 -","2","1","FR1166","Özbey, Süheyla; Kendi, Engin; Kılcıgil Ayhan, Gülgün; Ertan, Rahmiye","A flavone 1,4-dihydropyridine calcium antagonist","Acta Crystallographica Section C","1999","55","4","678","680","10.1107/S0108270198014930","","","0.71069","MoKα","","","0.047","","","0.054","","","","","1.05","1.05","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008359","12.5684","0.0009","14.4723","0.001","6.1016","0.0009","90","","90","","90","","1109.8","0.2","150","2","150","2","","","","","","","","2","P n a 21","P 2c -2n","33","Acefluoranthylene","Cyclopenta[cd]fluoranthene","","- C18 H10 -","- C18 H10 -","- C72 H40 -","4","1","GD1006","Lutz, Martin; Spek, Anthony L.; Sarobe, Martin; Jenneskens, Leonardus W.","Acefluoranthylene","Acta Crystallographica Section C","1999","55","4","659","661","10.1107/S0108270198013298","","","0.71073","MoKα","","0.04","0.034","","","","0.089","","","","","","1.024","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008360","13.271","0.002","6.674","0.002","14.79","0.001","90","","97.505","0.01","90","","1298.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","t-butylammonium hydrogenphenylphosphate","","- C10 H18 N O4 P -","- C10 H18 N O4 P -","- C40 H72 N4 O16 P4 -","4","1","GD1010","Reinoso, Santiago; Vitoria, Pablo; Ugalde, Maria; Gutiérrez-Zorrilla, Juan M.; Luque, Antonio; Román, Pascual","<i>tert</i>-Butylammonium hydrogen phenyl phosphate","Acta Crystallographica Section C","1999","55","4","683","685","10.1107/S0108270198016734","","","0.71069","MoKα","","","0.037","","0.053","0.043","","","","","","","3.11","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008361","10.494","0.004","13.11","0.004","13.485","0.004","90","","90","","90","","1855.2","1.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Complexe de cuivre(II) diamino-1,2(cyclohexane diacétatodiacétique) trihydrate","","- C14 H26 Cu N2 O11 -","- C14 H26 Cu N2 O11 -","- C56 H104 Cu4 N8 O44 -","4","1","GS1006","Ben Amor, Fatma; Jouini, Tahar","Complexe de cuivre(II) diamino-1,2-(cyclohexane diacétatodiacétique) trihydrate","Acta Crystallographica Section C","1999","55","4","499","501","10.1107/S0108270198011561","","","0.71069","MoKα","","0.048","0.037","","0.1","0.09","","","","1.093","1.061","1.061","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008362","7.095","0.002","11.761","0.004","8.419","0.003","90","","98.4","0.02","90","","695","0.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","Aqua(N,N,N',N'-tetramethylethylenediamine)diisothiocyanato-copper(II)","","- C8 H18 Cu N4 O S2 -","- C8 H18 Cu N4 O S2 -","- C16 H36 Cu2 N8 O2 S4 -","2","1","GS1023","Vrábel, Viktor; Garaj, Ján; Sivý, Július; Oktavec, Drahomír","Aquadiisothiocyanato(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-<i>N</i>,<i>N</i>')copper(II)","Acta Crystallographica Section C","1999","55","4","551","553","10.1107/S0108270198014553","","","0.71069","MoKα","","0.033","0.024","","0.06","0.059","","","","0.83","0.901","0.901","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008363","8.761","0.0005","8.8907","0.0004","10.4403","0.0006","112.419","0.004","106.101","0.005","96.407","0.004","700.3","0.08","293","","","","","","","","","","","4","P -1","-P 1","2","","diclhoro (phenylethinyl)(butyl)tellurium(IV)","","- C12 H14 Cl2 Te -","- C12 H14 Cl2 Te -","- C24 H28 Cl4 Te2 -","2","1","GS1025","Zukerman-Schpector, J.; Camillo, Robinson L.; Dabdoub, Miguel J.; Begnini, Mauro L.; Caracelli, I.","Butyldichloro(phenylethynyl)tellurium(IV)","Acta Crystallographica Section C","1999","55","4","648","650","10.1107/S0108270198014565","","","0.71073","MoKα","","0.03","0.028","","0.077","","0.075","","","1.117","","","1.122","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008364","14.361","0.002","13.711","0.002","7.475","0.002","90","","90","","90","","1471.9","0.5","293","","293","","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C11 H17 N O6 P2 -","- C11 H17 N O6 P2 -","- C44 H68 N4 O24 P8 -","4","1","GS1026","Saint-Clair, Jean-François; Siméon, Fabrice; Villemin, Didier; Averbuch-Pouchot, Marie-Thérèse","2-Hydroxy-5-methyl-2-oxo-6-phenyl-4-phosphonomethyl-1,4,2-oxazoniaphosphorinane","Acta Crystallographica Section C","1999","55","4","588","590","10.1107/S0108270198016643","","","0.7107","MoKα","","0.0264","0.0264","","0.0331","0.0331","","","","1.836","1.836","1.836","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008365","12.7246","0.0015","9.5273","0.0017","18.451","0.002","90","","93.098","0.012","90","","2233.6","0.5","296","1","296","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(4-methylbenzoyl)-6-(4-methylbenzilidene)-3-phenyl-2oxa-3-azabicyclo[3.3.0] oct-7-ene","","- C28 H25 N O2 -","- C28 H25 N O2 -","- C112 H100 N4 O8 -","4","1","GS1028","Djapa, Francis; Ciamala, Kabula; Vebrel, Joël; Kubicki, Marek M.; Blacque, Olivier","4-(4-Methylbenzoyl)-6-(4-methylbenzylidene)-3-phenyl-2-oxa-3-azabicyclo[3.3.0]oct-7-ene","Acta Crystallographica Section C","1999","55","4","677","678","10.1107/S0108270198015947","","","0.71073","MoKα","","0.1658","0.0502","","","","0.1564","","","","","","0.995","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008366","3.7946","0.0002","19.1766","0.0007","13.0641","0.0006","90","","96.893","0.001","90","","943.77","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-Aminopyrimidine-Fumaric Acid (1:2) co-crystal","","- C8 H9 N3 O4 -","- C8 H9 N3 O4 -","- C32 H36 N12 O16 -","4","1","HA1239","Shyamaprosad Goswami; Ajit Kumar Mahapatra; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun; Ibrahim Abdul Razak","2-Aminopyrimidine–fumaric acid cocrystal","Acta Crystallographica Section C","1999","55","4","583","585","10.1107/S0108270198014127","","","0.71073","MoKα","","0.103","0.067","","","","0.184","","","","","","1.055","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008367","7.1276","0.0006","7.886","0.0006","8.9938","0.0007","100.143","0.002","91.493","0.002","110.972","0.001","462.47","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Acetylamino-6-methylpyridine N-oxide monohydrate","","- C8 H12 N2 O3 -","- C8 H12 N2 O3 -","- C16 H24 N4 O6 -","2","1","HA1243","Shyamaprasad Goswami; Kumaresh Ghosh; Ajit Kumar Mahapatra; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun","2-Acetylamino-6-methylpyridine <i>N</i>-oxide monohydrate","Acta Crystallographica Section C","1999","55","4","579","581","10.1107/S0108270198014139","","","0.71073","MoKα","","0.071","0.05","","","","0.161","","","","","","1.044","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008368","13.585","0.002","35.391","0.007","7.067","0.002","90","","90","","90","","3397.7","1.3","296.2","","296.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","1-(2-aminoethyl)-2,3-diphenylpiperazine hydrochloride","","- C18 H24 Cl N3 -","- C18 H24 Cl N3 -","- C144 H192 Cl8 N24 -","8","1","HA1247","Sarmistha Basu Majumder; Monika Mukherjee; Goutam Kumar Patra; Dipankar Datta; Madeleine Helliwell","2-(2,3-Diphenylpiperazin-1-yl)ethylammonium chloride","Acta Crystallographica Section C","1999","55","4","668","670","10.1107/S0108270198017648","","","1.5418","CuKα","","0.14","0.0561","","0.2646","0.1371","","","","1.056","1.042","1.042","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008369","7.375","0.0001","12.53","0.0002","15.8752","0.0002","84.095","0.001","86.38","0.001","77.933","0.001","1425.67","0.04","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","3,5,7,3'-tetrahydroxy-4'-methoxyflavone monohydrate","","- C16 H14 O8 -","- C16 H14 O8 -","- C64 H56 O32 -","4","2","HA1249","Nor Syarmila Shuib; Teng Wah Sam; Keng Chong Wong; Kandasamy Chinnakali; Hoong-Kun Fun","Tamarixetin monohydrate","Acta Crystallographica Section C","1999","55","4","576","578","10.1107/S0108270198017430","","","0.71073","MoKα","","0.076","0.059","","","","0.163","","","","","","1.184","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008370","31.425","0.005","14.289","0.002","12.375","0.002","90","","90","","90","","5556.8","1.5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C26 H36 Cl N3 O8 Zn -","- C26 H36 Cl N3 O8 Zn -","- C208 H288 Cl8 N24 O64 Zn8 -","8","1","JZ1294","Balogh-Hergovich, Éva; Kaizer, József; Speier, Gábor; Huttner, Gottfried; Rutsch, Peter","[3,3'-Iminobis(<i>N</i>,<i>N</i>-dimethylpropylamine)](4'-methoxyflavonolato)zinc(II) perchlorate, [Zn(4'-MeOfla)(idpaH)]ClO~4~","Acta Crystallographica Section C","1999","55","4","557","558","10.1107/S0108270198016795","","","0.71073","MoKα","","0.097","0.059","","","","0.104","","","","","","1.123","","","","has coordinates,has disorder","301791","2025-08-18","23:15:32",""
"2008371","11.684","0.002","14.943","0.003","16.749","0.003","105.79","0.01","106.85","0.01","91.36","0.01","2676.4","0.9","293","2","","","","","","","","","","7","P -1","-P 1","2","","Chlorobis-[1,2-bis(diphenylphosphino)ethane]oxotungsten(IV) hexafluorophospate chloroform solvate","","- C53 H49 Cl4 F6 O P5 W -","- C53 H49 Cl4 F6 O P5 W -","- C106 H98 Cl8 F12 O2 P10 W2 -","2","1","JZ1303","Llusar, R.; Mata, J.; Peris, E.; Köckerling, M.","The oxotungsten(IV) complex [WOCl(Ph~2~PCH~2~CH~2~PPh~2~)~2~]PF~6~^.^CHCl~3~","Acta Crystallographica Section C","1999","55","4","506","508","10.1107/S0108270198015856","","","0.71073","MoKα","","","0.046","","","","0.048","","","","1.421","1.421","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008372","11.663","0.004","25.704","0.005","12.07","0.004","90","","103.856","0.014","90","","3513.1","1.8","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","μ-Oxo-bis-[N,N'-ehtylene-bis(2-thioacetophenonidenimine)iron(III)]","","- C36 H36 Fe2 N4 O S4 -","- C36 H36 Fe2 N4 O S4 -","- C144 H144 Fe8 N16 O4 S16 -","4","1","JZ1316","Karsten, Peter; Strähle, Joachim","μ-Oxo-bis[<i>N</i>,<i>N</i>'-ethylenebis(2-thioacetophenonidenimine)iron(III)]","Acta Crystallographica Section C","1999","55","4","488","489","10.1107/S0108270198014826","","","1.5418","CuKα","","0.0909","0.0563","","0.194","","0.1514","","","0.931","","","0.854","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008373","3.9321","0.0008","10.886","0.002","8.3","0.0009","90","","103.6","0.01","90","","345.32","0.1","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C4 O2 S4 -","- C4 O2 S4 -","- C8 O4 S8 -","2","0.5","JZ1320","Harald Müller; Marie-Thérèse Averbuch","1,3,4,6-Tetrathiapentalene-2,5-dione","Acta Crystallographica Section C","1999","55","4","590","592","10.1107/S0108270198014346","","","0.7107","MoKα","","0.0295","0.0295","","0.0448","0.0448","","","","1.919","1.919","1.919","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008374","26.392","0.006","8.041","0.001","18.168","0.004","90","","132.39","0.01","90","","2847.6","1.1","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis{μ-[N,N'-diethyl-N,N'-bis(β-mercaptoethyl)-1,3- propanediamine]}dimanganese(II).","","- C22 H48 Mn2 N4 S4 -","- C22 H48 Mn2 N4 S4 -","- C88 H192 Mn8 N16 S16 -","4","0.5","JZ1322","Jörg Schneider; Birgit Schnautz; Ralf Hauptmann; Gerald Henkel","Bis(μ-3,7-diethyl-3,7-diazanonane-1,9-dithiolato)dimanganese(II)","Acta Crystallographica Section C","1999","55","4","489","491","10.1107/S0108270198016485","","","0.71073","MoKα","","","0.0245","","","","0.0646","","","","1.091","1.091","","","","","has coordinates","198476","2020-10-21","18:00:00",""
"2008375","9.798","0.003","18.752","0.004","19.246","0.002","90","","90","","90","","3536.1","1.4","293","","293","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(2S,4S,5R,6S)-2-benzylcarbamoyl-6-bromo-3,3-dimethyl-4-thia-1- -azabicyclo[3.2.0]heptan-7-one 4-oxide hydrate","","- C15 H19 Br N2 O4 S -","- C15 H19 Br N2 O4 S -","- C120 H152 Br8 N16 O32 S8 -","8","2","KA1291","Danilovski, Aleksandar; Vinković, Mladen; Herak, Jure J.","Two novel optically active penam derivatives","Acta Crystallographica Section C","1999","55","4","656","659","10.1107/S0108270198015108","","","0.71073","MoKα","","0.28","0.069","","0.178","0.118","","","","0.969","1.239","1.239","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008376","5.295","0.006","11.559","0.008","11.698","0.011","90","","90.64","0.08","90","","715.9","1.2","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","(5R)-3-benzylimino-2-isopropylidene-4-thia-1-azabicyclo[3.2.0]heptan-7-one","","- C15 H16 N2 O S -","- C15 H16 N2 O S -","- C30 H32 N4 O2 S2 -","2","1","KA1291","Danilovski, Aleksandar; Vinković, Mladen; Herak, Jure J.","Two novel optically active penam derivatives","Acta Crystallographica Section C","1999","55","4","656","659","10.1107/S0108270198015108","","","0.71073","MoKα","","0.128","0.061","","0.143","0.115","","","","0.992","1.164","1.164","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008377","12.5516","0.0015","7.6362","0.0007","19.828","0.002","90","","94.049","0.011","90","","1895.7","0.3","134","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Acetyl-2-(3,3-dimethyl-2-butylidene)hydrazine.","","- C8 H16 N2 O -","- C8 H16 N2 O -","- C64 H128 N16 O8 -","8","2","KA1301","Bats, Jan W.; Grundl, Marc A.; Hashmi, A. Stephen K.","1-Acetyl-2-(3,3-dimethyl-2-butylidene)hydrazine: a monoclinic crystal structure with local orthorhombic pseudosymmetry","Acta Crystallographica Section C","1999","55","4","689","691","10.1107/S0108270198015157","","","0.71073","Mo-Kα","","","0.063","","","0.053","","","","","1.283","1.283","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008378","14.0723","0.0009","7.462","0.002","21.489","0.001","90","","90","","90","","2256.5","0.6","296","1","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","2,2'-Dibromobiphenyl","","- C12 H8 Br2 -","- C12 H8 Br2 -","- C96 H64 Br16 -","8","1","LN1062","MacNeil, Dean D.; Decken, Andreas","2,2'-Dibromobiphenyl","Acta Crystallographica Section C","1999","55","4","628","630","10.1107/S0108270198015339","","","1.54178","CuKα","","","0.0326","","","","0.113","","","","","","1.032","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008379","14.627","0.003","15.834","0.004","43.135","0.013","90","","90","","90","","9990","4","203","1","203","1","","","","","","","","5","F 2 d d","F -2d 2","43","","1,13-Diaza-2,14-cyclotetraeicosanedione","","- C22 H43 Cl N2 O2 -","- C22 H43 Cl N2 O2 -","- C352 H688 Cl16 N32 O32 -","16","1","LN1071","Escudero, Encarnacion; Subirana, José A.; Solans, Xavier","Amino-11-undecanoic acid cyclic dimer hydrochloride","Acta Crystallographica Section C","1999","55","4","644","646","10.1107/S0108270198015480","","","0.71069","MoKα","","0.2026","0.0494","","","","0.1966","","","","","","0.847","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008380","9.308","0.002","10.6395","0.0019","11.225","0.002","86.959","0.016","70.753","0.019","79.375","0.018","1031.5","0.4","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","7,11-Dihydro-9,10-dimethoxy-3,11b-diphenyl[1,2,4]oxadiazolo[5,4-a][2,3] benzodiazepin-6(5H)-one","","- C24 H21 N3 O4 -","- C24 H21 N3 O4 -","- C48 H42 N6 O8 -","2","1","NA1353","Bruno, Giuseppe; Chimirri, Alba; Gitto, Rosaria; Nicoló, Francesco; Scopelliti, Rosario","7,11b-Dihydro-9,10-dimethoxy-3,11b-diphenyl[1,2,4]oxadiazolo[5,4-<i>a</i>][2,3]benzodiazepin-6(5<i>H</i>)-one","Acta Crystallographica Section C","1999","55","4","685","687","10.1107/S010827019801227X","","","0.71073","MoKα","","0.0623","0.0342","","0.0802","0.0754","","","","0.796","1","1","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008381","6.1418","0.0002","7.5325","0.0001","14.5931","0.0005","91.876","0.002","101.71","0.001","95.106","0.002","657.55","0.03","293","2","293","2","","","","","","","","4","P -1","-P 1","2","fluoropyridyl-biphenyl","1-perfluoropyridyl-4-phenylbenzene","","- C17 H9 F4 N -","- C17 H9 F4 N -","- C34 H18 F8 N2 -","2","1","NA1381","Resel, Roland; Thurner, Philipp; Kahlert, Hartmut; Völlenkle, Horst; Winkler, Berthold; Müllner, Ruth; Stelzer, Franz; Tunega, Daniel; Leising, Günther","4-(4-Biphenyl)-2,3,5,6-tetrafluoropyridine, a new material for application in light-emitting diodes","Acta Crystallographica Section C","1999","55","4","693","695","10.1107/S0108270198015169","","","0.71073","MoKα","","0.065","0.046","","0.167","0.135","","","","1.189","1.116","1.116","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008382","9.2654","0.0012","10.6629","0.0014","27.703","0.004","90","","90","","90","","2736.9","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(25R)-3beta-bromo-6beta-acetoxy-5alfa-spirostan-23-one","","- C29 H43 Br O5 -","- C29 H43 Br O5 -","- C116 H172 Br4 O20 -","4","1","NA1383","Héctor Novoa de Armas; Norbert M. Blaton; Oswald M. Peeters; Camiel J. De Ranter; Ramón Pomés Hernández; Martín A. Iglesias Arteagas; Roxana Pérez Gil; Francisco Coll Manchado","(25<i>R</i>)-6β-Acetoxy-3β-bromo-5α-spirostan-23-one","Acta Crystallographica Section C","1999","55","4","601","603","10.1107/S0108270198016382","","","1.54178","CuKα","","0.081","0.061","","0.171","","0.142","","","1.097","","","1.097","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008383","9.185","0.001","12.052","0.001","18.899","0.001","90","","90","","90","","2092.1","0.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(1S,R~S~)-N-methyl-6,7-dimethoxy-1-(p-tolylsulfinyl)methyl- 1-trifluoromethyl-1,2,3,4-tetrahydroisoquinoline","","- C21 H24 F3 N O3 S -","- C21 H24 F3 N O3 S -","- C84 H96 F12 N4 O12 S4 -","4","1","NA1386","Pierfrancesco Bravo; Eleonora Corradi; Marcello Crucianelli; Stefano Valdo Meille; Matteo Zanda","(1<i>S</i>,<i>R</i>~S~)-6,7-Dimethoxy-<i>N</i>-methyl-1-(<i>p</i>-tolylsulfinylmethyl)-1-trifluoromethyl-1,2,3,4-tetrahydroisoquinoline","Acta Crystallographica Section C","1999","55","4","687","689","10.1107/S0108270198016114","","","1.5418","CuKα","","0.0757","0.0575","","","","0.1612","","","","","","1.057","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008384","9.619","0.001","10.325","0.002","18.91","0.003","90","","90","","90","","1878.1","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R)1-(1-hydroxymethyl-propyl)-pyrrolidine-2,5-dione","","- C8 H13 N O3 -","- C8 H13 N O3 -","- C64 H104 N8 O24 -","8","2","NA1387","Pilati, Tullio; G. Biju Kumar; Amrish C. Shah","(<i>R</i>)-<i>N</i>-(1-Hydroxybut-2-yl)pyrrolidine-2,5-dione","Acta Crystallographica Section C","1999","55","4","612","613","10.1107/S010827019801484X","","","0.71073","MoKα","","0.0956","0.0465","","","","0.1163","","","","","","0.97","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008385","11.8787","0.0008","15.483","0.001","12.3467","0.0008","90","","108.21","0.01","90","","2157.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,3,6,6-tetramethyl-9-(3-nitrophenyl)-3,4,5,6,10-hexahydroacridine- 1,8(2H,7H)-dione","","- C23 H26 N2 O4 -","- C23 H26 N2 O4 -","- C92 H104 N8 O16 -","4","1","NA1388","Héctor Novoa de Armas; Norbert M. Blaton; Oswald M. Peeters; Camiel J. De Ranter; Margarita Suárez Navarro; Yamila Verdecia Reyes; Estael Ochoa Rodríguez; Esperanza Salfrán","3,3,6,6-Tetramethyl-9-(3-nitrophenyl)-3,4,5,6,9,10-hexahydroacridine-1,8(2<i>H</i>,7<i>H</i>)-dione","Acta Crystallographica Section C","1999","55","4","596","599","10.1107/S0108270198016394","","","1.54178","CuKα","","0.087","0.059","","","","0.186","","","1.108","","","1.108","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008386","7.163","0.001","18.299","0.001","10.407","0.001","90","","109.55","0.01","90","","1285.5","0.2","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Co N4 O8 -","- C26 H26 Co N4 O8 -","- C52 H52 Co2 N8 O16 -","2","0.5","NA1389","Hökelek, Tuncer; Necefoğlu, Hacalı","<i>trans</i>-Diaquabis(benzoato-<i>O</i>)bis(nicotinamide-<i>N</i>^1^)cobalt(II)","Acta Crystallographica Section C","1999","55","4","545","547","10.1107/S0108270199000153","","","0.71073","MoKα","","","0.027","","","0.038","","","","","1.38","1.38","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008387","7.7585","0.0005","15.606","0.001","22.8759","0.0009","90","","90","","90","","2769.8","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Methyl-4β-bromine-7α-cathyloxy-3-oxo-5β-cholanoate","","- C28 H43 Br O6 -","- C28 H40 Br O6 -","- C112 H160 Br4 O24 -","4","1","NA1393","Héctor Novoa de Armas; Norbert M. Blaton; Oswald M. Peeters; Camiel J. De Ranter; Ramón Pomés Hernández; Francisco Coll Manchado; Roxana Pérez Gil","Methyl 4β-bromo-7α-cathyloxy-3-oxo-5β-cholanoate","Acta Crystallographica Section C","1999","55","4","599","601","10.1107/S0108270198016400","","","1.54178","CuKα","","0.054","0.044","","","","0.138","","","1.071","","","1.071","","","","has coordinates","191977","2020-10-21","18:00:00",""
"2008388","10.6629","0.0004","9.8546","0.0004","17.5982","0.0008","90","","94.249","0.001","90","","1844.11","0.13","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-benzoyl-1-naphthylbenzoate","","- C24 H16 O3 -","- C24 H16 O3 -","- C96 H64 O12 -","4","1","NA1396","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan","2-Benzoyl-1-naphthyl benzoate","Acta Crystallographica Section C","1999","55","4","587","588","10.1107/S010827019801765X","","","0.71073","MoKα","","0.105","0.065","","","","0.18","","","","","","1.142","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008389","9.245","0.002","16.226","0.002","8.828","0.002","92.41","0.01","98.17","0.02","78.08","0.01","1282.5","0.4","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","5-(8,8-Dicyanoheptafulven-3-yl)-2-hydroxy-1,3-xylyl-18-crown-5 potassium salt monohydrate","","- C26 H29 K N2 O7 -","- C26 H29 K N2 O7 -","- C52 H58 K2 N4 O14 -","2","1","OA1064","Shinya Matsumoto; Kaname Yumura; Hiroyuki Otani; Jin Mizuguchi","5-(8,8-Dicyanoheptafulven-3-yl)-2-hydroxy-1,3-xylyl-18-crown-5 potassium salt monohydrate","Acta Crystallographica Section C","1999","55","4","536","538","10.1107/S0108270198014772","","","1.5418","CuKα","","0.1006","0.0556","","0.0687","0.0605","","","","1.23","1.312","1.312","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008390","18.62","0.01","12.691","0.008","17.42","0.01","90","","121.17","0.05","90","","3522","4","298","","298","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","2-Bromo-2,3-diphenylmethano-2,3-dihydronaphthoquinone","","- C23 H15 Br O2 -","- C23 H15 Br O2 -","- C184 H120 Br8 O16 -","8","1","OA1073","Takumi Oshima; Kazuaki Fukushima; Tatsuya Kawamoto","2-Bromo-2,3-diphenylmethano-2,3-dihydronaphthoquinone","Acta Crystallographica Section C","1999","55","4","608","610","10.1107/S0108270198015212","","","0.71073","MoKα","","","0.054","","","0.067","","","","","2.296","2.296","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008391","13.15","0.002","11.545","0.002","14.565","0.002","90","","102.02","0.01","90","","2162.7","0.6","297","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(pyridine)-bis(2-thiopheneglyoxylato-O^1^,O^2^)copper(II)","","- C22 H16 Cu N2 O6 S2 -","- C22.334 H15.8 Cu N2 O6 S1.876 -","- C89.336 H63.2 Cu4 N8 O24 S7.504 -","4","0.5","OA1077","Nakasa, Kazuyuki; Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru","Copper(II) 2-thiopheneglyoxylate adducts with pyridine derivatives","Acta Crystallographica Section C","1999","55","4","513","517","10.1107/S0108270198016424","","","0.71073","MoKα","","","0.039","","","0.04","","","","","1.401","1.401","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008392","20.16","0.003","9","0.002","24.497","0.003","90","","118.47","0.01","90","","3907.2","1.2","298","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-Poly[bis(2-thiopheneglyoxylato-O^1^,O^2^)copper(II) -μ-(2-thiopheneglyoxylato-O^1^:O^1^,O^2^)-bis(3-methylpyridine)copper(II) -μ-(2-thiopheneglyoxylato-O^1^,O^2^:O^1^)monohydrate","","- C36 H28 Cu2 N2 O13 S4 -","- C37.666 H27 Cu2 N2 O13 S3.376 -","- C150.664 H108 Cu8 N8 O52 S13.504 -","4","0.5","OA1077","Nakasa, Kazuyuki; Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru","Copper(II) 2-thiopheneglyoxylate adducts with pyridine derivatives","Acta Crystallographica Section C","1999","55","4","513","517","10.1107/S0108270198016424","","","0.71073","MoKα","","","0.052","","","0.05","","","","","1.643","1.643","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008393","11.894","0.002","18.092","0.003","11.452","0.002","90","","90","","90","","2464.3","0.7","299","","","","","","","","","","","6","P n c a","-P 2a 2n","60","","Bis(4-methylpyridine)-bis(2-thiopheneglyoxylato-O^1^,O^2^)copper(II)","","- C24 H20 Cu N2 O6 S2 -","- C24 H20 Cu N2 O6 S2 -","- C96 H80 Cu4 N8 O24 S8 -","4","0.5","OA1077","Nakasa, Kazuyuki; Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru","Copper(II) 2-thiopheneglyoxylate adducts with pyridine derivatives","Acta Crystallographica Section C","1999","55","4","513","517","10.1107/S0108270198016424","","","0.71073","MoKα","","","0.054","","","0.049","","","","","1.421","1.421","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008394","15.005","0.003","20.397","0.004","6.342","0.0013","90","","90","","90","","1941","0.7","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","tri-p-tolyltriazine","2,4,6-tris-(4-Methylphenyl)-1,3,5-triazine","","- C24 H21 N3 -","- C24 H21 N3 -","- C96 H84 N12 -","4","0.5","OA1078","Thalladi, Venkat R.; Muthuraman, Meiyappan; Nangia, Ashwini; Desiraju, Gautam R.","Tri-<i>p</i>-tolyl-1,3,5-triazine","Acta Crystallographica Section C","1999","55","4","698","700","10.1107/S0108270198018496","","","0.71073","MoKα","","0.072","0.049","","0.14","0.121","","","","1.171","1.191","1.191","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008395","7.922","0.002","8.198","0.002","26.58","0.004","90","","90","","90","","1726.2","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","N-Pentenoyl Sultam","3H-3aR,6S,7aS-8,8-Dimethyl-N-[(3S)-3,4-dimethylpent-4-enoyl]-2,2- dioxo-3a-6-methano-4,5,6,7-tetrahydro-2,1-benzisothiazole","","- C17 H27 N O3 S -","- C17 H27 N O3 S -","- C68 H108 N4 O12 S4 -","4","1","OB1002","Hughes, Andrew B.; Mackay, Maureen F.; McCaffrey, Narelle L.","Absolute structure of an <i>N</i>-pentenoyl benzisothiazole","Acta Crystallographica Section C","1999","55","4","610","612","10.1107/S0108270198016126","","","1.5418","CuKα","","0.054","0.054","","0.152","0.144","","","","1.055","1.047","1.047","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008396","8.517","0.002","7.731","0.002","10.83","0.002","90","","90.38","0.03","90","","713.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H16 Cl2 N4 O10 -","- C6 H16 Cl2 N4 O10 -","- C12 H32 Cl4 N8 O20 -","2","0.5","OS1034","Cheng-Yong Su; Wen-Jun Zhang; Bei-Sheng Kang","<i>N</i>,<i>N</i>'-Bis(2-ammonioethyl)oxamide diperchlorate","Acta Crystallographica Section C","1999","55","4","636","637","10.1107/S010827019801470X","","","0.71073","MoKα","","0.0721","0.0662","","0.1746","0.1681","","","","1.115","1.115","1.115","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008397","4.76","0.001","26.181","0.005","9.62","0.002","90","","92.86","0.0005","90","","1197.4","0.4","295","","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Caesium 5-(2-cyanoethylthio)-1,3-dithiole-2-thione-4-thiolate","","- C6 H4 Cs N S5 -","- C6 H4 Cs N S5 -","- C24 H16 Cs4 N4 S20 -","4","1","OS1038","Simonsen, Klaus B.; Simonsen, Ole; Becher, Jan","Caesium 5-(2-cyanoethylthio)-2-thioxo-1,3-dithiole-4-thiolate","Acta Crystallographica Section C","1999","55","4","547","549","10.1107/S0108270198017442","","","0.71073","MoKα","","0.046","0.033","","0.315","0.044","","","","8.19","1.189","1.189","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008398","10.223","0.001","11.48","0.001","12.058","0.001","81.619","0.008","70.668","0.006","87.605","0.006","1321","0.2","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H32 N2 O4 S2 -","- C27 H32 N2 O4 S2 -","- C54 H64 N4 O8 S4 -","2","1","OS1042","Hökelek, Tuncer; Patır, Süleyman","<i>N</i>-(2,2-Dimethoxyethyl)-<i>N</i>-{9-methoxymethyl-1,2,3,4-tetrahydrospiro[carbazole-1,2'-[1,3]dithiolan]-4-yl}benzamide","Acta Crystallographica Section C","1999","55","4","675","677","10.1107/S0108270198017454","","","0.71073","MoKα","","","0.0626","","","0.0786","","","","","1.31","1.31","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008399","5.842","0.002","16.593","0.005","17.561","0.007","90","","90","","90","","1702.3","1","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","toluene-4-sulfonic acid 2-isopropyl-5-methyl-cyclohexyl ester","","- C17 H26 O3 S -","- C17 H26 O3 S -","- C68 H104 O12 S4 -","4","1","QA0096","Degen, Alexander; Bolte, Michael","(–)-3-<i>p</i>-Menthyl tosylate","Acta Crystallographica Section C","1999","55","4","IUC9900024","","10.1107/S0108270199099667","","","0.71073","MoKα","","0.039","0.031","","","","0.081","","","1.055","","","1.054","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008400","7.331","0.0001","14.0055","0.0003","9.2714","0.0002","90","","109.451","0.001","90","","897.6","0.03","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2-(Arylazo)imidazole","","- C9 H8 N4 -","- C9 H8 N4 -","- C36 H32 N16 -","4","1","QA0098","Hoong-Kun Fun; Kandasamy Chinnakali; Xiao-Feng Chen; Xu-Hui Zhu; Xiao-Zeng You","(1<i>H</i>-Imidazol-2-yl)phenyldiazene","Acta Crystallographica Section C","1999","55","4","IUC9900025","","10.1107/S0108270199099631","","","0.71073","MoKα","","0.074","0.043","","","","0.131","","","","","","1.023","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008401","7.215","0.002","8.209","0.004","16.542","0.004","90","","100.21","0.02","90","","964.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Hydroxy-cyclooctanone-O-methyl-oxime","","- C9 H17 N O2 -","- C9 H17 N O2 -","- C36 H68 N4 O8 -","4","1","QA0099","Boese, Roland; Rademacher, Paul; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","5-Hydroxycyclooctanone <i>O</i>-methyloxime at 293K","Acta Crystallographica Section C","1999","55","4","IUC9900026","","10.1107/S010827019909962X","","","0.71073","MoKα","","0.057","0.042","","","","0.132","","","","","","1.027","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008402","8.916","0.003","6.0717","0.0015","12.62","0.003","90","","95.027","0.014","90","","680.6","0.3","103","2","103","2","","","","","","","","2","I 1 2/a 1","-I 2ya","15","","dispiro[2.1.2.1]octane","","- C8 H12 -","- C8 H12 -","- C32 H48 -","4","0.5","QA0100","Boese, Roland; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","Dispiro[2.1.2.1]octane at 103K","Acta Crystallographica Section C","1999","55","4","IUC9900023","","10.1107/S0108270199099618","","","0.71073","MoKα","","0.069","0.054","","","","0.156","","","","","","1.047","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008403","9.222","0.005","9.365","0.005","16.728","0.009","90","","104.62","0.01","90","","1397.9","1.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-Allyl-3-(ethoxycarbonylmethylen)-2-oxo-1,2,3,4-tetrahydroquinoxaline","","- C15 H16 N2 O3 -","- C15 H16 N2 O3 -","- C60 H64 N8 O12 -","4","1","QA0101","Sersra, Souad; Essassi, El-Mokhtar; El-Bali, Brahim; Bolte, Michael","Ethyl 4-allyl-4-oxo-1,2,3,4-tetrahydroquinoxalin-2-ylideneacetate","Acta Crystallographica Section C","1999","55","4","IUC9900021","","10.1107/S0108270199099655","","","0.71073","MoKα","","0.127","0.055","","","","0.135","","","","","","0.994","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008404","9.1581","0.0005","9.3318","0.0007","13.4647","0.0008","90","","100.14","0.005","90","","1132.74","0.13","293","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","azepinoquinoleine","6-chloro-5H-tetrahydroazepino[3,2-c]quinoleine","","- C13 H13 Cl N2 -","- C13 H13 Cl N2 -","- C52 H52 Cl4 N8 -","4","1","QA0102","Bureau, Isabelle; Chardon, Josiane; Leclaire, Andre; Hinschberger, Antoine; Rault, Sylvain","6-Chloro-1<i>H</i>-2,3,4,5-tetrahydroazepino[3,2-<i>c</i>]quinoline","Acta Crystallographica Section C","1999","55","4","IUC9900022","","10.1107/S010827019909959X","","","0.71073","MoKα","","0.152","0.044","","0.059","0.044","","","","0.739","","","1.008","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008405","44.3229","0.0004","13.3413","0.0001","25.3433","0.0001","90","","105.845","0.001","90","","14416.7","0.19","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis[(acetato-O,O')bis(triphenylphosphine-P)silver(I)] monohydrate sesquiethanol solvate","","- C79 H77 Ag2 O6.5 P4 -","- C79 H77 Ag2 O6.5 P4 -","- C632 H616 Ag16 O52 P32 -","8","1","QA0103","Hanna, John V.; Ng, Seik Weng","Redetermination of bis[(acetato-<i>O</i>,<i>O</i>')bis(triphenylphosphine-<i>P</i>)silver(I)] monohydrate sesquiethanol solvate","Acta Crystallographica Section C","1999","55","4","IUC9900031","","10.1107/S0108270199099692","","","0.71073","MoKα","","0.071","0.043","","","","0.112","","","","","","1.013","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008406","7.3176","0.0006","8.9755","0.0006","17.909","0.001","90","","93.636","0.005","90","","1173.88","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1α,4α,4aβ,9β,9aβ,10β-hexahydro-9,10-Epithioanthracene-1,4-diol","","- C14 H14 O2 S -","- C14 H14 O2 S -","- C56 H56 O8 S4 -","4","1","QA0104","Bats, Jan W.; Krämer, Norbert H.; Linde, Hermann F.G.","1α,4α,4aβ,9β,10β,10aβ-Hexahydro-9,10-epithioanthracene-1,4-diol","Acta Crystallographica Section C","1999","55","4","IUC9900027","","10.1107/S0108270199099588","","","1.5418","CuKα","","0.034","0.034","","","","0.137","","","","","","2.148","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008407","11.9597","0.0001","18.3546","0.0003","15.0141","0.0003","90","","100.772","0.001","90","","3237.75","0.09","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Nitrito-O,O')bis(triphenylphosphine-P)silver(I)","","- C36 H30 Ag N O2 P2 -","- C36 H30 Ag N O2 P2 -","- C144 H120 Ag4 N4 O8 P8 -","4","1","QA0105","Hanna, John V.; Ng, Seik Weng","(Nitrito-<i>O</i>,<i>O</i>')bis(triphenylphosphine-<i>P</i>)silver(I)","Acta Crystallographica Section C","1999","55","4","IUC9900029","","10.1107/S0108270199099680","","","0.71073","MoKα","","0.087","0.046","","","","0.092","","","","","","1.024","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008408","8.6226","0.0016","8.6226","0.0016","21.73","0.005","90","","90","","90","","1615.6","0.6","125","2","125","2","","","","","","","","2","I 41/a :2","-I 4ad","88","","perfluoro-benzocyclobutene","","- C8 F8 -","- C8 F8 -","- C64 F64 -","8","0.5","QA0106","Boese, Roland; Bläser, Dieter; Latz, Rüdiger; Bäumen, Anja","2,3,4,5,7,7,8,8,-Octafluorobicyclo[4.2.0]octa-1,3,5-triene at 125K","Acta Crystallographica Section C","1999","55","4","IUC9900036","","10.1107/S0108270199099606","","","0.71073","MoKα","","0.074","0.063","","","","0.2","","","","","","1.075","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008409","9.985","0.002","14.839","0.003","12.744","0.003","90","","108.81","0.01","90","","1787.4","0.7","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H20 O4 -","- C22 H20 O4 -","- C88 H80 O16 -","4","1","QA0107","Elazami, Mohamed; Bitit, Najib; Kerbal, Abdelali; Fahim, Mohamed; El-Bali, Brahim; Bolte, Michael","Diethyl 2-anthracen-9-ylmethylenemalonate","Acta Crystallographica Section C","1999","55","4","IUC9900037","","10.1107/S0108270199099643","","","0.71073","MoKα","","0.112","0.054","","","","0.119","","","","","","1.017","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008410","10.195","0.0001","10.2164","0.0001","19.3172","0.0001","75.501","0.001","74.862","0.001","64.474","0.001","1730.53","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H30 N4 O3 W -","- C41 H30 N4 O3 W -","- C82 H60 N8 O6 W2 -","2","1","QB0073","Abboud, Khalil A.; He, Yingxia; McElwee-White, Lisa","Tricarbonylbis(1,2,3-triphenyl-1,3-diazaallyl)tungsten(IV)","Acta Crystallographica Section C","1999","55","4","IUC9900032","","10.1107/S0108270199099679","","","0.71073","MoKα","","0.033","0.027","","","0.058","0.061","","","","","","1.008","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008411","10.077","0.004","13.231","0.003","17.167","0.004","98.14","0.02","106.12","0.03","111.12","0.03","1975.2","1.2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","2,4-Di(triphenylphosphino)-closo-decaborane-Dichloromethane (1/1)","","- C37 H40 B10 Cl2 P2 -","- C37 H40 B10 Cl2 P2 -","- C74 H80 B20 Cl4 P4 -","2","1","QB0074","Yao, Hai-Jun; Hu, Chun-Hua; Dou, Jian-Min; Jin, Ruo-Shui; Zheng, Pei-Ju","2,4-Bis(triphenylphosphino)-<i>closo</i>-decaborane‒dichloromethane (1/1)","Acta Crystallographica Section C","1999","55","4","IUC9900033","","10.1107/S0108270199099576","","","0.71073","MoKα","","","0.057","","","","0.198","","","","","","1.046","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008412","5.493","0.002","10.104","0.002","16.288","0.004","97.26","0.02","93.4","0.02","92.6","0.03","893.9","0.4","173","2","","","","","","","","","","5","P -1","-P 1","2","Iodoproxyfan","3-(1H-imidazol-4-yl)propyl (4-iodophenyl)methyl ether hydrogen maleate","","- C17 H19 I N2 O5 -","- C17 H19 I N2 O5 -","- C34 H38 I2 N4 O10 -","2","1","QB0075","Kovalainen, Jari T.; Wegelius, Elina; Christiaans, Johannes A. M.; Huuskonen, Juhani; Gynther, Jukka","4-[3-(4-Iodophenylmethoxy)propyl]-1<i>H</i>-imidazolium hydrogen maleate (iodoproxyfan hydrogen maleate)","Acta Crystallographica Section C","1999","55","4","IUC9900035","","10.1107/S0108270199099564","","","0.71073","MoKα","","0.022","0.021","","","","0.057","","","","","","1.184","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008413","12.889","0.003","25.096","0.005","16.189","0.003","90","","94.812","0.015","90","","5218.1","1.9","295","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- Bi2 H88 Na6 Ni2 O112 W20 -","- Bi2 Na5.998 Ni1.62 O105 W20.38 -","- Bi4 Na11.996 Ni3.24 O210 W40.76 -","2","0.5","QB0077","Rosu, Cristina; Weakley, Timothy J.R.","Hexasodium tetrahydrogen bis(triaquanickelo)icosatungstodibismuthate(III)(10 ‒) 36-hydrate","Acta Crystallographica Section C","1999","55","4","IUC9900034","","10.1107/S0108270199099710","","","0.71073","MoKα","","0.117","0.052","","0.056","","0.05","","","1.35","","","1.5","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008414","9.364","0.0019","15.401","0.003","9.871","0.002","90","","112.38","0.03","90","","1316.3","0.5","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Cl2 P2 Pd -","- C26 H26 Cl2 P2 Pd -","- C52 H52 Cl4 P4 Pd2 -","2","0.5","QB0079","Guzman-Jimenez, Ilse Y.; Whitmire, Kenton H.","<i>trans</i>-Dichlorobis(methyldiphenylphosphine-<i>P</i>)palladium(II)","Acta Crystallographica Section C","1999","55","4","IUC9900028","","10.1107/S0108270199099709","","","0.71073","MoKα","","0.052","0.035","","","","0.098","","","","","","1.092","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008415","7.361","0.003","16.269","0.004","9.622","0.003","90","","97.6","0.03","90","","1142.2","0.7","299","","299","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","N,N'-bis(2-hydroxybenzyl)-1,2-diphenylethylenediamine","","","- C28 H28 N2 O2 -","- C28 H28 N2 O2 -","- C56 H56 N4 O4 -","2","0.5","QB0084","Hoshina, Gakuse; Ohba, Shigeru; Tsuchimoto, Masanobu","(<i>RS</i>,<i>SR</i>)-<i>N</i>,<i>N</i>'-Bis(2-hydroxybenzyl)-1,2-diphenylethylenediamine","Acta Crystallographica Section C","1999","55","4","IUC9900030","","10.1107/S0108270199099552","","","0.71073","MoKα","","0.125","0.066","","","","0.201","","","","","","1.048","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008416","10.9185","0.0011","28.281","0.004","8.638","0.0007","90","","90","","90","","2667.3","0.5","296","","296","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","L-menthyl (-)-3-methoxy-13-methyl-14-ethyl-11,12,13(S)14(R)- tetrahydrophenanthrene 13-carboxylate IUPAC: L-menthyl (-)-(1R,2S)-1-ethyl-7-methoxy-2-methyl- 1,2,3,4-tetrahydrophenanthrene-2-carboxylate","","- C29 H40 O3 -","- C29 H40 O3 -","- C116 H160 O12 -","4","1","QB0088","Robinson, Paul D.; Hou, Yuqing; Meyers, Cal Y.; Adler, Stuart; Banz, William J.; Winters, Todd A.","<small>L</small>-Menthyl ester of highly estrogenic (–)-(<i>Z</i>)-bisdehydrodoisynolic acid 3-methyl ether","Acta Crystallographica Section C","1999","55","4","IUC9900020","","10.1107/S0108270199099540","","","0.71069","MoKα","","0.186","0.034","","","","0.121","","","","","","0.958","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008417","9.285","0.001","11.86","0.003","12.53","0.002","90","","102.94","0.01","90","","1344.8","0.4","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","3,5-di-tert-butyl-1,2-benzoquinone","","- C14 H20 O2 -","- C14 H20 O2 -","- C56 H80 O8 -","4","1","SK1163","Horng, Den-Nan; Chyn, Jong-Pyng; Shieh, Kuan-Jiunn; Chou, Jeh-Li; Wen, Yuh-Sheng","3,5-Di-<i>tert</i>-butyl-1,2-benzoquinone","Acta Crystallographica Section C","1999","55","4","652","653","10.1107/S010827019801436X","","","0.71073","MolybdenumKα","","0.081","0.044","","0.056","0.052","","","","","1.9","1.9","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008418","7.328","0.008","8.729","0.009","11.513","0.011","95.83","0.07","107.27","0.08","97.34","0.07","689.9","1.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Methyl 1,4,5,6-tetrahydro-2-methyl-4-(2-nitrophenyl)-6-oxo-pyridine-3- carboxylate","","- C14 H14 N2 O5 -","- C14 H14 N2 O5 -","- C28 H28 N4 O10 -","2","1","SK1228","Viktor Kettmann; Ján Svetlík","Methyl 1,4,5,6-tetrahydro-2-methyl-4-(2-nitrophenyl)-6-oxopyridine-3-carboxylate","Acta Crystallographica Section C","1999","55","4","661","663","10.1107/S0108270198015029","","","0.71073","MoKα","","0.104","0.06","","0.165","0.123","","","","1.041","1.182","1.182","","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008419","4.8912","0.0006","11.6238","0.0012","5.6581","0.0003","90","","91.279","0.006","90","","321.61","0.05","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,2-Ethylenebis(phosphonic acid)","","","- C2 H8 O4 P2 -","- C2 H8 O4 P2 -","- C4 H16 O8 P4 -","2","0.5","SK1229","Joachim Bruckmann; Carl Krüger; Christian W. Lehmann; Walter Leitner; Jörg Rust; Christian Six","Ethylenebis(phosphonic acid)","Acta Crystallographica Section C","1999","55","4","695","696","10.1107/S0108270198016448","","","0.71069","MoKα","","0.041","0.038","","","0.115","0.118","","","","","","1.286","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008420","6.893","0.004","18.222","0.008","6.981","0.003","90","","108.05","0.05","90","","833.7","0.7","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","4-oxa-3,17-dioxoandrostane-5α-carbaldehyde","","- C19 H26 O4 -","- C19 H26 O4 -","- C38 H52 O8 -","2","1","SK1231","Andrade, L. C. R.; Paixão, J. A.; de Almeida, M. J.; Tavares da Silva, E. J.; Sá e Melo, M. L.; Campos Neves, A. S.","3,17-Dioxo-4-oxaandrostane-5α-carbaldehyde","Acta Crystallographica Section C","1999","55","4","637","639","10.1107/S0108270198015728","","","0.71073","MoKα","","0.0728","0.0403","","","","0.1128","","","","","","1.056","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008421","9.115","0.002","14.226","0.002","20.224","0.004","90","","93.532","0.009","90","","2617.5","0.9","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Coumarin-3-carboxylato)triphenyltin^.^ethanol","","- C30 H26 O5 Sn -","- C30 H26 O5 Sn -","- C120 H104 O20 Sn4 -","4","1","SK1234","Ng, Seik Weng","Coordination complexes of triphenyltin coumarin-3-carboxylate with <i>O</i>-donor ligands: (coumarin-3-carboxylato)triphenyltin‒<i>L</i> (<i>L</i> = ethanol, diphenylcyclopropenone and quinoline <i>N</i>-oxide) and bis[(coumarin-3-carboxylato)triphenyltin]‒<i>L</i> (<i>L</i> = triphenylphosphine oxide and triphenylarsine oxide)","Acta Crystallographica Section C","1999","55","4","523","531","10.1107/S0108270198014991","","","0.71073","MoKα","","0.096","0.052","","","","0.118","","","","","","0.992","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008422","12.712","0.002","19.402","0.002","14.456","0.003","90","","97.242","0.009","90","","3537","1","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Coumarin-3-carboxylato)triphenyltin^.^1,2-diphenylcyclopropenone","","- C43 H30 O5 Sn -","- C43 H30 O5 Sn -","- C172 H120 O20 Sn4 -","4","1","SK1234","Ng, Seik Weng","Coordination complexes of triphenyltin coumarin-3-carboxylate with <i>O</i>-donor ligands: (coumarin-3-carboxylato)triphenyltin‒<i>L</i> (<i>L</i> = ethanol, diphenylcyclopropenone and quinoline <i>N</i>-oxide) and bis[(coumarin-3-carboxylato)triphenyltin]‒<i>L</i> (<i>L</i> = triphenylphosphine oxide and triphenylarsine oxide)","Acta Crystallographica Section C","1999","55","4","523","531","10.1107/S0108270198014991","","","0.71073","MoKα","","0.126","0.059","","","","0.126","","","","","","0.989","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008423","10.4099","0.0003","11.52","0.001","13.725","0.002","111.754","0.008","95.758","0.007","98.695","0.005","1489.1","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","(Coumarin-3-carboxylato)triphenyltin^.^quinoline N-oxide","","- C37 H27 N O5 Sn -","- C37 H27 N O5 Sn -","- C74 H54 N2 O10 Sn2 -","2","1","SK1234","Ng, Seik Weng","Coordination complexes of triphenyltin coumarin-3-carboxylate with <i>O</i>-donor ligands: (coumarin-3-carboxylato)triphenyltin‒<i>L</i> (<i>L</i> = ethanol, diphenylcyclopropenone and quinoline <i>N</i>-oxide) and bis[(coumarin-3-carboxylato)triphenyltin]‒<i>L</i> (<i>L</i> = triphenylphosphine oxide and triphenylarsine oxide)","Acta Crystallographica Section C","1999","55","4","523","531","10.1107/S0108270198014991","","","0.71073","MoKα","","0.041","0.032","","","","0.08","","","","","","1.013","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008424","9.4696","0.0006","16.164","0.002","20.816","0.002","79.329","0.008","81.946","0.007","80.861","0.007","3071.2","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis[(coumarin-3-carboxylato)triphenyltin]^.^triphenylphosphine oxide","","- C74 H55 O9 P Sn2 -","- C74 H55 O9 P Sn2 -","- C148 H110 O18 P2 Sn4 -","2","1","SK1234","Ng, Seik Weng","Coordination complexes of triphenyltin coumarin-3-carboxylate with <i>O</i>-donor ligands: (coumarin-3-carboxylato)triphenyltin‒<i>L</i> (<i>L</i> = ethanol, diphenylcyclopropenone and quinoline <i>N</i>-oxide) and bis[(coumarin-3-carboxylato)triphenyltin]‒<i>L</i> (<i>L</i> = triphenylphosphine oxide and triphenylarsine oxide)","Acta Crystallographica Section C","1999","55","4","523","531","10.1107/S0108270198014991","","","0.71073","MoKα","","0.066","0.047","","","","0.102","","","","","","1.069","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008425","9.5242","0.0004","16.219","0.002","20.807","0.002","79.501","0.009","81.793","0.007","80.523","0.006","3096","0.5","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Bis[(coumarin-3-carboxylato)triphenyltin]^.^triphenylarsine oxide","","- C74 H55 As O9 Sn2 -","- C74 H55 As O9 Sn2 -","- C148 H110 As2 O18 Sn4 -","2","1","SK1234","Ng, Seik Weng","Coordination complexes of triphenyltin coumarin-3-carboxylate with <i>O</i>-donor ligands: (coumarin-3-carboxylato)triphenyltin‒<i>L</i> (<i>L</i> = ethanol, diphenylcyclopropenone and quinoline <i>N</i>-oxide) and bis[(coumarin-3-carboxylato)triphenyltin]‒<i>L</i> (<i>L</i> = triphenylphosphine oxide and triphenylarsine oxide)","Acta Crystallographica Section C","1999","55","4","523","531","10.1107/S0108270198014991","","","0.71073","MoKα","","0.058","0.041","","","","0.093","","","","","","1.085","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008426","8.3216","0.0016","12.392","0.003","15.949","0.002","83.58","0.02","79.634","0.016","72.99","0.015","1544","0.5","294","1","294","1","","","","","","","","5","P -1","-P 1","2","","1,1'-Bis(3-phenylquinoxalin-2-yl)ferrocene dichloromethane solvate","","- C38.9 H27.8 Cl1.8 Fe N4 -","- C38.898 H27.796 Cl1.796 Fe N4 -","- C77.796 H55.592 Cl3.592 Fe2 N8 -","2","1","SK1238","Ahmed, S. Zaka,; Glidewell, Christopher; Ferguson, George","1,1'-Bis(3-phenylquinoxalin-2-yl)ferrocene dichloromethane solvate","Acta Crystallographica Section C","1999","55","4","503","506","10.1107/S010827019801186X","","","0.71073","MoKα","","0.145","0.067","","","","0.144","","","","","","0.852","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008427","8.5966","0.0007","11.4966","0.0014","12.4867","0.0011","70.432","0.008","77.619","0.007","85.302","0.009","1135.7","0.2","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H18 N4 O6 Zn -","- C26 H18 N4 O6 Zn -","- C52 H36 N8 O12 Zn2 -","2","1","SK1243","Tatar, Leyla; Ülkü, Dinçer; Atakol, Orhan","Zinc(II) complexes of bidentate Schiff base ligands containing methoxyphenyl and nitrophenyl groups","Acta Crystallographica Section C","1999","55","4","508","510","10.1107/S0108270198015406","","","0.71073","MoKα","","","0.0412","","","0.0517","","","","","1.01","1.01","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008428","9.0778","0.0011","11.4052","0.0013","12.0973","0.0012","84.898","0.002","87.619","0.003","71.594","0.002","1183.6","0.2","295","","","","","","","","","","","5","P -1","-P 1","2","","","","- C28 H24 N2 O4 Zn -","- C28 H24 N2 O4 Zn -","- C56 H48 N4 O8 Zn2 -","2","1","SK1243","Tatar, Leyla; Ülkü, Dinçer; Atakol, Orhan","Zinc(II) complexes of bidentate Schiff base ligands containing methoxyphenyl and nitrophenyl groups","Acta Crystallographica Section C","1999","55","4","508","510","10.1107/S0108270198015406","","","0.71073","MoKα","","","0.0279","","","0.0371","","","","","1.01","1.01","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008429","6.9446","0.0006","9.8415","0.0007","17.0921","0.0013","94.102","0.006","94.906","0.006","100.05","0.006","1141.57","0.16","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-Poly[diaqua(pyridine-2-carboxamide-N^1^,O)-copper(II)-μ-sulfato-O,O'] monohydrate","","- C6 H12 Cu N2 O8 S -","- C6 H12 Cu N2 O8 S -","- C24 H48 Cu4 N8 O32 S4 -","4","2","SK1250","Sieroń, Lesław; Bukowska-Strzyżewska, Maria","<i>catena</i>-Poly[[[diaqua(pyridine-2-carboxamide-<i>N</i>^1^,<i>O</i>)copper(II)]-μ-(sulfato-<i>O</i>:<i>O</i>')] monohydrate]","Acta Crystallographica Section C","1999","55","4","491","494","10.1107/S0108270198015340","","","0.71073","MoKα","","0.027","0.024","","","","0.066","","","","","","1.034","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008430","11.0232","0.0002","15.1645","0.0002","24.2826","0.0001","90","","90","","90","","4059.11","0.09","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C14 H28 N2 S4 -","- C14 H28 N2 S4 -","- C112 H224 N16 S32 -","8","1","","Fangfang Jian; Lijian Jiang; Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak; Xiaozeng You","Bis(dipropylthiocarbamoyl) disulfide","Acta Crystallographica Section C","1999","55","","574","576","","","","","","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008431","16.169","0.002","7.6796","0.0009","14.153","0.002","90","","90","","90","","1757.4","0.4","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","tris(ethylenediamine)-nickel(II)tetrathiomolybdate","","","- C6 H24 Mo N6 Ni S4 -","- C6 H24 Mo N6 Ni S4 -","- C24 H96 Mo4 N24 Ni4 S16 -","4","1","SK1258","Ellermeier, Jan; Näther, Christian; Bensch, Wolfgang","Tris(ethylenediamine-<i>N</i>,<i>N</i>')nickel(II) tetrathiomolybdate","Acta Crystallographica Section C","1999","55","4","501","503","10.1107/S0108270198016461","","","0.71073","MoKα","","0.039","0.021","","0.05","0.046","","","","1.01","1.044","1.044","","","","","has coordinates,has disorder","301791","2025-08-18","23:15:32",""
"2008432","12.189","0.006","6.64","0.003","12.393","0.005","90","","105.36","0.02","90","","967.2","0.8","301","","301","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C3 H13 K O7 -","- C3 H13 K O7 -","- C12 H52 K4 O28 -","4","1","SX1073","Allen W. Apblett; Elizabeth M. Holt","Potassium methoxyacetate tetrahydrate","Acta Crystallographica Section C","1999","55","4","539","541","10.1107/S0108270198014395","","","0.71073","MoKα","","","0.049","","","","0.072","","","","","","1.42","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008433","7.513","0.001","12.74","0.002","8.68","0.001","90","","95.67","0.02","90","","826.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Patassium (μ-oxo) [(oxalato)-oxomolybdate] monohydrate","","- C2 H2 K2 Mo O8 -","- C2 K2 Mo O8 -","- C8 K8 Mo4 O32 -","4","1","TA1220","Xing, Yong-Heng; Wang, Zuo; Xu, Ji-Qing; Li, Dong-Mei; Wang, Ren-Zhang; Bu, Wei-Ming; Ye, Ling; Xing Yan; Yong-Hua Lin; Heng-Qing Jia","K~2~[MoO~3~(C~2~O~4~)]^.^H~2~O","Acta Crystallographica Section C","1999","55","4","521","523","10.1107/S0108270198014851","","","0.71073","MoKα","","0.0378","0.0358","","0.1049","0.1034","","","","1.099","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008434","19.3111","0.0012","7.5851","0.0004","15.514","0.0008","90","","90","","90","","2272.4","0.2","298","","298","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- H4 Mo4 O15 Sr -","- H4 Mo4 O15 Sr -","- H32 Mo32 O120 Sr8 -","8","1","TA1224","Harrison, William T. A.","Strontium tetramolybdate dihydrate, SrMo~4~O~13~^.^2H~2~O","Acta Crystallographica Section C","1999","55","4","485","487","10.1107/S0108270198013602","","","0.71073","MoKα","","","0.031","","","0.022","","","","","1.049","1.049","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008435","14.671","0.004","15.135","0.002","9.328","0.002","90","","90","","90","","2071.2","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","4,5-dihydro-1,2,4-oxadiazole","Methyl (2S)-2-[(5R)-diphenyl-4,5-dihydro-1,2,4-oxadiazol-4-yl]-3-phenylpropanoate","","- C24 H22 N2 O3 -","- C24 H22 N2 O3 -","- C96 H88 N8 O12 -","4","1","TA1227","Xu, Jiaxi; Li, Xiaoyu; Wang, Zhemin; Yang, Qingchuan; Yan, Chunhua","Methyl (2<i>S</i>)-2-[(5<i>R</i>)-3,5-diphenyl-4,5-dihydro-1,2,4-oxadiazol-4-yl]-3-phenylpropanoate","Acta Crystallographica Section C","1999","55","4","650","652","10.1107/S0108270198015492","","","0.71073","MoKα","","0.0762","0.0549","","","","0.1228","","","","","","1.096","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008436","7.359","0.003","7.873","0.003","16.098","0.004","90","0.01","96","0.02","90","0.01","927.6","0.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","2'-Tosyl adenosine","","- C17 H19 N5 O6 S -","- C17 H19 N5 O6 S -","- C34 H38 N10 O12 S2 -","2","1","VJ1090","D. Prahadeeswaran; T. P. Seshadri","2'-<i>O</i>-Tosyladenosine","Acta Crystallographica Section C","1999","55","4","606","608","10.1107/S0108270198015236","","","1.5418","CuKα","","0.0573","0.0565","","0.1371","0.1356","","","","1.086","1.091","1.091","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008437","9.412","0.002","6.914","0.001","14.667","0.002","90","0.01","102.89","0.02","90","0.02","930.4","0.3","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N^6^Anisoyl Adenosine Monohydrate","","- C18 H21 N5 O7 -","- C18 H21 N5 O7 -","- C36 H42 N10 O14 -","2","1","VJ1092","S. Kolappan; T. P. Seshadri","<i>N</i>^6^-Anisoyladenosine monohydrate","Acta Crystallographica Section C","1999","55","4","603","604","10.1107/S0108270198015248","","","1.5418","CuKα","","0.0371","0.0356","","0.1048","0.1021","","","","1.013","1.009","1.009","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008438","14.202","0.002","5.737","0.003","33.319","0.005","90","0.02","92.93","0.02","90","0.03","2711.2","1.5","293","2","293","2","","","","","","","","4","P 1 2 1","P 2y","3","","N^3^,2',3'-Tri-O-Benzoyluridine","","- C30 H24 N2 O9 -","- C30 H24 N2 O9 -","- C120 H96 N8 O36 -","4","2","VJ1093","S. Kolappan; T. P. Seshadri","<i>N</i>^3^-Benzoyl-2',3'-di-<i>O</i>-benzoyluridine","Acta Crystallographica Section C","1999","55","4","604","606","10.1107/S0108270198015224","","","1.5418","CuKα","","0.0632","0.0407","","0.157","0.1174","","","","1.03","1.055","1.055","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008439","9.2989","0.0007","14.057","0.001","3.6066","0.0003","90","","90","","90","","471.44","0.06","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","4-NRTZ","4-nitramino-1,2,4-triazole","","- C2 H3 N5 O2 -","- C2 H3 N5 O2 -","- C8 H12 N20 O8 -","4","1","AV1027","Vasiliev, Alexander D.; Astachov, Alexander M.; Stepanov, Rudolf S.; Kirik, Sergei D.","4-Nitramino-1,2,4-triazole","Acta Crystallographica Section C","1999","55","5","830","832","10.1107/S0108270199002243","","","1.5418","CuKα","","0.028","0.027","","","","0.073","","","","","","1.096","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008440","20.652","0.002","8.8934","0.0006","7.5917","0.0005","90","","90","","90","","1394.34","0.19","297","","273","","","","","","","","","5","A b a 2","A 2 -2ab","41","cadmium isopropylxanthate","cadmium(II) bis-(O-isopropyldithiocarbonate)","","- C8 H14 Cd O2 S4 -","- C8 H14 Cd0.5 O2 S4 -","- C32 H56 Cd2 O8 S16 -","4","","BK1413","Tomlin, David W.; Cooper, Thomas M.; Zelmon, David E.; Gebeyehu, Zewdu; Hughes, John M.","Cadmium isopropylxanthate","Acta Crystallographica Section C","1999","55","5","717","719","10.1107/S010827019801823X","","","0.7107","MoKα","","0.025","0.025","","","0.034","","","","1.27","1.27","1.27","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008441","13.2852","0.0004","11.4419","0.0003","13.5434","0.0004","90","","98.438","0.002","90","","2036.42","0.1","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H29 N O4 -","- C22 H29 N O4 -","- C88 H116 N4 O16 -","4","1","BK1450","Thuéry, Pierre; Nierlich, Martine; Wang, Zhen-He; Hirose, Takuji","Imide and tribenzyl ester derivatives of Kemp's triacid","Acta Crystallographica Section C","1999","55","5","808","811","10.1107/S0108270198018241","","","0.71073","MoKα","","0.068","0.047","","0.123","0.105","","","","1.066","1.073","1.073","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008442","9.1757","0.0004","13.1247","0.0006","18.6567","0.0009","90","","97.412","0.003","90","","2228.02","0.18","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H33 N O5 -","- C23 H33 N O5 -","- C92 H132 N4 O20 -","4","1","BK1450","Thuéry, Pierre; Nierlich, Martine; Wang, Zhen-He; Hirose, Takuji","Imide and tribenzyl ester derivatives of Kemp's triacid","Acta Crystallographica Section C","1999","55","5","808","811","10.1107/S0108270198018241","","","0.71073","MoKα","","0.097","0.059","","0.162","0.125","","","","1.083","1.064","1.064","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008443","14.5445","0.0005","9.668","0.0002","19.8101","0.0007","90","","90.186","0.001","90","","2785.61","0.15","123","2","123","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C33 H36 O6 -","- C33 H36 O6 -","- C132 H144 O24 -","4","1","BK1450","Thuéry, Pierre; Nierlich, Martine; Wang, Zhen-He; Hirose, Takuji","Imide and tribenzyl ester derivatives of Kemp's triacid","Acta Crystallographica Section C","1999","55","5","808","811","10.1107/S0108270198018241","","","0.71073","MoKα","","0.063","0.044","","0.115","0.099","","","","1.032","1.046","1.046","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008444","7.669","0.005","12.402","0.008","27.204","0.007","90","","90","","90","","2587","2","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C16 H14 O4 -","- C16 H14 O4 -","- C128 H112 O32 -","8","1","BM1292","K. Rajalakshmi; Niveta Jain; S. Deepthi; H.G. Krishnamurthy; Vasantha Pattabhi","7-Hydroxy-4-(4-methoxyphenyl)-3,4-dihydrocoumarin","Acta Crystallographica Section C","1999","55","5","813","815","10.1107/S0108270198016072","","","1.5418","CuKα","","0.0749","0.0699","","0.2033","0.1918","","","","1.077","1.114","1.114","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008445","7.3239","0.0014","9.8199","0.0014","13.738","0.003","90","","90","","90","","988","0.3","143","2","143","2","","","","","","","","5","P n a 21","P 2c -2n","33","","1,2,4-Triazolium Di(methanesulfonyl)amidate","","- C4 H10 N4 O4 S2 -","- C4 H10 N4 O4 S2 -","- C16 H40 N16 O16 S8 -","4","1","BM1307","Moers, Oliver; Wijaya, Karna; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. CIX. 1,2,4-Triazolium di(methanesulfonyl)amidate","Acta Crystallographica Section C","1999","55","5","754","756","10.1107/S0108270199000426","","","0.71073","MoKα","","0.0204","0.0199","","","","0.0549","","","","","","1.068","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008446","7.4177","0.0008","21.393","0.002","9.2734","0.001","90","","101.766","0.008","90","","1440.6","0.3","173","2","173","2","","","","","","","","3","C 1 c 1","C -2yc","9","","4-(2'-furyl)[2.2]paracyclophane","","- C20 H18 O -","- C20 H18 O -","- C80 H72 O4 -","4","1","BM1314","Dix, Ina; Hopf, Henning; Jones, Peter G.","Heterocycle-substituted [2.2]paracyclophanes","Acta Crystallographica Section C","1999","55","5","756","759","10.1107/S0108270199001808","","","0.71073","MoKα","","0.0536","0.0478","","","","0.1254","","","","","","1.062","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008447","16.85","0.002","7.6203","0.001","11.574","0.002","90","","95.523","0.011","90","","1479.2","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-(2'-thienyl)[2.2]paracyclophane","","- C20 H18 S -","- C20 H18 S -","- C80 H72 S4 -","4","1","BM1314","Dix, Ina; Hopf, Henning; Jones, Peter G.","Heterocycle-substituted [2.2]paracyclophanes","Acta Crystallographica Section C","1999","55","5","756","759","10.1107/S0108270199001808","","","0.71073","MoKα","","0.0708","0.0378","","","","0.0841","","","","","","0.862","","","","has coordinates,has disorder","301791","2025-08-18","23:15:32",""
"2008448","8.958","0.005","13.258","0.007","14.769","0.008","71.61","0.05","88.37","0.04","70.53","0.04","1563.5","1.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","5,9,14,18-N-(2,3,6,8,11,12,15,17-octamethyl-5,9,14,18- tetraazadibenzo-[a,h]-tetraazacyclotetradecene)- dichlorozirconium(IV) tetrahydrofuran solvate(1/0.5)","","- C28 H34 Cl2 N4 O0.5 Zr -","- C28 H34 Cl2 N4 O0.5 Zr -","- C56 H68 Cl4 N8 O Zr2 -","2","1","CF1287","Corden, Jonathan P; Errington, William; Moore, Peter; Wallbridge, Malcolm G H","Dichloro(2,3,6,8,11,12,15,17-octamethyl-5,9,14,18-tetraazadibenzo[<i>a</i>,<i>h</i>]cyclotetradecene-κ^4^<i>N</i>)zirconium(IV) tetrahydrofuran hemisolvate","Acta Crystallographica Section C","1999","55","5","706","707","10.1107/S0108270198018010","","","0.71073","MoKα","","0.123","0.051","","","","0.117","","","","","","0.709","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2008449","16.234","0.003","11.017","0.002","7.1954","0.0014","90","","93.15","0.03","90","","1285","0.4","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-(3-pyridyl)4-p-tolyl-1,2,4-oxadiazoline-5-thione","","- C14 H11 N3 O S -","- C14 H11 N3 O S -","- C56 H44 N12 O4 S4 -","4","1","DA1041","Billodeaux, Damon R.; Fronczek, Frank R.; Dürüşt, Yas̨ar","Two novel 3,4-disubstituted 1,2,4-oxadiazole-5(4<i>H</i>)-thiones","Acta Crystallographica Section C","1999","55","5","761","764","10.1107/S0108270199000475","","","1.54184","CuKα","","0.091","0.07","","0.201","0.169","","","","1.069","1.088","1.088","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008450","7.728","0.001","8.826","0.002","9.3699","0.0009","112.89","0.01","112.029","0.009","94.84","0.01","525.57","0.16","100","","100","","","","","","","","","5","P -1","-P 1","2","","3-(2-pyridyl)-4-n-propyl-1,2,4-oxadiazoline-5-thione","","- C10 H11 N3 O S -","- C10 H11 N3 O S -","- C20 H22 N6 O2 S2 -","2","1","DA1041","Billodeaux, Damon R.; Fronczek, Frank R.; Dürüşt, Yas̨ar","Two novel 3,4-disubstituted 1,2,4-oxadiazole-5(4<i>H</i>)-thiones","Acta Crystallographica Section C","1999","55","5","761","764","10.1107/S0108270199000475","","","0.71073","MoKα","","0.05","0.044","","0.058","0.058","","","","","1.955","1.955","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008451","12.105","0.003","12.105","0.003","5.776","0.003","90","","90","","90","","846.4","0.5","293","2","293","2","","","","","","","","4","P 43","P 4cw","78","","2-amino-4-phenylthiazole","","- C9 H8 N2 S -","- C9 H8 N2 S -","- C36 H32 N8 S4 -","4","1","DA1045","Au-Alvarez, Oscar; Peterson, Ronald C.; Crespo, Alexis Acosta; Esteva, Yolanda Rodríguez; Alvarez, Heidy Marquez; Stiven, Ana M. Plutín; Hernández, Ramón Pomés","2-Amino-4-phenylthiazole","Acta Crystallographica Section C","1999","55","5","821","823","10.1107/S0108270199001961","","","0.71073","MoKα","","0.066","0.042","","","","0.105","","","","","","1.072","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008452","10.068","0.003","10.068","0.003","16.728","0.006","90","","90","","120","","1468.5","0.8","293","2","293","2","","","","","","","","6","P 3 1 c","P 3 -2c","159","","","","- C24 H27 Cl2 Mn N7 O8 -","- C24 H27 Cl2 Mn N7 O8 -","- C48 H54 Cl4 Mn2 N14 O16 -","2","0.333333","DA1054","Qian, Ming; Gou, Shao-Hua; He, Ling; Zhou, Yu-Ming; Duan, Chun-Ying","[Tris(2-pyridyl-κ<i>N</i>-methyleneamino-κ<i>N</i>-ethyl)amine-κ<i>N</i>]manganese(II) diperchlorate","Acta Crystallographica Section C","1999","55","5","742","744","10.1107/S0108270198017624","","","0.71073","MoKα","","0.0844","0.0516","","0.1267","0.1165","","","","1.052","1.244","1.244","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008453","7.1325","0.0006","9.7959","0.0008","12.3235","0.0008","74.082","0.006","81.086","0.006","86.242","0.007","817.78","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H14 Cl2 O Ti -","- C18 H14 Cl2 O Ti -","- C36 H28 Cl4 O2 Ti2 -","2","1","FG1495","Bu, Weiming; Wang, Jianhui; Ye, Ling; Mu, Ying; Yang, Guangdi; Fan, Yuguo","Dichloro{2-[(η^5^-cyclopentadienyl)phenylmethyl]phenolato-<i>O</i>}titanium","Acta Crystallographica Section C","1999","55","5","728","730","10.1107/S0108270198015479","","","0.71073","MoKα","","0.0562","0.0421","","0.0707","0.0615","","","","1.105","1.189","1.189","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008454","11.5121","0.0003","8.5186","0.0003","20.4454","0.0007","90","","100.768","0.002","90","","1969.71","0.11","150","0.1","150","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Dibenzo[b,f]azepin-2-one","","- C14 H9 N O -","- C14 H9 N O -","- C112 H72 N8 O8 -","8","1","FG1517","Ruane, Patrick H.; McClelland, Robert A.; Lough, Alan J.","2<i>H</i>-Dibenzo[<i>b</i>,<i>f</i>]azepin-2-one","Acta Crystallographica Section C","1999","55","5","819","821","10.1107/S0108270198016357","","","0.71073","MoKα","","0.046","0.038","","","","0.099","","","","","","1.035","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008455","10.2782","0.0001","11.4269","0.0002","13.5079","0.0002","96.11","0.01","99.224","0.001","113.462","0.001","1410.87","0.06","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","6,11-Dihydroxy-1,4-methano-1,4,4a-tetrahydronaphthacene-5,12-dione","","- C19 H14 O4 -","- C19 H14 O4 -","- C76 H56 O16 -","4","2","FR1163","Kandasamy Chinnakali; Hoong-Kun Fun; Dipakranjan Mal; Sujit Kumar Ghorai; Nirmal Kumar Hazra; Gur Dayal Nigam","6,11-Dihydroxy-1,4-methano-1,4,4a,12a-tetrahydronaphthacene-5,12-dione","Acta Crystallographica Section C","1999","55","5","776","778","10.1107/S0108270199000657","","","0.71073","MoKα","","0.1033","0.0609","","","","0.1499","","","","","","1.079","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008456","9.063","0.001","16.543","0.002","8.46","0.001","90","","83.11","0.01","90","","1259.2","0.3","295","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 Cl F N2 O2 -","- C13 H10 Cl F N2 O2 -","- C52 H40 Cl4 F4 N8 O8 -","4","1","FR1168","Candan, M. Murat; Kendi, Engin; Göker, Hakan","4-Chloro-<i>N</i>-(<i>p</i>-fluorobenzyl)-2-nitroaniline","Acta Crystallographica Section C","1999","55","5","825","827","10.1107/S0108270199001456","","","0.71069","MoKα","","","0.039","","","0.046","","","","","0.97","0.97","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008457","13.887","0.001","7.162","0.001","32.124","0.003","90","","90","","90","","3195","0.6","153","2","153","2","","","","","","","","4","P n a 21","P 2c -2n","33","","2-[3-(tosyloxy)-propoxy]benzaldehyde","","- C17 H18 O5 S -","- C17 H18 O5 S -","- C136 H144 O40 S8 -","8","2","FR1170","Jene, Paul G.; Chan, David S.; Cooke, Bethany L.; Ibers, James A.","Capped-porphyrin precursors","Acta Crystallographica Section C","1999","55","5","801","806","10.1107/S0108270198018034","","","0.71073","MoKα","","0.089","0.049","","","","0.11","","","","","","0.91","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008458","8.532","0.001","9.576","0.001","9.953","0.001","76.679","0.001","84.054","0.001","70.29","0.001","744.65","0.14","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","2-[3-(Tosyloxy)ethoxy]benzaldehyde","","- C16 H16 O5 S -","- C16 H16 O5 S -","- C32 H32 O10 S2 -","2","1","FR1170","Jene, Paul G.; Chan, David S.; Cooke, Bethany L.; Ibers, James A.","Capped-porphyrin precursors","Acta Crystallographica Section C","1999","55","5","801","806","10.1107/S0108270198018034","","","0.71073","MoKα","","0.055","0.041","","","","0.11","","","","","","1.41","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008459","14.415","0.001","6.693","0.001","31.692","0.002","90","","90","","90","","3057.6","0.5","153","2","153","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","2-[3-(Tosyloxy)-ethoxy]benzaldehyde hemihydrate","","- C16 H17 O5.5 S -","- C16 H17 O5.5 S -","- C128 H136 O44 S8 -","8","1","FR1170","Jene, Paul G.; Chan, David S.; Cooke, Bethany L.; Ibers, James A.","Capped-porphyrin precursors","Acta Crystallographica Section C","1999","55","5","801","806","10.1107/S0108270198018034","","","0.71073","MoKα","","0.07","0.043","","","","0.097","","","","","","1.13","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008460","7.685","0.001","9.042","0.001","32.071","0.003","90","","93.46","0.01","90","","2224.5","0.4","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,2,4,5-Tetrakis{3-[2-(1,3-dioxolan-2-yl)phenoxy]propoxy}-benzene","","- C50 H54 O16 -","- C50 H54 O16 -","- C100 H108 O32 -","2","0.5","FR1170","Jene, Paul G.; Chan, David S.; Cooke, Bethany L.; Ibers, James A.","Capped-porphyrin precursors","Acta Crystallographica Section C","1999","55","5","801","806","10.1107/S0108270198018034","","","0.71073","MoKα","","0.089","0.042","","","","0.092","","","","","","0.88","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008461","12.148","0.002","24.682","0.002","8.021","0.002","90","","90","","90","","2405","0.7","296","","296","","","","","","","","","3","P b c a","-P 2ac 2ab","61","3-[2-(1,3-dioxolan-2-yl)ethyl]-2-methylbenzoic acid","","","- C13 H16 O4 -","- C13 H16 O4 -","- C104 H128 O32 -","8","1","FR1181","Gerkin, Roger E.","3-[2-(1,3-Dioxolan-2-yl)ethyl]-2-methylbenzoic acid","Acta Crystallographica Section C","1999","55","5","798","801","10.1107/S0108270199000128","","","0.71073","MoKα","","","0.065","","","0.077","","","","","1.42","1.42","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008462","18.6342","0.0019","11.1941","0.0008","34.734","0.002","90","","99.188","0.009","90","","7152.3","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Trinitrato-bis[N-(2-pyridinylmethylene)-N'-benzoyl-hydrazino]cerium(III) acetone dihydrate","","- C29 H32 Ce N9 O14 -","- C29.5 H28 Ce N8.5 O14 -","- C236 H224 Ce8 N68 O112 -","8","2","GD1012","Christidis, Panayiotis C.; Tossidis, Ioannis A.; Paschalidis, Damianos G.","Bis[<i>N</i>-benzoyl-<i>N</i>'-(2-pyridylmethylene)hydrazine]trinitratocerium(III) acetone dihydrate","Acta Crystallographica Section C","1999","55","5","707","710","10.1107/S0108270199000438","","","0.7107","MoKα","","0.1077","0.0462","","","","0.1162","","","","","","0.945","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008463","12.369","0.001","12.998","0.001","13.39","0.001","63.54","0.01","88.97","0.01","79.89","0.01","1892.9","0.3","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","N-[2,3-dihydro-4-(2,5-Dimethoxyphenyl)thiazol-2-ylidene]-2,4- dichlorobenzenesulfonamide.","","- C17 H14 Cl2 N2 O4 S2 -","- C17 H14 Cl2 N2 O4 S2 -","- C68 H56 Cl8 N8 O16 S8 -","4","2","GS1030","Beuchet, Pierre; Léger, Jean-Michel; Varache-Lembége, Martine; Nuhrich, Alain","Tautomerism in a 2,4-dichlorobenzenesulfonamide derived from 2-amino-4-(2,5-dimethoxyphenyl)thiazole","Acta Crystallographica Section C","1999","55","5","791","794","10.1107/S0108270198017922","","","1.54178","CuKα","","0.07","0.041","","0.101","0.134","","","","1.043","1.088","1.088","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008465","9.033","0.001","11.081","0.001","13.447","0.001","90","","90","","90","","1346","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(E)-3-(Benzoylmethylene)-N-methyl isoindolin-1-one","(E)-3-(Benzoylmethylene)-N-methyl isoindolin-1-one","","- C17 H13 N O2 -","- C17 H13 N O2 -","- C68 H52 N4 O8 -","4","1","HA1246","Guha, Subhadra; Mukherjee, Alok K.; Khan, M. Wahab; Kundu, Nitya G.","(<i>E</i>)-3-(Benzoylmethylene)-<i>N</i>-methylisoindolin-1-one","Acta Crystallographica Section C","1999","55","5","818","819","10.1107/S0108270198018393","","","0.71073","MoKα","","0.069","0.04","","0.104","0.096","","","","0.863","0.968","0.968","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008466","11.245","0.002","11.752","0.002","14.476","0.005","90","","90","","90","","1913","0.8","150","1","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1'R, 2'R)-3-[(cis-2'-Cyclohexylmethylcyclopentyl)imino]-2-azabicyclo[2.2.2] octan-HBr","","- C19 H33 Br N2 -","- C19 H33 Br N2 -","- C76 H132 Br4 N8 -","4","1","JZ1314","Hartmann, Susanne; Weckert, Edgar; Frahm, August W.","(1'<i>R</i>,2'<i>R</i>)-3-[(<i>cis</i>-2'-Cyclohexylmethylcyclopentyl)imino]-2-azabicyclo[2.2.2]octane hydrobromide, a hypoglycaemic semicyclic amidine","Acta Crystallographica Section C","1999","55","5","806","808","10.1107/S0108270199000402","","","0.71069","MoKα","","0.0196","0.0195","","","","0.0512","","","","","","1.102","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008467","12.106","0.002","6.831","0.001","13.411","0.003","90","","116.74","0.03","90","","990.4","0.4","173","2","173","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Diaquahydrogen(1+) hexachloroantimonat","","","- Cl6 H5 O2 Sb -","- Cl6 H5 O2 Sb -","- Cl24 H20 O8 Sb4 -","4","0.5","JZ1325","Minkwitz, Rolf; Hirsch, Claudia","Tieftemperaturstruktur von diaquahydrogen(1+) hexachloroantimonat, H~5~O~2~^+^^.^SbCl~6~^{-^}","Acta Crystallographica Section C","1999","55","5","703","705","10.1107/S0108270198018058","","","0.71069","MoKα","","0.065","0.034","","0.064","0.058","","","","0.995","1.074","1.074","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008468","6.914","0.003","9.48","0.007","13.644","0.004","102.9","0.04","90.3","0.03","106.85","0.05","831.9","0.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","dimethyl (Z)-2-[1-methyl-2-(p-tolyl)-4,5-dihydro-1H-pyrrol-3- yl]but-2-enedioate","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C36 H42 N2 O8 -","2","1","JZ1327","Zellmer, Dirk; Niewa, Rainer; Kreher, Richard P.","A functionalized dimethyl maleate (maleic acid dimethyl ester)","Acta Crystallographica Section C","1999","55","5","823","825","10.1107/S0108270199000852","","","0.71069","MoKα","","0.153","0.054","","","","0.142","","","","","","1.09","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008469","4.8112","0.0007","4.8112","0.0007","23.302","0.005","90","","90","","120","","467.12","0.14","173","2","173","2","","","","","","","","4","R -3 :H","-R 3","148","","barium dinickel(II) bis(phosphate)","","- Ba Ni2 O8 P2 -","- Ba Ni2 O8 P2 -","- Ba3 Ni6 O24 P6 -","3","0.166667","JZ1337","El-Bali, Brahim; Bolte, Michael; Boukhari, Ali; Aride, Jilali; Taibe, M'Hamed","BaNi~2~(PO~4~)~2~","Acta Crystallographica Section C","1999","55","5","701","702","10.1107/S0108270199000499","","","0.71073","MoKα","","0.039","0.039","","","","0.099","","","","","","1.167","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008470","12.0311","0.0016","24.574","0.003","8.9357","0.0011","90","","99.245","0.014","90","","2607.5","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7-oxa-bicyclo[2.2.1]heptane-2-exo,3-exo-dicarboxylato-(2,2'-bipyridine-N,N') manganese(II) 7-oxa-bicyclo[2.2.1]heptane-2-exo,3-exo-dicarboxylic acid monohydrate","","- C26 H28 Mn N2 O11 -","- C26 H28 Mn N2 O11 -","- C104 H112 Mn4 N8 O44 -","4","1","KA1307","Baumeister, Ute; Hartung, Helmut; Kaplonek, Roland","(2,2'-Bipyridine-<i>N</i>,<i>N</i>')(7-oxabicyclo[2.2.1]heptane-2-<i>exo</i>,3-<i>exo</i>-dicarboxylato-κ^3^<i>O</i>^2,3,7^)manganese(II)‒7-oxabicyclo[2.2.1]heptane-2-<i>exo</i>,3-<i>exo</i>-dicarboxylic acid‒water (1/1/1)","Acta Crystallographica Section C","1999","55","5","715","717","10.1107/S0108270198018095","","","0.71073","MoKα","","0.103","0.052","","","","0.123","","","","","","1.1","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008471","7.2842","0.0006","13.45","0.001","16.503","0.002","90","","90","","90","","1616.8","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","androst-4-ene-3,6,17-trione","Androst-4-ene-3,6,17-trione","","- C19 H24 O3 -","- C19 H24 O3 -","- C76 H96 O12 -","4","1","KA1312","Addlagatta Anthony; Mariusz Jaskólski; Ashwini Nangia","Androst-4-ene-3,6,17-trione","Acta Crystallographica Section C","1999","55","5","787","789","10.1107/S0108270199000517","","","1.54178","CuKα","","0.042","0.035","","","","0.101","","","","","","1.01","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008472","8.181","0.002","9.036","0.002","8.392","0.001","90","","90","","90","","620.4","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C4 H4 Ba O6 -","- C4 H4 Ba O6 -","- C16 H16 Ba4 O24 -","4","1","LN1069","González-Silgo, Cristina; González-Platas, Javier; Ruiz-Pérez, Catalina; López, Trinidad; Torres, Manuel","Barium <small>L</small>-tartrate","Acta Crystallographica Section C","1999","55","5","740","742","10.1107/S0108270198016709","","","0.71069","MoKα","","0.019","0.019","","0.048","","0.048","","","1.21","","","1.21","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008473","9.5461","0.0015","6.251","0.001","20.773","0.003","90","","98.008","0.004","90","","1227.5","0.3","160","2","160","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-benzyloxy-1[H]-phenyltetrazole","","- C14 H12 N4 O -","- C14 H12 N4 O -","- C56 H48 N16 O4 -","4","1","LN1073","Brigas, Amadeu F.; Clegg, William; Johnstone, Robert A.W.; Mendonca, Ricardo F.","5-Benzyloxy-1-phenyltetrazole: catalytic transfer hydrogenolysis of benzyl ethers","Acta Crystallographica Section C","1999","55","5","778","781","10.1107/S0108270199000141","","","0.71073","MoKα","","0.0902","0.0397","","","","0.0896","","","","","","0.91","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008474","14.276","0.003","15.29","0.003","19.807","0.004","90","","102.36","0.02","90","","4223.3","1.5","298","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","cis-chlorohydridotetrakis(triethylphosphine)iridium(III) bis(catecholato)borate","","- C36 H69 B Cl Ir O4 P4 -","- C36 H69 B Cl Ir O4 P4 -","- C144 H276 B4 Cl4 Ir4 O16 P16 -","4","1","LN1074","Clegg, William; Elsegood, Mark R.J.; Scott, Andrew J.; Marder, Todd B.; Dai, Chaoyang; Norman, Nicholas C.; Pickett, Nigel L.; Robins, Edward G.","Salts of the bis(catecholato)borate anion with rhodium‒ and iridium‒phosphine complex cations","Acta Crystallographica Section C","1999","55","5","733","739","10.1107/S0108270199000323","","","0.71073","MoKα","","0.05","0.0289","","","","0.0796","","","","","","1.02","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008475","12.5401","0.0008","13.5374","0.0009","16.931","0.0011","91.937","0.002","97.051","0.002","90.121","0.002","2850.8","0.3","160","2","160","2","","","","","","","","7","P -1","-P 1","2","","trans-chlorohydridobis(1,2-bis(diphenylphosphino)ethane)rhodium(III) bis(catecholato)borate dichloromethane solvate","","- C65 H59 B Cl3 O4 P4 Rh -","- C65 H59 B Cl3 O4 P4 Rh -","- C130 H118 B2 Cl6 O8 P8 Rh2 -","2","1","LN1074","Clegg, William; Elsegood, Mark R.J.; Scott, Andrew J.; Marder, Todd B.; Dai, Chaoyang; Norman, Nicholas C.; Pickett, Nigel L.; Robins, Edward G.","Salts of the bis(catecholato)borate anion with rhodium‒ and iridium‒phosphine complex cations","Acta Crystallographica Section C","1999","55","5","733","739","10.1107/S0108270199000323","","","0.71073","MoKα","","0.0591","0.0461","","","","0.1041","","","","","","1.139","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008476","13.932","0.0008","21.2938","0.001","25.5613","0.0014","90","","90","","90","","7583.1","0.7","160","2","160","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","trans-chlorohydridobis(1,2-bis(dicyclohexylphosphino)ethane)rhodium(III) bis(catecholato)borate dichloromethane tetrasolvate","","- C68 H113 B Cl9 O4 P4 Rh -","- C68 H113 B Cl9 O4 P4 Rh -","- C272 H452 B4 Cl36 O16 P16 Rh4 -","4","1","LN1074","Clegg, William; Elsegood, Mark R.J.; Scott, Andrew J.; Marder, Todd B.; Dai, Chaoyang; Norman, Nicholas C.; Pickett, Nigel L.; Robins, Edward G.","Salts of the bis(catecholato)borate anion with rhodium‒ and iridium‒phosphine complex cations","Acta Crystallographica Section C","1999","55","5","733","739","10.1107/S0108270199000323","","","0.71073","MoKα","","0.0993","0.0858","","","","0.1783","","","","","","1.381","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008477","9.7315","0.0009","29.559","0.003","10.8716","0.001","90","","102.541","0.002","90","","3052.6","0.5","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","tetrakis(trimethylphosphine)rhodium(I) bis(catecholato)borate","","- C24 H44 B O4 P4 Rh -","- C24 H44 B O4 P4 Rh -","- C96 H176 B4 O16 P16 Rh4 -","4","1","LN1074","Clegg, William; Elsegood, Mark R.J.; Scott, Andrew J.; Marder, Todd B.; Dai, Chaoyang; Norman, Nicholas C.; Pickett, Nigel L.; Robins, Edward G.","Salts of the bis(catecholato)borate anion with rhodium– and iridium–phosphine complex cations","Acta Crystallographica Section C","1999","55","5","733","739","10.1107/S0108270199000323","","","0.71073","MoKα","","0.0609","0.0365","","","","0.0815","","","","","","1.053","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008478","13.4442","0.0007","18.7746","0.001","24.5809","0.0012","90","","90","","90","","6204.5","0.6","160","2","160","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","cis-dihydridotetrakis(trimethylphosphine)rhodium(III) bis(catecholato)borate","","- C24 H46 B O4 P4 Rh -","- C24 H46 B O4 P4 Rh -","- C192 H368 B8 O32 P32 Rh8 -","8","1","LN1074","Clegg, William; Elsegood, Mark R.J.; Scott, Andrew J.; Marder, Todd B.; Dai, Chaoyang; Norman, Nicholas C.; Pickett, Nigel L.; Robins, Edward G.","Salts of the bis(catecholato)borate anion with rhodium‒ and iridium‒phosphine complex cations","Acta Crystallographica Section C","1999","55","5","733","739","10.1107/S0108270199000323","","","0.71073","MoKα","","0.1043","0.0878","","","","0.1903","","","","","","1.448","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008479","10.387","0.001","10.248","0.001","13.857","0.003","90","","107.54","0.02","90","","1406.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 N2 O3 -","- C16 H14 N2 O3 -","- C64 H56 N8 O12 -","4","1","NA1384","Subramanian, E.; Renganayaki, S.; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun","<i>N</i>-Methyl-2'-nitrocinnamanilide","Acta Crystallographica Section C","1999","55","5","764","766","10.1107/S010827019801806X","","","0.71073","MoKα","","0.058","0.044","","0.124","0.113","","","","1.029","1.083","1.083","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008480","13.5557","0.0013","9.8241","0.0009","17.604","0.002","90","","90","","90","","2344.4","0.4","295","2","","","","","","","","","","5","P n a 21","P 2c -2n","33","","Dichloro(pentamethylcyclopentadienyl)(2,6-diisopropylaniline)rhodium(III)","","- C22 H34 Cl2 N Rh -","- C22 H34 Cl2 N Rh -","- C88 H136 Cl8 N4 Rh4 -","4","1","NA1385","Lee, Soon W.; Lee, Jae-Gyung","Dichloro(2,6-diisopropylaniline-<i>N</i>)(η^5^-pentamethylcyclopentadienyl)rhodium(III)","Acta Crystallographica Section C","1999","55","5","722","724","10.1107/S0108270198014693","","","0.71073","MoKα","","","0.0232","","","","0.0611","","","","","","1.083","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008481","12.336","0.001","13.447","0.001","20.024","0.001","75.44","0.01","88.71","0.01","63.8","0.01","2869.6","0.5","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","A W-Ag-Se Cluster Compound, (μ~3~-bromine)(μ~3~-tetraselenidotungstide)tris(triphenylphosphinesilver)- ethanol [(μ~3~-Br)(μ~3~-WSe~4~)(AgPPh~3~)~3~]^.^EtOH","","- C56 H51 Ag3 Br O P3 Se4 W -","- C56 H51 Ag3 Br O P3 Se4 W -","- C112 H102 Ag6 Br2 O2 P6 Se8 W2 -","2","1","NA1390","Zhang, Qianfeng; Xin, Xinquan; Hong, Maochun; Cao, Rong; S.Shanmuga Sundara Raj; Hoong-Kun Fun","A W‒Ag‒Se cluster compound: (μ~3~-bromo)(μ~3~-tetraselenidotungstide)tris(triphenylphosphinesilver) ethanol solvate, [(μ~3~-Br)(μ~3~-WSe~4~)(AgPPh~3~)~3~]^.^EtOH","Acta Crystallographica Section C","1999","55","5","726","728","10.1107/S0108270199000207","","","0.71073","MoKα","","0.055","0.041","","","","0.107","","","","","","1.038","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008482","14.084","0.005","14.047","0.005","10.402","0.005","90","0.005","93.463","0.005","90","0.005","2054.2","1.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[(N,N,N',N"",N""pentamethyldiethylenetriamine)iodoplatinum(II)] [tetraiodo-μ-,μ'-diiododiplatinate(II)]","","- C18 H46 I8 N6 Pt4 -","- C18 H46 I8 N6 Pt4 -","- C36 H92 I16 N12 Pt8 -","2","0.5","NA1394","Francesco P. Fanizzi; Francesco P. Intini; Luciana Maresca; Giovanni Natile; Concetta Pacifico","Bis[iodo(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''-pentamethyldiethylenetriamine-κ^3^<i>N</i>)platinum(II)] di-μ-iodo-bis[diiodoplatinate(II)]","Acta Crystallographica Section C","1999","55","5","712","714","10.1107/S010827019801693X","","","0.71069","MoKα","","","0.043","","","","0.079","","","","","","0.841","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008483","10.386","0.001","22.501","0.001","11.114","0.001","90","","110.08","0.03","90","","2439.4","0.6","298","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C15 H23 Cl5 N3 O P3 -","- C15 H23 Cl5 N3 O P3 -","- C60 H92 Cl20 N12 O4 P12 -","4","1","NA1395","Hökelek, Tuncer; Kılıç, Adem; Begeç, Saliha; Kılıç, Zeynel","2,4,4,6,6-Pentachloro-2-(2,6-di-<i>tert</i>-butyl-4-methylphenoxy)cyclo-2λ^5^,4λ^5^,6λ^5^-triphosphazatriene","Acta Crystallographica Section C","1999","55","5","783","785","10.1107/S0108270198016941","","","0.71073","MoKα","","","0.038","","","0.05","","","","","1.6","1.6","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008484","8.4481","0.0001","16.4652","0.0001","16.814","0.0002","104.33","0.001","97.886","0.001","92.943","0.001","2235.74","0.04","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,2-di(2-methoxyphenyl)-4-methyl-7,8,9,10-tetrahydro-8,9epoxy[2H]benzo [ 1,2-b]chromene","","- C28 H26 O4 -","- C28 H26 O4 -","- C112 H104 O16 -","4","2","NA1398","Chinnakali, Kandasamy; Fun, Hoong-Kun; Sriraghavan, Kamaraj; Ramakrishnan, Vayalakkavoor T.","2,2-Bis(2-methoxyphenyl)-4-methyl-8,9-epoxy-7,8,9,10-tetrahydro-2<i>H</i>-benzo[<i>h</i>]chromene","Acta Crystallographica Section C","1999","55","5","768","770","10.1107/S0108270198018071","","","0.71073","MoKα","","0.118","0.049","","","","0.138","","","","","","0.884","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008485","22.07","0.02","4.419","0.006","22.29","0.03","90","","127.18","0.08","90","","1732","4","293","","","","","","","","","","","5","C 1 2 1","C 2y","5","","(+)-(2R-cis)-10-Bromo-2,3,3a,8-tetrahydro- N,N-dimethyl-dibenz[c,f]isoxazolo[2,3-a]azepine-2-methanamine","","- C19 H21 Br N2 O -","- C19 H21 Br N2 O -","- C76 H84 Br4 N8 O4 -","4","1","NA1399","Oswald M. Peeters; Norbert M. Blaton; Camiel J. De Ranter; Hans L. De Winter","(+)-(2<i>R</i>-<i>cis</i>)-Dimethyl(10-bromo-2,3,3a,8-tetrahydrodibenz[<i>c</i>,<i>f</i>]isoxazolo[2,3-<i>a</i>]azepin-2-ylmethyl)amine","Acta Crystallographica Section C","1999","55","5","794","796","10.1107/S0108270199000219","","","0.71073","MoKα","","0.0633","0.0365","","0.0908","","0.0908","","","1.056","","","1.056","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008486","6.376","0.0001","18.121","0.0002","10.6546","0.0001","90","","107.408","0.0001","90","","1174.65","0.03","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 O3 -","- C16 H12 O3 -","- C64 H48 O12 -","4","1","","Chinnakali, Kandasamy; Fun, Hoong-Kun; Mal, Dipakranjan; Bandopadhyay, Mousumi; Datta, Kalyani; Nigam, Gur Dayal","5a,6,9,9a-Tetrahydro-4-hydroxy-6,9-methano-5H-fluoreno[2,3-b]furan-5-one and 5a,6,9,9a-tetrahydro-6,9-methano-4-methoxy-5H-fluoreno[2,3-b]furan-5-ol","Acta Crystallographica Section C","1999","55","","774","776","","","","","","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008487","9.8318","0.0001","9.9472","0.0002","14.2471","0.0003","73.852","0.008","86.554","0.009","78.916","0.001","1313.38","0.07","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","5,5a,6,9,9a-pentahydro-5-hydroxy-6,9-methano-4-methoxyfluoreno[ 2,3-d]furan","","- C17 H16 O3 -","- C17 H16 O3 -","- C68 H64 O12 -","4","2","NA1407","Chinnakali, Kandasamy; Fun, Hoong-Kun; Mal, Dipakranjan; Bandopadhyay, Mousumi; Datta, Kalyani; Nigam, Gur Dayal","5a,6,9,9a-Tetrahydro-4-hydroxy-6,9-methano-5<i>H</i>-fluoreno[2,3-<i>b</i>]furan-5-one and 5a,6,9,9a-tetrahydro-6,9-methano-4-methoxy-5<i>H</i>-fluoreno[2,3-<i>b</i>]furan-5-ol","Acta Crystallographica Section C","1999","55","5","774","776","10.1107/S0108270199001596","","","0.71073","MoKα","","0.142","0.058","","","","0.159","","","","","","0.906","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008488","10.762","0.002","10.96","0.002","7.16","0.001","100.76","0.01","97.53","0.01","115.33","0.01","728.5","0.2","298.2","","298.2","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H16 N4 O3 Pd -","- C15 H16 N4 O3 Pd -","- C30 H32 N8 O6 Pd2 -","2","1","OA1076","Tamura, Masana; Kajikawa, Yuji; Azuma, Nagao; Tani, Hiroyuki; Tajima, Kunihiko; Kanaori, Kenji; Makino, Keisuke; Takayama, Toshio","[1,3-Bis(pyridine-2-carboxamido)propane]palladium(II) monohydrate and its nickel(II) analogue","Acta Crystallographica Section C","1999","55","5","719","722","10.1107/S0108270198016412","","","0.7107","MoKα","","","0.032","","","","0.035","","","","","","1.57","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008489","7.183","0.002","9.307","0.003","11.326","0.003","90","","105.73","0.02","90","","728.8","0.4","298.2","","298.2","","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C15 H16 N4 Ni O3 -","- C14.5 H16 N4 Ni0.5 O2.5 -","- C29 H32 N8 Ni O5 -","2","0.5","OA1076","Tamura, Masana; Kajikawa, Yuji; Azuma, Nagao; Tani, Hiroyuki; Tajima, Kunihiko; Kanaori, Kenji; Makino, Keisuke; Takayama, Toshio","[1,3-Bis(pyridine-2-carboxamido)propane]palladium(II) monohydrate and its nickel(II) analogue","Acta Crystallographica Section C","1999","55","5","719","722","10.1107/S0108270198016412","","","0.7107","MoKα","","","0.043","","","","0.045","","","","","","1.674","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008490","7.145","0.004","32.419","0.009","5.142","0.002","90","","90","","90","","1191.1","0.9","298.2","","298.2","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","1,11-undecanediol","","","- C11 H24 O2 -","- C11 H24 O2 -","- C44 H96 O8 -","4","1","OB1004","Naotake Nakamura; Shigetaka Setodoi; Tatsuhiro Ikeya","1,11-Undecanediol","Acta Crystallographica Section C","1999","55","5","789","791","10.1107/S0108270198018253","","","1.5418","CuKα","","0.066","0.0499","","0.0771","0.07","","","","1.334","1.38","1.38","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008491","8.608","0.003","10.393","0.004","12.455","0.005","109.36","0.04","102.24","0.03","92.1","0.03","1020.4","0.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","10β-Hydroxy-6α-(3,4,5-trimethoxyphenyl)-2,3,6,6aα,7,9,9aβ,10- octahydroisobenzofuro[5,6-g][1,4]benzodioxin-7-one","","- C23 H24 O8 -","- C23 H24 O8 -","- C46 H48 O16 -","2","1","OS1046","A. Sergi Capilla; M. Dolors Pujol; Xavier Solans; Mercè Font-Bardia","10β-Hydroxy-6α-(3,4,5-trimethoxyphenyl)-2,3,6,6aα,7,9,9aβ,10-octahydroisobenzofuro[5,6-<i>g</i>][1,4]benzodioxin-7-one","Acta Crystallographica Section C","1999","55","5","786","787","10.1107/S0108270198017296","","","0.71069","MoKα","","0.067","0.057","","","","0.141","","","","","","1.044","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008492","7.6235","0.0015","7.9661","0.0016","7.9712","0.0016","106.71","0.03","108.96","0.03","95.64","0.03","428.6","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H16 Cl2 Cu N4 O8 -","- C12 H16 Cl2 Cu N4 O8 -","- C12 H16 Cl2 Cu N4 O8 -","1","0.5","QA0091","Huai-Ming Hu; De-Liang Long; Hui-Yi Zeng; Wen-Dan Cheng; Jin-Shun Huang","A redetermination of bis(2-aminomethylpyridine)diperchloratocopper(II)","Acta Crystallographica Section C","1999","55","5","IUC9900049","","10.1107/S0108270199099485","","","0.71073","MoKα","","0.054","0.036","","","","0.083","","","","","","1.048","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008493","14.06","0.0009","26.4879","0.0016","32.732","0.002","90","","90","","90","","12190","1.3","295","2","295","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Tris(1,3-diaminopropane-N,N')nickel(II) diperchlorate","Tris(1,3-diaminopropane-N,N')nickel(II) diperchlorate","","- C9 H30 Cl2 N6 Ni O8 -","- C9 H30 Cl2 N6 Ni O8 -","- C216 H720 Cl48 N144 Ni24 O192 -","24","3","QA0097","Olof Kristiansson","Tris(1,3-diaminopropane-<i>N</i>,<i>N</i>')nickel(II) diperchlorate","Acta Crystallographica Section C","1999","55","5","IUC9900038","","10.1107/S0108270199099539","","","0.71073","MoKα","","0.104","0.06","","","","0.195","","","","","","1.03","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008494","7.4603","0.0005","9.5852","0.0006","10.4734","0.0006","90","","106.713","0.005","90","","717.3","0.08","294","1","294","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","7-aminothiazolino[3,2a]pyrimidin-5-one","","- C6 H7 N3 O S -","- C6 H7 N3 O S -","- C24 H28 N12 O4 S4 -","4","1","QA0108","Low, John Nicolson; Ferguson, George; Melguizo, Manuel; Sanchez, Adolfo","7-Amino-2,3-dihydro-5<i>H</i>-thiazolo[3,2-<i>a</i>]pyrimidin-5-one","Acta Crystallographica Section C","1999","55","5","IUC9900048","","10.1107/S0108270199099461","","","0.71073","MoKα","","0.054","0.038","","","","0.127","","","","","","1.32","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008495","11.586","0.001","15.48","0.002","15.408","0.001","90","","103.436","0.008","90","","2687.8","0.5","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","5-Ethyl-2-phenyl-3-trifluoromethyl-1-(2,4,6-trichlorophenyl)-1H- 1,2,4-triazolium hexachloroantimonate","","- C17 H12 Cl9 F3 N3 Sb -","- C17 H12 Cl9 F3 N3 Sb -","- C68 H48 Cl36 F12 N12 Sb4 -","4","1","QA0110","Xian-Jun Liu; Yu-Bo Fan; Yi Liu; Quan-Rui Wang","5-Ethyl-2-phenyl-1-(2,4,6-trichlorophenyl)-3-trifluoromethyl-1<i>H</i>-1,2,4-triazolium hexachloroantimonate","Acta Crystallographica Section C","1999","55","5","IUC9900047","","10.1107/S0108270199099473","","","0.7107","MoKα","","","0.03","","","0.038","","","","","1.54","1.54","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008496","10.649","0.002","5.8777","0.0016","14.8257","0.0015","90","","107.705","0.01","90","","884","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","N,N'-dibenzenesulfonylputrescine","N-{4-[(benzenesulfonyl)amino]butyl}benzenesulfonamide","","- C16 H20 N2 O4 S2 -","- C16 H20 N2 O4 S2 -","- C32 H40 N4 O8 S4 -","2","0.5","QA0111","Linden, Anthony; Bienz, Stefan","<i>N</i>,<i>N</i>'-Dibenzenesulfonylputrescine","Acta Crystallographica Section C","1999","55","5","IUC9900046","","10.1107/S010827019909945X","","","0.71069","MoKα","","0.06","0.036","","","","0.105","","","","","","1.027","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008498","8.1864","0.0006","18.141","0.002","9.3307","0.0007","90","","103.662","0.006","90","","1346.5","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis{[2-(1,5-diazacyclooctane)methyl phenol]copper}-di(μ-(end-on)azide)","","- C26 H38 Cu2 N10 O2 -","- C26 H38 Cu2 N10 O2 -","- C52 H76 Cu4 N20 O4 -","2","0.5","QB0072","Weiming Bu; Ling Ye; Qiang Xu; Xianhe Bu; Guangdi Yang; Yuguo Fan","Bis(μ-azido-κ<i>N</i>^1^:κ<i>N</i>^1^)bis{[2-(1,5-diazacyclooct-1-yl-κ^2^<i>N</i>,<i>N</i>'-methyl)phenolato-κ<i>O</i>]copper(II)}","Acta Crystallographica Section C","1999","55","5","IUC9900044","","10.1107/S0108270199099515","","","0.71073","MoKα","","0.051","0.041","","0.065","0.05","","","","1.002","1.028","1.028","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008499","8.332","0.002","13.766","0.003","17.264","0.004","90","","90","0.03","90","","1980.2","0.8","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","Sodium hydrogen dichloro(ethylenediaminetetra-acetate) ruthenium(III) eneahydrate","","- C20 H47 Cl4 N4 Na O25 Ru2 -","- C20 H46 Cl4 N4 Na O25 Ru2 -","- C40 H92 Cl8 N8 Na2 O50 Ru4 -","2","1","QB0080","Stadler, Eduardo; Stadler, Carlos C.; Peixoto, Carlos R. de M.; Vencato, Ivo","Sodium hydrogen bis[dichloro(dihydrogen ethylenediaminetetraacetato-<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>')ruthenium(III)] nonahydrate","Acta Crystallographica Section C","1999","55","5","IUC9900051","","10.1107/S0108270199099503","","","0.71073","MoKα","","0.023","0.023","","","","0.062","","","","","","1.082","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008500","6.318","0.004","15.69","0.04","11.161","0.006","90","","103.48","0.05","90","","1076","3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","3β,4β-epoxy-7-oxo-7a-oxa-5β-cholanoic acid","","- C24 H36 O5 -","- C24 H36 O5 -","- C48 H72 O10 -","2","1","QB0082","Angel Dago Morales; Santiago García-Granda; Roxana Pérez Gil; Francisco Coll-Manchado","3β,4β-Epoxy-7-oxo-7a-oxa-7a-homo-5β-cholan-24-oic acid","Acta Crystallographica Section C","1999","55","5","IUC9900043","","10.1107/S0108270199099448","","","0.71073","MoKα","","0.107","0.053","","","","0.155","","","","","","1.034","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008501","10.361","0.01","13.044","0.01","18.806","0.006","90","","90","","90","","2542","3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(25R)-3β-Bromo-5α-spirostan-6,23-dione","","- C27 H39 Br O4 -","- C27 H39 Br O4 -","- C108 H156 Br4 O16 -","4","1","QB0083","Angel Dago Morales; Santiago García-Granda; Martín Andrés Iglesias-Arteaga; Francisco Coll-Manchado","(25<i>R</i>)-3β-Bromo-5α-spirostan-6,23-dione","Acta Crystallographica Section C","1999","55","5","IUC9900042","","10.1107/S0108270199099436","","","0.71073","MoKα","","0.305","0.041","","","","0.107","","","","","","0.929","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:32",""
"2008502","6.001","0.003","12.107","0.004","22.995","0.005","90","","90","","90","","1670.7","1.1","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S,S)-Ferrocenyl[methyl(1-phenyl-ethyl)amino]acetonitrile","","- C21 H22 Fe N2 -","- C21 H22 Fe N2 -","- C84 H88 Fe4 N8 -","4","1","QB0089","Howell, James A. S.; Humphries, Kristina; McArdle, Patrick; Cunningham, Desmond; Walsh, Martin; Daly, Pearl","(<i>S</i>,<i>S</i>)-Ferrocenyl[methyl(1-phenylethyl)amino]acetonitrile","Acta Crystallographica Section C","1999","55","5","IUC9900050","","10.1107/S0108270199099497","","","0.5","synchrotron","","0.032","0.029","","","","0.074","","","","","","1.004","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008503","20.62","0.006","13.147","0.004","9.601","0.005","90","","101.14","0.03","90","","2553.7","1.7","293","2","294","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H12 Cl N3 O2 -","- C13 H12 Cl N3 O2 -","- C104 H96 Cl8 N24 O16 -","8","1","QB0090","Benakli, K.; Crozet, M. P.; Vanelle, P.; Giorgi, M.","(<i>E</i>)-2-[2-(4-Chloromethylphenyl)vinyl]-1-methyl-5-nitro-1<i>H</i>-imidazole","Acta Crystallographica Section C","1999","55","5","IUC9900041","","10.1107/S0108270199099424","","","0.71073","MoKα","","0.084","0.051","","","","0.148","","","","","","1.063","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008504","11.337","0.002","9.96","0.002","11.423","0.002","90","","117.15","0.01","90","","1147.7","0.4","297","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","4,4-Dimethyltricyclo[6.3.0.0^1,7^]undecane-2,6-dione","","- C13 H18 O2 -","- C13 H18 O2 -","- C52 H72 O8 -","4","1","QB0094","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","<i>cis</i>-4,4-Dimethyltricyclo[6.3.0.0^1,7^]undecane-2,6-dione","Acta Crystallographica Section C","1999","55","5","IUC9900039","","10.1107/S0108270199099412","","","0.71073","MoKα","","","0.065","","","","0.076","","","","","","1.09","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008505","10.994","0.002","6.718","0.002","16.824","0.002","90","","102.59","0.01","90","","1212.7","0.4","297","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione","","- C12 H17 Br O2 -","- C12 H17 Br O2 -","- C48 H68 Br4 O8 -","4","1","QB0095","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","3-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (I), 5-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 3,5-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 1,7-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (IV)","Acta Crystallographica Section C","1999","55","5","IUC9900040","","10.1107/S0108270199099400","","","0.71073","MoKα","","","0.054","","","","0.069","","","","","","1.31","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008506","7.186","0.001","18.104","0.002","9.569","0.002","90","","97.34","0.02","90","","1234.7","0.3","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","5-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione","","- C12 H17 Br O2 -","- C12 H17 Br O2 -","- C48 H68 Br4 O8 -","4","1","QB0095","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","3-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (I), 5-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 3,5-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 1,7-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (IV)","Acta Crystallographica Section C","1999","55","5","IUC9900040","","10.1107/S0108270199099400","","","0.71073","MoKα","","","0.057","","","","0.074","","","","","","1.31","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008507","16.027","0.003","11.741","0.004","14.477","0.003","90","","102.56","0.01","90","","2659","1.2","298","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","3,5-Dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione","","- C12 H16 Br2 O2 -","- C12 H16 Br2 O2 -","- C96 H128 Br16 O16 -","8","1","QB0095","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","3-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (I), 5-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 3,5-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 1,7-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (IV)","Acta Crystallographica Section C","1999","55","5","IUC9900040","","10.1107/S0108270199099400","","","0.71073","MoKα","","","0.055","","","","0.085","","","","","","1.88","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008508","7.228","0.002","15.875","0.003","5.851","0.002","99.57","0.03","98.31","0.03","77.2","0.02","641.5","0.3","298","","","","","","","","","","","4","P -1","-P 1","2","","1,7-Dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione","","- C12 H16 Br2 O2 -","- C12 H16 Br2 O2 -","- C24 H32 Br4 O4 -","2","1","QB0095","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","3-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (I), 5-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 3,5-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 1,7-dibromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (IV)","Acta Crystallographica Section C","1999","55","5","IUC9900040","","10.1107/S0108270199099400","","","0.71073","MoKα","","","0.041","","","","0.055","","","","","","1.23","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008509","21.797","0.004","17.904","0.004","12.497","0.002","90","","112.59","0.03","90","","4502.8","1.8","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","aqua(2,2'-bipyrimidine-N,N')(2,6-di(2-pyridyl)-pyridineN,N',N'') dicopper(II) tetraperchlorate","","- C38 H30 Cl4 Cu2 N10 O17 -","- C38 H30 Cl4 Cu2 N10 O17 -","- C152 H120 Cl16 Cu8 N40 O68 -","4","0.5","SK1194","Francese, Giancarlo; Schmalle, Helmut W.; Decurtins, Silvio","A copper(II) dimer: aqua(μ-2,2'-bipyrimidine-<i>N</i>,<i>N</i>')(perchlorato)bis{[2,6-bis(2-pyridyl)pyridine-<i>N</i>,<i>N</i>',<i>N</i>'']copper(II)} triperchlorate","Acta Crystallographica Section C","1999","55","5","730","733","10.1107/S0108270199000530","","","0.71073","MoKα","","0.1036","0.0461","","","","0.1478","","","","","","1.029","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008510","12.9","0.002","18.135","0.002","21.822","0.004","90","","97.42","0.01","90","","5062.3","1.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-poly[triphenyltin-μ-(N,N-diethylthiocarbamoylthioacetato)-O:O']","","- C25 H27 N O2 S2 Sn -","- C25 H27 N O2 S2 Sn -","- C200 H216 N8 O16 S16 Sn8 -","8","2","SK1233","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng; Hook, James M.","<i>catena</i>-Poly[triphenyltin-μ-(<i>N</i>,<i>N</i>-diethylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')], <i>catena</i>-poly[triphenyltin-μ-(<i>N</i>-methyl-<i>N</i>-phenylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')] and triphenyl(<i>N</i>,<i>N</i>-tetramethylenethiocarbamoylthioacetato-<i>O</i>)tin","Acta Crystallographica Section C","1999","55","5","744","748","10.1107/S0108270199002954","","","0.71073","MoKα","","0.1","0.058","","","","0.166","","","","","","1.009","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008511","17.019","0.002","18.466","0.002","18.921","0.002","71.952","0.007","72.482","0.008","73.333","0.009","5267.3","1.1","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","catena-poly[(triphenyltin-μ-N-methyl-N-phenyldithiocarbamoylacetato)-O:O']","","- C28 H25 N O2 S2 Sn -","- C28 H25 N O2 S2 Sn -","- C224 H200 N8 O16 S16 Sn8 -","8","4","SK1233","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng; Hook, James M.","<i>catena</i>-Poly[triphenyltin-μ-(<i>N</i>,<i>N</i>-diethylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')], <i>catena</i>-poly[triphenyltin-μ-(<i>N</i>-methyl-<i>N</i>-phenylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')] and triphenyl(<i>N</i>,<i>N</i>-tetramethylenethiocarbamoylthioacetato-<i>O</i>)tin","Acta Crystallographica Section C","1999","55","5","744","748","10.1107/S0108270199002954","","","0.71073","MoKα","","0.097","0.052","","","","0.124","","","","","","1.002","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008512","9.7442","0.0003","9.8923","0.0005","13.3187","0.0004","107.064","0.004","95.246","0.003","97.153","0.004","1206.62","0.09","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","(N,N-tetramethylenethiocarbamoylthioacetato)triphenyltin","","- C25 H25 N O2 S2 Sn -","- C25 H25 N O2 S2 Sn -","- C50 H50 N2 O4 S4 Sn2 -","2","1","SK1233","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng; Hook, James M.","<i>catena</i>-Poly[triphenyltin-μ-(<i>N</i>,<i>N</i>-diethylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')], <i>catena</i>-poly[triphenyltin-μ-(<i>N</i>-methyl-<i>N</i>-phenylthiocarbamoylthioacetato-<i>O</i>:<i>O</i>')] and triphenyl(<i>N</i>,<i>N</i>-tetramethylenethiocarbamoylthioacetato-<i>O</i>)tin","Acta Crystallographica Section C","1999","55","5","744","748","10.1107/S0108270199002954","","","0.71073","MoKα","","0.024","0.021","","","","0.057","","","","","","1.003","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008513","7.654","0.002","11.578","0.002","17.771","0.003","90","","90","","90","","1574.8","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Polimeric (Aqua-1κO)bis[(R,R)-tartrato-1κ^2^O^1^,O^2^:2κ^2^O^3^,O^4^] dicadmium(II) Trihydrate","","- C8 H16 Cd2 O16 -","- C8 H8 Cd2 O16 -","- C32 H32 Cd8 O64 -","4","1","SK1241","González-Silgo, Cristina; González-Platas, Javier; Ruiz-Pérez, Catalina; López, Trinidad; Torres, Manuel Eulalio","Polymeric aqua-1κ<i>O</i>-bis[μ-(<i>R</i>,<i>R</i>)-tartrato-1κ^2^<i>O</i>^1^,<i>O</i>^2^:2κ^2^<i>O</i>^3^,<i>O</i>^4^]dicadmium(II) trihydrate","Acta Crystallographica Section C","1999","55","5","710","712","10.1107/S0108270199000542","","","0.71069","MoKα","","0.0285","0.028","","0.0717","","0.0717","","","1.204","","","1.204","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008514","6.8228","0.0001","7.1672","0.0002","31.9396","0.0006","90","","90","","90","","1561.86","0.06","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Pipemidic Acid Hydrochloride","","- C14 H18 Cl N5 O3 -","- C14 H18 Cl N5 O3 -","- C56 H72 Cl4 N20 O12 -","4","1","SK1259","Hoong-Kun Fun; Kandasamy Chinnakali; Ibrahim Abdul Razak; Shu-zhong Zhan; Chuan-jiang Hu; Qingjin Meng","Pipemidic acid hydrochloride","Acta Crystallographica Section C","1999","55","5","766","768","10.1107/S0108270198018277","","","0.71073","MoKα","","0.055","0.049","","","","0.13","","","","","","1.118","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008515","22.2132","0.0015","12.9986","0.0013","8.5456","0.0005","90","","96.107","0.005","90","","2453.5","0.3","294","1","294","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5,5,6-Triacetyl-5,6-diaminopyrimidine-2,4-(1H,3H)-dione","","- C10 H12 N4 O5 -","- C10 H12 N4 O5 -","- C80 H96 N32 O40 -","8","1","SK1260","Low, John Nicolson; Ferguson, George; Nogueras, Manuel; Sánchez, Adolfo; Cobo, Justo","6-Acetylamino-5-(diacetylamino)pyrimidine-2,4(1<i>H</i>,3<i>H</i>)-dione","Acta Crystallographica Section C","1999","55","5","749","751","10.1107/S0108270198018290","","","0.71073","MoKα","","0.0765","0.0426","","","","0.1087","","","","","","1.025","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008516","11.9991","0.0002","9.0405","0.0002","12.0566","0.0002","90","","99.472","0.001","90","","1290.04","0.04","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-Ethyl-2-(3-oxobutyl)cycloheptane-1,3-dione","","- C13 H20 O3 -","- C13 H20 O3 -","- C52 H80 O12 -","4","1","SK1261","Kandasamy Chinnakali; Hoong-Kun Fun; Desikan Rajagopal; Sambasivam Swaminathan","2-Ethyl-2-(3-oxobutyl)cycloheptane-1,3-dione","Acta Crystallographica Section C","1999","55","5","772","774","10.1107/S0108270198018289","","","0.71073","MoKα","","0.092","0.057","","","","0.172","","","","","","0.981","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008517","11.5436","0.0004","18.282","0.0006","8.2935","0.0003","90","","107.141","0.001","90","","1672.52","0.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(p-Methoxyphenyl)-3,5-bis(2-pyridyl)-4H-1,2,4-triazole","","- C19 H15 N5 O -","- C19 H15 N5 O -","- C76 H60 N20 O4 -","4","1","SK1269","Hoong-Kun Fun; Kandasamy Chinnakali; Sichang Shao; Dunru Zhu; Xiao Zeng You","4-(<i>p</i>-Methoxyphenyl)-3,5-bis(2-pyridyl)-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section C","1999","55","5","770","772","10.1107/S0108270199001821","","","0.71073","MoKα","","0.074","0.046","","","","0.12","","","","","","1.029","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008518","9.9485","0.0006","9.3724","0.0006","20.3571","0.0011","90","","98.605","0.006","90","","1876.8","0.2","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","2,2'-Biphenol–1,10-phenanthroline (1/1).","","- C24 H18 N2 O2 -","- C24 H18 N2 O2 -","- C96 H72 N8 O8 -","4","1","SK1270","Lavender, Emma S.; Gregson, Richard M.; Ferguson, George; Glidewell, Christopher","2,2'-Biphenol–1,10-phenanthroline (1/1): a two-dimensional structure built up from three types of hydrogen bond and π–π stacking interactions","Acta Crystallographica Section C","1999","55","5","751","754","10.1107/S0108270199002942","","","0.7107","MoKα","","0.081","0.039","","","","0.107","","","","","","1.022","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008519","7.3635","0.0007","9.8643","0.001","11.4142","0.0015","110.845","0.008","99.069","0.012","92.998","0.009","759.83","0.16","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","1,4,8,11-Tetraazacyclotetradecane–2,2'-biphenol (1/2)","","- C34 H44 N4 O4 -","- C34 H44 N4 O4 -","- C34 H44 N4 O4 -","1","0.5","SK1271","Ferguson, George; Gregson, Richard M.; Glidewell, Christopher","A chain of fused <i>R</i>^2^~2~(10) and <i>R</i>^4^~6~(12) rings in the hydrogen-bonded structure of 1,4,8,11-tetraazacyclotetradecane–2,2'-biphenol (1/2)","Acta Crystallographica Section C","1999","55","5","815","817","10.1107/S0108270199001833","","","0.71073","MoKα","","0.074","0.043","","","","0.111","","","","","","1.03","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008520","12.748","0.002","6.11","0.003","14.87","0.006","90","","99.51","0.02","90","","1142.3","0.8","100","","100","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","dl-3-[[2,5-dihydro-3-methyl-2-oxo-5-furanyl]oxo]methylene-3,3a,6,6a- tetrahydro-2H-cyclopenta[b]furan-2-one","","- C13 H12 O5 -","- C13 H12 O5 -","- C52 H48 O20 -","4","1","SX1062","Rugutt, Joseph K.; Fronczek, Frank R.; Yarabe, Houphouet H.; Shamsi, Shahab A.; Henry III, Charles W.; Billiot, Eugene J.; Warner, Isiah M.","A racemic strigol analogue at 100K","Acta Crystallographica Section C","1999","55","5","759","761","10.1107/S0108270199001341","","","0.71073","Mo-Kα","","0.063","0.05","","0.056","0.055","","","","1.992","1.976","1.976","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008521","21.205","0.004","37.941","0.008","12.227","0.002","90","","90","","90","","9837","3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","TNLP","Theonellapeptolide-Id","","- C70 H149 N13 O28 -","- C70 H125 N13 O27.65 -","- C280 H500 N52 O110.6 -","4","1","SX1064","Mitsunobu Doi; Toshimasa Ishida; Motomasa Kobayashi; Jeffrey R. Deschamps; Judith L. Flippen-Anderson","The highly solvated structure of theonellapeptolide Id, a tridecapeptide lactone from the Okinawa marine sponge <i>Theonella swinhoei</i>","Acta Crystallographica Section C","1999","55","5","796","798","10.1107/S0108270198014383","","","1.5418","CuKα","","0.136","0.113","","","","0.287","","","","","","1.02","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008522","5.869","0.001","22.53","0.003","8.753","0.001","90","","98.67","0.01","90","","1144.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","PHTU","1-(2-Pyridyl)-3-phenylthiourea","","- C12 H11 N3 S -","- C12 H11 N3 S -","- C48 H44 N12 S4 -","4","1","SX1068","West, Douglas X.; Hermetet, Anne K.; Ackerman, Lily J.; Valdés-Martínez, Jesús; Hernández-Ortega, Simón","3-Phenyl-1-(2-pyridyl)thiourea","Acta Crystallographica Section C","1999","55","5","811","813","10.1107/S0108270198018083","","","0.71073","MoKα","","0.08","0.05","","","0.13","0.149","","","","","","1.072","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008523","8.144","0.002","10.004","0.002","24.101","0.005","90","","90","","90","","1963.6","0.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","acetylated illustrol","3'-14-epoxy-4',15-dioxaandrost-5-en-3β-yl acetate","","- C22 H30 O5 -","- C22 H30 O5 -","- C88 H120 O20 -","4","1","SX1075","Vencato, Ivo; Niero, Rivaldo; Montanari, João L.; Calixto, João B.; Sant'Ana, Antonio E. G.; Yunes, Rosendo A.","A new 14:15-seco-15-norpregnane derivative from <i>Mandevilla illustris</i> Woodson (Apocynaceae)","Acta Crystallographica Section C","1999","55","5","827","829","10.1107/S0108270199000529","","","0.71073","MoKα","","0.067","0.045","","","","0.143","","","","","","1.069","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008524","10.399","0.003","14.467","0.005","14.216","0.006","90","","104.27","0.03","90","","2072.7","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Cis-(Nitrato-O,O')(C-rac-1,5,8,12-tetramethyl-1,4,8,11- tetraazacyclotetradecane-N,N',N'',N''')nickel(II) Nitrate","","- C14 H32 N6 Ni O6 -","- C14 H32 N6 Ni O6 -","- C56 H128 N24 Ni4 O24 -","4","0.5","TA1219","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Liao, Fen-Ling; Chung, Chung-Sun","<i>cis</i>-(Nitrato-<i>O</i>,<i>O</i>')[(1<i>RS</i>,4<i>SR</i>,5<i>SR</i>,8<i>RS</i>,11<i>SR</i>,12<i>SR</i>)-<i>C</i>-<i>rac</i>-1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane-κ^4^<i>N</i>]nickel(II) nitrate","Acta Crystallographica Section C","1999","55","5","724","726","10.1107/S0108270198014449","","","0.71073","MoKα","","0.0435","0.0369","","","","0.1035","","","","","","1.075","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008525","10.594","0.002","7.461","0.004","22.92","0.005","90","","90","","90","","1811.6","1.1","153.2","","153.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C2 H10 N4 O6 S -","- C2 H10 N4 O6 S -","- C16 H80 N32 O48 S8 -","8","1","BK1397","Chen, Tianlang; Xiao, Shenxiu; Zhong, Boyu; Stern, Charlotte L.; Ellis, Donald E.","Uronium sulfate, [OHC(NH~2~)~2~]~2~(SO~4~)","Acta Crystallographica Section C","1999","55","6","994","996","10.1107/S0108270198014619","","","0.7107","MoKα","","0.0411","0.023","","0.066","","0.034","","","2.217","","","2.44","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008526","13.702","0.003","14.167","0.003","10.598","0.002","90","","97.34","0.03","90","","2040.4","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 F3 Na2 O11 S2 -","- C13 H15 F3 Na2 O11 S2 -","- C52 H60 F12 Na8 O44 S8 -","4","1","BK1421","Wang, Feng; Qi, Yinghua; Chen, Tianlu; Xing, Yan; Lin, Yonghua; Xu, Jiping","Disodium 4,4'-difluoro-3,3'-carbonyldibenzenesulfonate hydrofluoride tetrahydrate","Acta Crystallographica Section C","1999","55","6","871","873","10.1107/S0108270198016710","","","0.71073","MoKα","","0.0553","0.0407","","0.1274","0.1216","","","","1.009","1.113","1.113","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008527","8.951","0.0018","10.8181","0.0016","16.585","0.003","77.735","0.014","81.298","0.016","73.906","0.015","1500.5","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Hexakis(imidazole)nickel(II) oxydiacetate ethanol solvate","","- C24 H34 N12 Ni O6 -","- C23.04 H30.6 N12 Ni O5.52 -","- C46.08 H61.2 N24 Ni2 O11.04 -","2","1","BK1429","Perec, Mireille; Baggio, Ricardo; Garland, Maria Teresa","Hexakis(imidazole-<i>N</i>^3^)nickel(II) oxydiacetate ethanol solvate","Acta Crystallographica Section C","1999","55","6","858","860","10.1107/S0108270199001420","","","0.71073","MoKα","","0.076","0.049","","","","0.147","","","","","","1.077","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008528","3.8724","0.0002","12.0839","0.0005","18.4079","0.0006","90","","91.412","0.002","90","","861.11","0.06","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","naphthalene-2,3-dicarbaldehyde","","- C12 H8 O2 -","- C12 H8 O2 -","- C48 H32 O8 -","4","1","BK1446","Britton, Doyle","Naphthalene-2,3-dicarbaldehyde","Acta Crystallographica Section C","1999","55","6","978","980","10.1107/S0108270199000840","","","0.71073","MoKα","","0.047","0.039","","0.108","0.101","","","","1.06","1.08","1.08","","","","","has coordinates","301791","2025-08-18","23:15:32",""
"2008529","12.922","0.002","13.914","0.002","14.263","0.006","65.05","0.02","73.3","0.03","64.59","0.01","2082.4","1","295","","295","","","","","","","","","7","P -1","-P 1","2","","","","- C16 H12 F3 N2 O8 Re S -","- C16 H8 F3 N2 O7.995 Re S -","- C64 H32 F12 N8 O31.98 Re4 S4 -","4","2","BK1449","Connick, William B.; Di Bilio, Angel J.; Schaefer, William P.; Gray, Harry B.","The red form of [Re(phen)(CO)~3~(H~2~O)]CF~3~SO~3~^.^H~2~O","Acta Crystallographica Section C","1999","55","6","913","916","10.1107/S0108270199001432","","","0.7107","MoKα","","0.058","0.058","","0.075","0.075","","","","1.66","1.66","1.66","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008530","11.148","0.002","14.47","0.01","11.08","0.01","110.13","0.06","96.85","0.03","81.97","0.04","1657","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tetra-μ-[(2,6-dichlorophenyl)amino-phenyl(acetato-O,O')]-bis(acetone-O) -di-copper(II), acetaldeyde solvate","","- C64 H56 Cl8 Cu2 N4 O11 -","- C64 H56 Cl8 Cu2 N4 O11 -","- C64 H56 Cl8 Cu2 N4 O11 -","1","0.5","BM1274","Castellari, Carlo; Feroci, Giorgio; Ottani, Stefano","Diclofenac interactions: tetrakis[μ-2-(2,6-dichloroanilino)phenylacetato]-1:2κ^8^<i>O</i>:<i>O</i>'-diacetone-1κ<i>O</i>,2κ<i>O</i>-dicopper(II)(<i>Cu</i>—<i>Cu</i>) acetaldehyde solvate","Acta Crystallographica Section C","1999","55","6","907","910","10.1107/S0108270199002206","","","0.71069","MoKα","","0.137","0.042","","","","0.11","","","","","","0.902","","","","has coordinates,has disorder","301791","2025-08-18","23:15:32",""
"2008531","13.82","0.001","9.3728","0.0011","15.308","0.0012","90","","92.144","0.002","90","","1981.5","0.3","295","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 Cu I2 N2 O2 Zn -","- C17 H16 Cu I2 N2 O2 Zn -","- C68 H64 Cu4 I8 N8 O8 Zn4 -","4","1","BM1298","Ercan, Filiz; Arıcı, Cengiz; Ülkü, Dinçer; Atakol, Orhan; Aksu, Mecit","{[μ-Bis(salicylidene)-1,3-propanediaminato]-copper(II)}diiodozinc(II)","Acta Crystallographica Section C","1999","55","6","930","932","10.1107/S0108270199002851","","","0.71073","MoKα","","","0.04","","","0.044","","","","","0.98","0.98","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008532","8.4341","0.0001","15.5112","0.0003","11.4293","0.0001","90","","90.397","0.001","90","","1495.18","0.04","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H18 O4 -","- C17 H18 O4 -","- C68 H72 O16 -","4","1","","Ercan, Filiz; Arıcı, Cengiz; Ülkü, Dinçer; Atakol, Orhan; Aksu, Mecit","{[μ-Bis(salicylidene)-1,3-propanediaminato]copper(II)}diiodozinc(II)","Acta Crystallographica Section C","1999","55","","930","932","","","","","","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008533","14.835","0.002","7.157","0.003","14.971","0.003","90","","103.05","0.04","90","","1548.5","0.8","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Oleana-13(18), 15(16)-diene-3β, 28-diol diacetate","","- C34 H52 O4 -","- C34 H52 O4 -","- C68 H104 O8 -","2","1","BM1304","Bhattacharyya, Kinkini; Kar, Tanusree; Dutta, Pradeep Kumar; Bocelli, Gabriele; Righi, Lara","Dimethyl oleana-13(18),15(16)-diene-3β,28-diacetate","Acta Crystallographica Section C","1999","55","6","992","994","10.1107/S0108270199002255","","","1.54178","CuKα","","0.1122","0.0539","","0.1716","0.1247","","","","0.822","1.048","1.048","","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:33",""
"2008534","7.9607","0.0002","9.9649","0.0002","14.2553","0.0003","86.208","0.001","79.818","0.001","73.889","0.001","1069.14","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2-Acetyl-6-phenyl-5,6,7,8-tetrahydronaphthalen-1-yl 4-toluenesulfonate","","- C25 H24 O4 S -","- C25 H24 O4 S -","- C50 H48 O8 S2 -","2","1","BM1306","Chinnakali, Kandasamy; Fun, Hoong-Kun; Sriraghavan, Kamaraj; Ramakrishnan, Vayalakkavoor T.","2-Acetyl-6-phenyl-5,6,7,8-tetrahydro-1-naphthyl <i>p</i>-toluenesulfonate","Acta Crystallographica Section C","1999","55","6","944","946","10.1107/S0108270199001791","","","0.71073","MoKα","","0.123","0.07","","","","0.195","","","","","","1.014","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008535","10.412","0.001","8.516","0.001","21.556","0.001","90","","101.223","0.01","90","","1874.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-ethyl-5-[(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalene)-methynyl]- 2,4-triazolidindione","","- C20 H25 N O2 S -","- C20 H25 N O2 S -","- C80 H100 N4 O8 S4 -","4","1","BM1315","Bozdag-Dundar, Oya; Dundar, Burak; Buyukbingol, Erdem; Caira, Mino R","3-Ethyl-5-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthylmethylene)thiazolidine-2,4-dione","Acta Crystallographica Section C","1999","55","6","1027","1029","10.1107/S0108270199002267","","","0.71069","MoKα","","0.068","0.0521","","0.1674","","0.1516","","","1.049","","","1.093","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:33",""
"2008536","11.662","0.005","14.323","0.007","8.7","0.004","90","0.03","94.57","0.04","90","0.03","1448.6","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N-phenylamide of 2-cyano-5-phenylpent-2-en-4-ynoic acid","","- C18 H12 N2 O -","- C18 H12 N2 O -","- C72 H48 N8 O4 -","4","1","BM1318","Borbulevych, Oleg Ya.; Golding, Igor R.; Kharitonkin, Andrey B.; Shishkin, Oleg V.; Gololobov, Yuriy G.","The <i>N</i>-phenylamide of 2-cyano-5-phenylpent-2-en-4-ynoic acid","Acta Crystallographica Section C","1999","55","6","1019","1020","10.1107/S0108270199002218","","","0.71073","MoKα","","0.1255","0.0487","","0.1521","","0.1131","","","0.86","","","1.092","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008537","9.529","0.002","16.354","0.005","13.719","0.005","90","","105.13","0.01","90","","2063.8","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Bis(n-butyl)(dichloro)(2,2'-bipyridyl)tin(IV)","","- C18 H26 Cl2 N2 Sn -","- C18 H26 Cl2 N2 Sn -","- C72 H104 Cl8 N8 Sn4 -","4","1","BM1319","Jennifer Gill; Hans Parge; Christine J. Cardin; Chris Tsiamis; Constantin Kavounis","(2,2'-Bipyridyl-<i>N</i>,<i>N</i>')di-<i>n</i>-butyldichlorotin(IV)","Acta Crystallographica Section C","1999","55","6","875","876","10.1107/S010827019900325X","","","0.71073","MoKα","","0.065","0.054","","","","0.158","","","","","","1.119","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008538","6.142","0.001","6.142","0.001","14.395","0.002","90","","90","","120","","470.29","0.13","295","2","295","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","potassium oxo antimonide","","- K4 O3 Sb2 -","- K4 O3 Sb2 -","- K8 O6 Sb4 -","2","0.166667","BR1231","Tillard, Monique; Monconduit, Laure; Traber, Boris; Belin, Claude","K~4~Sb~2~O~3~ containing the Sb~2~O~3~^4-^ anion","Acta Crystallographica Section C","1999","55","6","833","835","10.1107/S0108270198018484","","","0.71073","MoKα","","0.086","0.048","","","","0.126","","","","","","1.133","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008539","7.274","0.0011","7.2911","0.0011","18.551","0.003","96.375","0.009","90.714","0.009","119.656","0.008","847.1","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","sodium tungsten oxide","","- Na5 O44 W14 -","- Na5 O44 W14 -","- Na5 O44 W14 -","1","0.5","BR1234","Triantafyllou, Spyros T.; Christidis, Panayiotis C.","Triclinic sodium tungsten oxide, Na~5~W~14~O~44~","Acta Crystallographica Section C","1999","55","6","838","841","10.1107/S0108270199002760","","","0.7107","MoKα","","0.09","0.063","","","","0.159","","","","","","1.004","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008540","5.221","0.001","9.983","0.001","7.388","0.001","90","","90.21","0.004","90","","385.07","0.1","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","sodium cobalt(II) phosphate","","- Co Na O4 P -","- Co Na O4 P -","- Co4 Na4 O16 P4 -","4","1","BR1238","Chippindale, Ann M.; Cowley, Andrew R.; Chen, Jiesheng; Gao, Qiuming; Xu, Ruren","A new modification of NaCoPO~4~ with the zeolite ABW structure","Acta Crystallographica Section C","1999","55","6","845","847","10.1107/S010827019900414X","","","0.71069","MoKα","","","0.0182","","","0.02","","","","","1.0847","1.0847","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008541","18.793","0.002","18.793","0.002","18.793","0.002","90","","90","","90","","6637.3","1.2","200","2","200","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- C27 H36 Cl4 Fe2 N6 -","- C27 H36 Cl4 Fe2 N6 -","- C216 H288 Cl32 Fe16 N48 -","8","0.333333","CF1275","Alcock, Nathaniel W.; Zhang, Delong; Busch, Daryle H.","Tris(2-pyridylmethyl)triazacyclododecane complexes of Fe^II^ and Cu^II^","Acta Crystallographica Section C","1999","55","6","886","889","10.1107/S0108270198018381","","","0.71073","MoKα","","0.088","0.063","","0.173","0.157","","","","1.094","1.165","1.165","","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2008542","24.309","0.005","13.543","0.003","41.392","0.008","90","","90","","90","","13627","5","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C28 H37.5 Cu F12 N6.5 P2 -","- C28 H27.988 Cu F12 N6.5 P2 -","- C448 H447.808 Cu16 F192 N104 P32 -","16","2","CF1275","Alcock, Nathaniel W.; Zhang, Delong; Busch, Daryle H.","Tris(2-pyridylmethyl)triazacyclododecane complexes of Fe^II^ and Cu^II^","Acta Crystallographica Section C","1999","55","6","886","889","10.1107/S0108270198018381","","","0.71073","MoKα","","0.124","0.066","","","","0.179","","","","","","0.842","","","","has coordinates,has disorder,has Fobs","176435","2020-10-21","18:00:00",""
"2008543","9.5694","0.001","12.0225","0.001","19.5555","0.001","103.82","0.01","91.434","0.01","110.249","0.01","2035.3","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","trans-carbonyl[η^2^-dihydrobis(pyrazol-1-yl)borato]hydridobis- (triphenylarsino)ruthenium(II) monohydrate","","- C43 H41 As2 B N4 O2 Ru -","- C43 H39 As2 B N4 O2 Ru -","- C86 H78 As4 B2 N8 O4 Ru2 -","2","1","CF1291","Huh, Seong; Kim, Youngmee; Park, Seongsoon; Park, Tae-Jin; Jun, Moo-Jin","<i>trans</i>-Carbonyl[η^2^-dihydrobis(pyrazol-1-yl-<i>N</i>^2^)borato]hydridobis(triphenylarsine)ruthenium(II) monohydrate","Acta Crystallographica Section C","1999","55","6","850","852","10.1107/S0108270199002279","","","0.71073","MoKα","","0.0778","0.0463","","","","0.1526","","","","","","1.118","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008544","6.377","0.002","6.972","0.003","10.514","0.016","90","","104.45","","90","","452.7","0.7","122","0.2","122","0.5","","","","","","","","4","P 1 21 1","P 2yb","4","","(R)-(+)-2-(4-Chlorophenoxy)propionic acid","","- C9 H9 Cl O3 -","- C9 H9 Cl O3 -","- C18 H18 Cl2 O6 -","2","1","CF1292","Henning Osholm Sørensen; André Collet; Sine Larsen","(<i>R</i>)-(+)-2-(4-Chlorophenoxy)propionic acid","Acta Crystallographica Section C","1999","55","6","953","956","10.1107/S0108270199002280","","","1.54184","CuKα","","0.022","0.022","","","","0.062","","","","","","1.048","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008545","7.898","0.002","10.188","0.003","7.064","0.002","95","0.02","92.92","0.02","105.17","0.02","544.9","0.3","293","","293","","","","","","","","","5","P -1","-P 1","2","","μ-[N,N'-bis(3-aminopropyl)-oxamidato(2-)]-N,N',O':N'',N''',O-bis[(nitrato-O) (imidazole-N^3^)copper(II)]","","- C14 H24 Cu2 N10 O8 -","- C14 H24 Cu2 N10 O8 -","- C14 H24 Cu2 N10 O8 -","1","0.5","CF1295","Zhang, Cungen; Sun, Jie; Kong, Xiangfu; Zhao, Chengxue","An oxamidato-bridged binuclear imidazole–copper(II) complex","Acta Crystallographica Section C","1999","55","6","873","875","10.1107/S0108270199001110","","","0.7107","MoKα","","","0.027","","","","0.04","","","","","","1.65","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008546","5.2624","0.0009","8.8737","0.0014","14.518","0.003","82.455","0.015","85.847","0.018","89.393","0.012","670.3","0.2","290","1","290","1","","","","","","","","4","P 1","P 1","1","","(2S,4S,5R)-(-)-3,4-dimethyl-5-phenyl-2-(pyrrol-2-yl)-1,3- oxazolidine","","- C15 H18 N2 O -","- C15 H18 N2 O -","- C30 H36 N4 O2 -","2","2","CF1298","Gallagher, John F.; Fitzsimons, Lavelle M.","Intermolecular N—H···O and C—H···O interactions form a two-dimensional network in (2<i>S</i>,4<i>S</i>,5<i>R</i>)-(–)-3,4-dimethyl-5-phenyl-2-(pyrrol-2-yl)-1,3-oxazolidine","Acta Crystallographica Section C","1999","55","6","1000","1003","10.1107/S0108270199002292","","","0.7107","MolybdenumKα","","0.078","0.052","","","","0.137","","","","","","1.004","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008547","7.281","0.002","16.084","0.007","12.849","0.006","90","","100.51","0.02","90","","1479.5","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichloro-bis[2-(2-hydroxymethyl)-1-methylimidazole-N^3^]zinc(II)","","- C10 H16 Cl2 N4 O2 Zn -","- C10 H16 Cl2 N4 O2 Zn -","- C40 H64 Cl8 N16 O8 Zn4 -","4","1","CF1299","Yang, Shi-Ping; Long, La-Sheng; Chen, Xiao-Ming; Ji, Liang-Nian","Dichlorobis(2-hydroxymethyl-1-methylimidazole-<i>N</i>^3^)zinc(II)","Acta Crystallographica Section C","1999","55","6","869","871","10.1107/S0108270199002309","","","0.71073","MoKα","","0.099","0.06","","","","0.166","","","","","","1.033","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008548","8.7836","0.0006","16.5431","0.0013","15.5118","0.0011","90","","93.117","0.006","90","","2250.7","0.3","298","2","298","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","8b,8c-dibenzoyl-4b,8b,8c,8d-tetrahydrodibenzo[a,f]cyclopropa[cd]pentalene-4b -carbaldehyde","","- C31 H20 O3 -","- C31 H20 O3 -","- C124 H80 O12 -","4","1","DA1047","Muneer, M.; Ramaiah, D.; Ajitkumar, E. S.; Sajimon, M. C.; Rath, Nigam P.; George, M. V.","Regioselectivity in dibenzobarrelene photorearrangements: photoproducts derived from 9-substituted-dibenzobarrelenes","Acta Crystallographica Section C","1999","55","6","996","1000","10.1107/S0108270199000487","","","1.54178","CuKα","","0.078","0.057","","","","0.175","","","","","","1.073","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008549","9.0656","0.0015","8.779","0.003","29.758","0.005","90","","94.672","0.013","90","","2360.5","1","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4b-acetyl-8b,8c-dibenzoyl-4b,8b,8c,8d- tetrahydrodibenzo[a,f]cyclopropa[cd]pentalene","","- C32 H22 O3 -","- C32 H22 O3 -","- C128 H88 O12 -","4","1","DA1047","Muneer, M.; Ramaiah, D.; Ajitkumar, E. S.; Sajimon, M. C.; Rath, Nigam P.; George, M. V.","Regioselectivity in dibenzobarrelene photorearrangements: photoproducts derived from 9-substituted-dibenzobarrelenes","Acta Crystallographica Section C","1999","55","6","996","1000","10.1107/S0108270199000487","","","0.71073","MoKα","","0.22","0.077","","","","0.184","","","","","","1.04","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008550","16.8684","0.0001","15.3955","0.0001","17.52","0.0002","90","","90","","90","","4549.9","0.07","223","2","223","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","8b,8c-dibenzoyl-4b-nitro-4b,8b,8c,8d- tetrahydrodibenzo[a,f]cyclopropa[cd]pentalene","","- C30 H19 N O4 -","- C30 H19 N O4 -","- C240 H152 N8 O32 -","8","1","DA1047","Muneer, M.; Ramaiah, D.; Ajitkumar, E. S.; Sajimon, M. C.; Rath, Nigam P.; George, M. V.","Regioselectivity in dibenzobarrelene photorearrangements: photoproducts derived from 9-substituted-dibenzobarrelenes","Acta Crystallographica Section C","1999","55","6","996","1000","10.1107/S0108270199000487","","","0.71073","MoKα","","0.061","0.045","","","","0.11","","","","","","1.056","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008551","16.6439","0.0006","17.9178","0.0008","8.3487","0.0003","90","","94.963","0.005","90","","2480.43","0.17","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","10c-benzoyl-6b-tert-butyl-2-phenyl-10b,10c-dihydro-6bH-dibenzo[a,f]furo[2,3,4- cd]pentalene","","- C34 H28 O2 -","- C34 H28 O2 -","- C136 H112 O8 -","4","1","DA1047","Muneer, M.; Ramaiah, D.; Ajitkumar, E. S.; Sajimon, M. C.; Rath, Nigam P.; George, M. V.","Regioselectivity in dibenzobarrelene photorearrangements: photoproducts derived from 9-substituted-dibenzobarrelenes","Acta Crystallographica Section C","1999","55","6","996","1000","10.1107/S0108270199000487","","","1.54178","CuKα","","0.05","0.042","","","","0.124","","","","","","1.062","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008552","5.925","0.002","8.321","0.001","16.126","0.003","103.41","0.01","98.85","0.02","99.51","0.02","747.3","0.3","293","2","300","","","","","","","","","4","P -1","-P 1","2","Indole","Ethyl 1-2'-Cyanoethyl-3,5-Dimethyl-2-Indolecarboxylate","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C32 H36 N4 O4 -","2","1","DA1055","T. N. Chandrakantha; Puttaraja; M. K. Kokila; N. C. Shivaprakash","Ethyl 1-(2-cyanoethyl)-3,5-dimethyl-1<i>H</i>-indole-2-carboxylate","Acta Crystallographica Section C","1999","55","6","990","992","10.1107/S0108270199001973","","","1.5418","CuKα","","0.0855","0.0636","","0.1824","0.1476","","","","1.101","1.134","1.134","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008553","8.401","0.001","10.704","0.001","9.325","0.001","90","","104.96","0.01","90","","810.12","0.15","295","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis(trigonelline)-dichlorocopper(II)","","- C14 H14 Cl2 Cu N2 O4 -","- C14 H14 Cl2 Cu N2 O4 -","- C28 H28 Cl4 Cu2 N4 O8 -","2","0.5","DA1057","Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Hideaki, Matsushima; Tokii, Tadashi","A monomeric and a dimeric copper(II) trigonelline adduct with chloride, and a dimeric copper(II) 1-methyl-2-pyrrolecarboxylate adduct with 3-methylpyridine","Acta Crystallographica Section C","1999","55","6","882","886","10.1107/S0108270199001985","","","0.71073","MoKα","","","0.044","","","0.045","","","","","1.23","1.23","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008554","10.156","0.002","13.883","0.002","7.793","0.001","99.4","0.01","109.29","0.01","75.57","0.01","1000.4","0.3","299","","","","","","","","","","","6","P -1","-P 1","2","","Tetrakis(μ-trigonelline-O,O')-dichlorocopper(II) dichloride octahydrate","","- C28 H44 Cl4 Cu2 N4 O16 -","- C28 H44 Cl4 Cu2 N4 O16 -","- C28 H44 Cl4 Cu2 N4 O16 -","1","0.5","DA1057","Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Hideaki, Matsushima; Tokii, Tadashi","A monomeric and a dimeric copper(II) trigonelline adduct with chloride, and a dimeric copper(II) 1-methyl-2-pyrrolecarboxylate adduct with 3-methylpyridine","Acta Crystallographica Section C","1999","55","6","882","886","10.1107/S0108270199001985","","","0.71073","MoKα","","","0.043","","","0.043","","","","","1.48","1.48","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008555","10.431","0.002","17.795","0.003","10.685","0.002","90","","114.4","0.01","90","","1806.2","0.6","299","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Tetrakis(μ-1-methylpyrrole-2-carboxylato-O,O')-dipyridinecopper(II)","","- C36 H38 Cu2 N6 O8 -","- C36 H38 Cu2 N6 O8 -","- C72 H76 Cu4 N12 O16 -","2","0.5","DA1057","Nakagawa, Hiroo; Kani, Yoshiyuki; Tsuchimoto, Masanobu; Ohba, Shigeru; Hideaki, Matsushima; Tokii, Tadashi","A monomeric and a dimeric copper(II) trigonelline adduct with chloride, and a dimeric copper(II) 1-methyl-2-pyrrolecarboxylate adduct with 3-methylpyridine","Acta Crystallographica Section C","1999","55","6","882","886","10.1107/S0108270199001985","","","0.71073","MoKα","","","0.052","","","0.043","","","","","1.26","1.26","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008556","9.849","0.002","10.8","0.002","25.682","0.003","90","0.01","90","0.01","90","0.01","2731.8","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2^'^,3^'^,5^'^-Tri-O-Benzoylinosine","","- C31 H24 N4 O8 -","- C31 H24 N4 O8 -","- C124 H96 N16 O32 -","4","1","DE1094","S.Kolappan; T. Parthasarathy Seshadri","2',3',5'-Tri-<i>O</i>-benzoylinosine","Acta Crystallographica Section C","1999","55","6","986","987","10.1107/S0108270198014668","","","1.5418","CuKα","","0.0456","0.0327","","","","0.1167","","","","","","0.691","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008557","9.296","0.002","10.524","0.003","11.044","0.003","113.89","0.02","100.15","0.02","109.75","0.02","866.1","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","1-acetyl-5-(2-chlorophenyl)-3-(2-chlorostyryl)-2-pyrazoline","","- C19 H16 Cl2 N2 O -","- C19 H16 Cl2 N2 O -","- C38 H32 Cl4 N4 O2 -","2","1","DE1102","R. V. Krishnakumar; S. Natarajan; V. Vijayabaskar; S. Perumal; S. Selvaraj","1-Acetyl-5-(4-methoxyphenyl)-3-(4-methoxystyryl)-2-pyrazoline and 1-acetyl-5-(2-chlorophenyl)-3-(2-chlorostyryl)-2-pyrazoline","Acta Crystallographica Section C","1999","55","6","987","990","10.1107/S0108270199000712","","","0.71073","MoKα","","0.101","0.067","","","","0.15","","","","","","1.232","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008558","5.72","0.001","12.085","0.004","26.654","0.004","90","","91.78","0.02","90","","1841.6","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-acetyl-5-(4-methoxyphenyl)-3-(4-methoxystyryl)-2-pyrazoline","","- C21 H22 N2 O3 -","- C21 H22 N2 O3 -","- C84 H88 N8 O12 -","4","1","DE1102","R. V. Krishnakumar; S. Natarajan; V. Vijayabaskar; S. Perumal; S. Selvaraj","1-Acetyl-5-(4-methoxyphenyl)-3-(4-methoxystyryl)-2-pyrazoline and 1-acetyl-5-(2-chlorophenyl)-3-(2-chlorostyryl)-2-pyrazoline","Acta Crystallographica Section C","1999","55","6","987","990","10.1107/S0108270199000712","","","1.5418","CuKα","","0.049","0.043","","","","0.127","","","","","","1.138","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008559","4.586","0.002","12.843","0.004","9.767","0.001","90","","133.98","0.02","90","","413.9","0.3","296.2","","","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C2 H4 N4 -","- C2 H4 N4 -","- C8 H16 N16 -","4","1","DE1103","Ohno, Yoshio; Akutsu, Yoshiaki; Arai, Mitsuru; Tamura, Masamitsu; Takehiro Matsunaga","5-Methyl-1<i>H</i>-tetrazole","Acta Crystallographica Section C","1999","55","6","1014","1016","10.1107/S0108270199002437","","","0.7107","MoKα","","","0.04","","","","0.052","","","","","","1.859","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008560","6.069","0.007","7.829","0.002","13.455","0.003","90","","91.76","0.03","90","","639","0.8","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Ethylene bis(dimethyldithiocarbamate)","","- C8 H16 N2 S4 -","- C8 H16 N2 S4 -","- C16 H32 N4 S8 -","2","0.5","FG1520","Jian Fangfang; Zhu Dunru; Fun Hoong-Kun; Kandasamy Chinnakali; Ibrahim Abdul Razak; You Xiaozeng","Ethylene bis(dimethyldithiocarbamate) and butane-1,4-diyl bis(dimethyldithiocarbamate)","Acta Crystallographica Section C","1999","55","6","940","942","10.1107/S0108270198016370","","","0.71073","MoKα","","0.0687","0.041","","","","0.0954","","","","","","1.043","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008561","7.4875","0.0001","7.4424","0.0002","13.7568","0.0003","90","","97.536","0.001","90","","759.98","0.03","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Butylene bis(dimethyldithiocarbamate)","","- C10 H20 N2 S4 -","- C10 H20 N2 S4 -","- C20 H40 N4 S8 -","2","0.5","FG1520","Jian Fangfang; Zhu Dunru; Fun Hoong-Kun; Kandasamy Chinnakali; Ibrahim Abdul Razak; You Xiaozeng","Ethylene bis(dimethyldithiocarbamate) and butane-1,4-diyl bis(dimethyldithiocarbamate)","Acta Crystallographica Section C","1999","55","6","940","942","10.1107/S0108270198016370","","","0.71073","MoKα","","0.0309","0.0268","","","","0.0754","","","","","","1.103","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008562","6.2578","0.0005","16.352","0.001","14.819","0.001","90","","91.255","0.001","90","","1516.03","0.18","296","1","296","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H24 Co N2 O14 P2 -","- C2 H22 Co N2 O14 P2 -","- C8 H88 Co4 N8 O56 P8 -","4","1","FR1152","Yongkui Shan; Songping D. Huang","(C~2~H~10~N~2~)[Co(H~2~O)~6~](HPO~4~)~2~: a supramolecular three-dimensional hydrogen-bonding network","Acta Crystallographica Section C","1999","55","6","921","923","10.1107/S0108270199001584","","","0.7107","MoKα","","0.061","0.034","","0.051","","0.044","","","1.024","","","1.09","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008563","8.9034","0.0012","10.0168","0.0011","16.709","0.0012","73.579","0.002","74.837","0.003","65.376","0.002","1281.6","0.2","295","","","","","","","","","","","7","P -1","-P 1","2","","","","- C23 H23 Cu I2 N3 O2 Zn -","- C24 H21 Cu I2 N3 O2 Zn -","- C48 H42 Cu2 I4 N6 O4 Zn2 -","2","1","FR1157","Ercan, Filiz; Arıcı, Cengiz; Akay, Abdülkadir; Atakol, Orhan; Ülkü, Dinc̨er","{[μ-Bis(salicylidene)-1,3-propanediaminato]-(3-methylpyridine)copper(II)}diiodozinc(II)","Acta Crystallographica Section C","1999","55","6","925","928","10.1107/S0108270199003273","","","0.71073","MoKα","","","0.032","","","0.039","","","","","0.92","0.92","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008564","8.2202","0.0003","18.2074","0.0006","11.9429","0.0004","90","","93.079","0.001","90","","1784.9","0.11","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Aminoguanidinium (N,N'-ethylenediaminetetraacetato)antimonate(III) hydrate","","- C11 H21 N6 O9 Sb -","- C11 H21 N6 O9 Sb -","- C44 H84 N24 O36 Sb4 -","4","1","FR1177","Hoong-Kun Fun; S. Shanmuga Sundara Raj; Abdul Razak, Ibrahim; Ilyukhin, Andrey B.; Davidovich, Ruven L.; Huang, Jing-Wei; Hu, Sheng-Zhi; Ng, Seik Weng","Aminoguanidinium (ethylenediamine-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetraacetato)antimonate(III) monohydrate","Acta Crystallographica Section C","1999","55","6","905","907","10.1107/S0108270199002310","","","0.71073","MoKα","","0.026","0.021","","","","0.051","","","","","","1.087","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008565","6.8822","0.0008","8.9557","0.001","11.0364","0.0012","98.765","0.002","92.365","0.002","98.66","0.002","663.18","0.13","293","","","","","","","","","","","5","P -1","-P 1","2","","4-Methoxybenzaldehyde-(pentafluorophenylmethylidene)hydrazone","","- C15 H9 F5 N2 O -","- C15 H9 F5 N2 O -","- C30 H18 F10 N4 O2 -","2","1","FR1178","Lewis, Michael; Barnes, Charles L.; Hathaway, Bruce A.; Glaser, Rainer","4-Methoxybenzaldehyde pentafluorophenylmethylidenehydrazone","Acta Crystallographica Section C","1999","55","6","975","978","10.1107/S0108270199002541","","","0.7093","MolybdenumKα","","","0.058","","","","0.075","","","","","","1.19","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008566","11.1445","0.0007","11.7843","0.0007","14.0877","0.0009","90","","95.819","0.001","90","","1840.6","0.2","198","2","198","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H19 N2 P -","- C23 H19 N2 P -","- C92 H76 N8 P4 -","4","1","","Filippo Minutolo; Scott R. Wilson; John A. Katzenellenbogen","Crystallographic evidence for the electronic distribution in (2,4-cyclopentadien-1-ylidenehydrazono)triphenylphosphorane","Acta Crystallographica Section C","1999","55","6","1016","1016","","","","","","","","0.033","","","0.0651","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008567","8.438","0.002","27.496","0.001","4.894","0.001","90","","117.38","0.02","90","","1008.3","0.4","296","","296","","","","","","","","","4","C 1 c 1","C -2yc","9","quinolinium-4-carboxylate dihydrate","","","- C10 H11 N O4 -","- C10 H11 N O4 -","- C40 H44 N4 O16 -","4","1","FR1183","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding in quinolinium-4-carboxylate dihydrate","Acta Crystallographica Section C","1999","55","6","935","937","10.1107/S0108270199002565","","","0.71073","MoKα","","","0.032","","","0.055","","","","","1.85","1.85","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008568","7.714","0.002","17.848","0.002","6.91","0.002","90","","107.34","0.02","90","","908.1","0.4","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","naphthalene-1,2-dicarboxylic anhydride","","","- C12 H6 O3 -","- C12 H6 O3 -","- C48 H24 O12 -","4","1","FR1187","Fitzgerald, Lawrence J.; Gerkin, Roger E.","Network of C—H···O interactions in 1,2-naphthalenedicarboxylic anhydride","Acta Crystallographica Section C","1999","55","6","937","940","10.1107/S0108270199002577","","","0.71073","MoKα","","","0.045","","","","0.052","","","","","","1.62","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008569","7.937","0.003","37.789","0.004","9.696","0.003","90","","90","","90","","2908.1","1.5","296","","296","","","","","","","","","4","P b c a","-P 2ac 2ab","61","dipotassium naphthalene-1,8-dicarboxylate.potassium bicarbonate","","","- C13 H7 K3 O7 -","- C13 H7 K3 O7 -","- C104 H56 K24 O56 -","8","1","FR1190","Fitzgerald, Lawrence J.; Gerkin, Roger E.","Dipotassium naphthalene-1,8-dicarboxylate‒potassium bicarbonate","Acta Crystallographica Section C","1999","55","6","918","921","10.1107/S0108270199002966","","","0.71073","MoKα","","","0.044","","","","0.074","","","","","","1.35","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008570","8.8712","0.0018","10.2642","0.0012","14.4412","0.0009","98.78","0.005","92.483","0.009","104.804","0.014","1251.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","aquachloro(1-ethyl-1,4-dihydro-4-oxo-1,3-dioxolo[4,5-g]cinnoline-3-carboxylato- O^3^,O^4^)(1-ethyl-1,4-dihydro-4-oxo-1,3-dioxolo[4,5-g]cinnoline-3-carboxylic acid-O^3^,O^4^)copper(II)","","- C24 H21 Cl Cu N4 O11 -","- C24 H21 Cl Cu N4 O11 -","- C48 H42 Cl2 Cu2 N8 O22 -","2","1","GD1017","Ruíz, Monica; Ortiz, Rosa; Perelló, Lourdes; Alfonso Castiñeiras","[CuCl(C~12~H~9~N~2~O~5~)(C~12~H~10~N~2~O~5~)(H~2~O)]","Acta Crystallographica Section C","1999","55","6","878","880","10.1107/S0108270199001122","","","1.54184","CuKα","","0.057","0.041","","","","0.12","","","","","","1.08","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008571","12.694","0.005","16.353","0.005","11.122","0.003","90","","90","","90","","2308.8","1.3","293","2","293","2","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rubidium molybdyl arsenate","","- As Mo O6 Rb -","- As Mo O6 Rb -","- As16 Mo16 O96 Rb16 -","16","0.5","GS1008","Zid, Mohamed Faouzi; Jouini, Tahar","RbMoO~2~AsO~4~","Acta Crystallographica Section C","1999","55","6","843","845","10.1107/S0108270198016102","","","0.71069","MoKα","","0.0335","0.024","","0.0674","0.0553","","","","1.173","1.071","1.071","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008572","5.763","0.001","10.153","0.002","12.022","0.002","83.37","0.01","86.46","0.01","78.83","0.01","684.9","0.2","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H18 O S -","- C16 H18 O S -","- C32 H36 O2 S2 -","2","1","GS1033","Zukerman-Schpector, J.; Gruber, Jonas; Camilo, Fernanda Ferraz","Two new 2,3-substituted 5-norbornenes","Acta Crystallographica Section C","1999","55","6","980","983","10.1107/S010827019900236X","","","0.71073","MoKα","","0.103","0.042","","","","0.115","","","","","","1.019","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008573","9.763","0.001","12.097","0.002","12.164","0.001","90","","107.292","0.008","90","","1371.7","0.3","293","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 N O3 S -","- C15 H15 N O3 S -","- C60 H60 N4 O12 S4 -","4","1","GS1033","Zukerman-Schpector, J.; Gruber, Jonas; Camilo, Fernanda Ferraz","Two new 2,3-substituted 5-norbornenes","Acta Crystallographica Section C","1999","55","6","980","983","10.1107/S010827019900236X","","","0.71073","MoKα","","0.15","0.05","","","","0.165","","","","","","1.039","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008574","7.7541","0.0013","14.4655","0.0019","31.108","0.005","90","","90","","90","","3489.3","0.9","293","2","293","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","(2S,3S)-2-[2-(benzyloxy)ethyl]-3-(6-chloro-9H-purin-9-yl)oxolane","","- C18 H19 Cl N4 O2 -","- C18 H19 Cl N4 O2 -","- C144 H152 Cl8 N32 O16 -","8","1","GS1035","George Balayiannis; Ioannis Argiris; Dionissios Papaioannou; Constantin Kavounis","(2<i>S</i>,3<i>S</i>)- and (2<i>R</i>,3<i>S</i>)-2-[2-(benzyloxy)ethyl]-3-(6-chloro-9<i>H</i>-purin-9-yl)oxolane","Acta Crystallographica Section C","1999","55","6","1005","1008","10.1107/S0108270199002784","","","0.71069","MoKα","","0.073","0.044","","","","0.127","","","","","","1.018","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008575","7.5238","0.0005","10.9972","0.0008","20.9169","0.0019","90","","90","","90","","1730.7","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2R,3S)-2-[2-(benzyloxy)ethyl]-3-(6-chloro-9H-purin-9-yl)oxolane","","- C18 H19 Cl N4 O2 -","- C18 H19 Cl N4 O2 -","- C72 H76 Cl4 N16 O8 -","4","1","GS1035","George Balayiannis; Ioannis Argiris; Dionissios Papaioannou; Constantin Kavounis","(2<i>S</i>,3<i>S</i>)- and (2<i>R</i>,3<i>S</i>)-2-[2-(benzyloxy)ethyl]-3-(6-chloro-9<i>H</i>-purin-9-yl)oxolane","Acta Crystallographica Section C","1999","55","6","1005","1008","10.1107/S0108270199002784","","","0.71069","MoKα","","0.105","0.053","","","","0.137","","","","","","1.027","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008576","10.045","0.003","14.347","0.005","15.606","0.006","99.24","0.02","100.22","0.02","108.76","0.02","2037.8","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","(3,3'-dimethylene-2,2'-biquinoline)bromotricarbonylrhenium(I)","","- C23 H14 Br N2 O3 Re -","- C23 H14 Br N2 O3 Re -","- C92 H56 Br4 N8 O12 Re4 -","4","2","HA1240","Juan Guerrero; Sergio A. Moya; María Teresa Garland; Ricardo F. Baggio","Bromotricarbonyl(3,3'-dimethylene-2,2'-biquinoline)rhenium(I)","Acta Crystallographica Section C","1999","55","6","932","934","10.1107/S0108270198017181","","","0.71073","MoKα","","0.059","0.036","","","","0.077","","","","","","1.064","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008577","6.88","0.0008","13.8033","0.0009","29.389","0.002","90","0.01","90","0.01","90","0.01","2791","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Olean-12-en[2,3-d]isoxazole-28-oic acid methyl ester","","- C32 H47 N O3 -","- C32 H47 N O3 -","- C128 H188 N4 O12 -","4","1","JZ1306","Gzella, Andrzej; Linkowska, Ewa; Zaprutko, Lucjusz; Wrzeciono, Urszula","Triterpenoide. XIV. [2,3-<i>d</i>]Isoxazoltriterpenderivate","Acta Crystallographica Section C","1999","55","6","1031","1034","10.1107/S010827019900013X","","","1.54178","CuKα","","0.0398","0.0353","","0.1034","0.0994","","","","1.035","1.036","1.036","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008578","6.5284","0.001","30.614","0.002","13.5481","0.001","90","0.01","101.31","0.01","90","0.01","2655.1","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","19β,28-Epoxy-18Hα-oleanan[2,3-d]isoxazole","","- C31 H47 N O2 -","- C31 H47 N O2 -","- C124 H188 N4 O8 -","4","2","JZ1306","Gzella, Andrzej; Linkowska, Ewa; Zaprutko, Lucjusz; Wrzeciono, Urszula","Triterpenoide. XIV. [2,3-<i>d</i>]Isoxazoltriterpenderivate","Acta Crystallographica Section C","1999","55","6","1031","1034","10.1107/S010827019900013X","","","1.54178","CuKα","","0.0481","0.0361","","0.1045","0.0997","","","","1.003","1.023","1.023","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008579","6.425","0.001","7.895","0.001","21.883","0.002","90","","95.5","0.01","90","","1104.9","0.2","293","2","","","","","","","","","","5","P 1 21 1","P 2yb","4","","(1R,2R,3S,4S,5S,6S)-exo-3-[(S)-1,2-dibenzyloxyethyl]-exo-2-cyano-endo-6- hydroxy-exo-5-iodobicyclo[2.2.1]heptane-endo-2-carboxylic Acid Lactone.","","- C25 H24 I N O4 -","- C25 H24 I N O4 -","- C50 H48 I2 N2 O8 -","2","1","JZ1323","Alías, Miriam; Buñuel, Elena; Cativiela, Carlos; Díaz-de-Villegas, María D.; Gálvez, José A.","(1<i>R</i>,2<i>R</i>,3<i>S</i>,4<i>S</i>,5<i>S</i>,6<i>S</i>)-<i>exo</i>-2-Cyano-<i>exo</i>-3-[(<i>S</i>)-1,2-dibenzyloxyethyl]-<i>exo</i>-5-iodobicyclo[2.2.1]heptane-<i>endo</i>-2,6-carbolactone","Acta Crystallographica Section C","1999","55","6","1009","1012","10.1107/S010827019900222X","","","0.71073","MoKα","","","0.0384","","","","0.0969","","","","","","1.017","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008580","10.503","0.001","13.889","0.002","10.678","0.001","90","","90.68","0.02","90","","1557.6","0.3","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cyclo-tri-μ-methoxo-tris(dichloroaluminium)","","- C3 H9 Al3 Cl6 O3 -","- C3 H9 Al3 Cl6 O3 -","- C12 H36 Al12 Cl24 O12 -","4","1","KA1308","Gelbrich, Thomas","A trimeric aluminium alkoxide: methoxyaluminium dichloride","Acta Crystallographica Section C","1999","55","6","856","858","10.1107/S0108270199000505","","","0.71073","MoKα","","0.066","0.034","","","","0.099","","","","","","1.019","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008581","15.21","0.002","5.539","0.0006","17.192","0.002","90","","134.45","0.01","90","","1034","0.3","291","","291","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2,3,5,6-tetraphenylpyrazine (α form)","","- C28 H20 N2 -","- C28 H20 N2 -","- C56 H40 N4 -","2","0.5","LN1076","Bartnik, Romuald; Faure, René; Gebicki, Krzysztof","Dimorphism of 2,3,5,6-tetraphenylpyrazine","Acta Crystallographica Section C","1999","55","6","1034","1037","10.1107/S0108270199002450","","","1.54056","CuKα","","","0.06","","","0.137","","","","","","","1.9","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008582","18.654","0.003","23.509","0.002","9.576","0.001","90","","92.18","0.01","90","","4196.4","0.9","291","","291","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","2,3,5,6-tetraphenylpyrazine (β form)","","- C28 H20 N2 -","- C28 H20 N2 -","- C224 H160 N16 -","8","1","LN1076","Bartnik, Romuald; Faure, René; Gebicki, Krzysztof","Dimorphism of 2,3,5,6-tetraphenylpyrazine","Acta Crystallographica Section C","1999","55","6","1034","1037","10.1107/S0108270199002450","","","1.54056","CuKα","","","0.057","","","0.077","","","","","","","1.24","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008583","7.904","0.005","8.899","0.006","9.335","0.007","108.26","0.04","112.63","0.03","91.41","0.03","567.6","0.7","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","catena-poly[[bis[μ-(2,6-dimethylpiperidinido)-N:N]dilithium]-μ-(N,N,N',N'- tetramethylethylenediamine-N:N')]","","- C20 H44 Li2 N4 -","- C20 H44 Li2 N4 -","- C20 H44 Li2 N4 -","1","0.5","LN1078","Clegg, William; Horsburgh, Lynne; Couper, Scott A.; Mulvey, Robert E.","<i>catena</i>-Poly[[bis(μ-2,6-dimethylpiperidinido-<i>N</i>:<i>N</i>)dilithium]-μ-(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-<i>N</i>:<i>N</i>')]","Acta Crystallographica Section C","1999","55","6","867","869","10.1107/S0108270199001171","","","0.71073","MoKα","","0.05","0.038","","","","0.109","","","","","","1.027","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008584","9.733","0.003","17.579","0.004","13.016","0.003","90","","97.12","0.02","90","","2209.8","1","160","2","160","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H32 Mo N2 -","- C22 H32 Mo N2 -","- C88 H128 Mo4 N8 -","4","1","LN1081","Clegg, William; Elsegood, Mark R. J.; Dyer, Philip W.; Gibson, Vernon C.; Marshall, Edward L.","Dibenzylbis(<i>tert</i>-butylimido)molybdenum(VI), containing both η^1^- and η^2^-benzyl ligands","Acta Crystallographica Section C","1999","55","6","916","918","10.1107/S0108270199003510","","","0.71073","MoKα","","0.02","0.018","","","","0.051","","","","","","1.086","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008585","9.003","0.005","12.699","0.003","20.522","0.008","90","","90","","90","","2346.3","1.7","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","melaniline","N,N' diphenyl guanidine","","- C13 H13 N3 -","- C13 H13 N3 -","- C104 H104 N24 -","8","2","NA1391","Paixão, J. A.; Matos Beja, A.; Pereira Silva, P. S.; Ramos Silva, M.; Alte da Veiga, L.","A new orthorhombic phase of <i>N</i>,<i>N</i>'-diphenylguanidine","Acta Crystallographica Section C","1999","55","6","1037","1040","10.1107/S0108270199002462","","","0.71073","MoKα","","0.0628","0.0364","","","","0.1094","","","","","","1.03","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008586","15.67","0.004","10.556","0.002","12.258","0.004","90","","96.1","0.01","90","","2016.1","0.9","150","1","150","1","","","","","","","","5","P 1 21 1","P 2yb","4","","1-(2R,3R)-5-(N-benzyl-N-methylamino)-2-[N-(4-methoxyphenyl)carbamoyl]-4-nitro-2-phenyl-2,3-dihydro-3-thienyl]-1,2,3,4,5-penta-O-acetyl-D-manno-pentitol","","- C41 H45 N3 O14 S -","- C41 H45 N3 O14 S -","- C82 H90 N6 O28 S2 -","2","1","NA1392","María Jesús Diánez; María Dolores Estrada; Amparo López-Castro; Simeón Pérez-Garrido","Study of a diastereoisomeric dihydrothiophene derivative at 150K","Acta Crystallographica Section C","1999","55","6","1020","1023","10.1107/S010827019900102X","","","0.71073","MoKα","","0.047","0.042","","0.124","0.119","","","","1.047","1.054","1.054","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008587","7.32","0.004","20.15","0.005","10.448","0.003","90","","103.33","0.04","90","","1499.5","1","299","3","299","3","","","","","","","","5","C 1 2/m 1","-C 2y","12","","Disodium hexaaquacobalt(II) dihydrogen 1,2,4,5-benzenetetracarboxylate(2-) tetrahydrate","","- C20 H28 Co Na2 O26 -","- C20 H28 Co Na2 O26 -","- C40 H56 Co2 Na4 O52 -","2","0.25","NA1397","Karanović, Ljiljana; Poleti, Dejan; Bogdanović, Goran A.; Spasojević-de Biré, Anne","Disodium hexaaquacobalt(II) bis[dihydrogen 1,2,4,5-benzenetetracarboxylate(2 ‒)] tetrahydrate","Acta Crystallographica Section C","1999","55","6","911","913","10.1107/S0108270199002498","","","0.71069","MoKα","","0.057","0.045","","0.1207","","0.1159","","","0.945","","","0.987","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008588","5.4931","0.0001","22.2521","0.0003","11.035","0.0002","90","","104.23","0.001","90","","1307.45","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","9-hydroxy-8-iodo-4-methyl-7,8,9,10-tetrahydro-7,8-benzocoumarin","","- C14 H13 I O3 -","- C14 H13 I O3 -","- C56 H52 I4 O12 -","4","1","NA1400","Kandasamy Chinnakali; Hoong-Kun Fun; Kamaraj Sriraghavan; Vayalakkavoor T.Ramakrishnan","9-Hydroxy-8-iodo-4-methyl-7,8,9,10-tetrahydrobenzo[<i>h</i>]coumarin","Acta Crystallographica Section C","1999","55","6","946","948","10.1107/S0108270199002036","","","0.71073","MoKα","","0.06","0.053","","","","0.151","","","","","","1.208","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008589","13.6977","0.0005","19.8307","0.0008","12.7594","0.0008","90","","90","","90","","3465.9","0.3","296.2","","296.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","(1S,3R)-Carpropamide","","","- C15 H18 Cl3 N O -","- C15 H18 Cl3 N O -","- C120 H144 Cl24 N8 O8 -","8","2","NA1401","Koketsu, Mamoru; Kagabu, Shinzo; Matsuoka, Masashi","Absolute configuration of the active stereoisomer of new rice fungicide Carpropamid","Acta Crystallographica Section C","1999","55","6","1025","1027","10.1107/S0108270199002504","","","0.7107","MoKα","","0.0952","0.0552","","","","0.0671","","","","","","1.484","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008590","7.3993","0.0002","8.9006","0.0002","11.7469","0.0003","101.651","0.001","100.54","0.001","93.448","0.001","741.11","0.03","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Chloro(di-2-pyridylamine-N,N')(propionato-O,O')copper(II) Monohydrate","","- C13 H16 Cl Cu N3 O3 -","- C13 H16 Cl Cu N3 O3 -","- C26 H32 Cl2 Cu2 N6 O6 -","2","1","NA1404","Sujittra Youngme; Kandasamy Chinnakali; Suchada Chantrapromma; Hoong-Kun Fun","Chloro(di-2-pyridyl-κ<i>N</i>-amine)(propionato-κ^2^<i>O</i>,<i>O</i>')copper(II) monohydrate","Acta Crystallographica Section C","1999","55","6","899","901","10.1107/S0108270199002048","","","0.71073","MoKα","","0.037","0.031","","","","0.087","","","","","","1.045","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008591","13.088","0.001","8.765","0.001","18.717","0.001","90","","97.77","0.01","90","","2127.4","0.3","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C34 H72 N12 P4 -","- C34 H72 N12 P4 -","- C68 H144 N24 P8 -","2","0.5","NA1406","Hökelek, Tuncer; Kılıç, Emine; Kılıç, Zeynel","<i>trans</i>-2,6-Bis(ethylamino)-2,4,4,6,8,8-hexapiperidinocyclo-2λ^5^,4λ^5^,6λ^5^,8λ^5^-tetraphosphazatetraene","Acta Crystallographica Section C","1999","55","6","983","985","10.1107/S0108270199002474","","","0.71073","MoKα","","","0.037","","","","0.053","","","","","","1.2","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008592","15.578","0.001","22.428","0.001","19.406","0.001","90","","108.83","0.01","90","","6417.3","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(2'-formylphenyl)-1,4-dioxabutane S-methylbenzyl dithiocarbazate Cobalt(II)","","- C32 H28 Co N4 O2 S4 -","- C32 H28 Co N4 O2 S4 -","- C256 H224 Co8 N32 O16 S32 -","8","1","NA1408","Hoong-Kun Fun; S. Shanmuga Sundara Raj; Xu-Hui Zhu; Xiao-Feng Chen; Jing-Lin Zuo; Xiao-Zeng You","A neutral cobalt(II) complex of a Schiff base ligand containing mixed O~2~S~2~N~2~ donors","Acta Crystallographica Section C","1999","55","6","896","899","10.1107/S0108270199001602","","","0.71073","MoKα","","0.133","0.059","","0.109","","0.087","","","1.036","","","1.145","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008593","7.3875","0.0002","12.4718","0.0003","14.8382","0.0004","90","","96.727","0.001","90","","1357.71","0.06","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","p-Methoxybenzaldehyde Isonicotinoyl Hydrazone Monohydrate","","- C14 H15 N3 O3 -","- C14 H15 N3 O3 -","- C56 H60 N12 O12 -","4","1","NA1409","S.Shanmuga Sundara Raj; Hoong-Kun Fun; Zhong-Lin Lu; Wen Xiao; Ye-Xiang Tong; Bei-Sheng Kang","<i>p</i>-Methoxybenzaldehyde isonicotinoylhydrazone monohydrate","Acta Crystallographica Section C","1999","55","6","942","944","10.1107/S0108270199002486","","","0.71073","MoKα","","0.0722","0.0485","","","","0.1413","","","","","","1.056","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008594","18.46","0.004","6.552","0.0005","32.603","0.007","90","","103.34","0.01","90","","3836.9","1.2","208","2","208","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","tetraphenylphosphonium tetra(1-methyl-1,2,3,4-tetrazol-5-thiolato)aurate(III)","","- C32 H33 Au N16 O0.5 P S4 -","- C32 H33 Au N16 O0.5 P S4 -","- C128 H132 Au4 N64 O2 P4 S16 -","4","0.5","NA1415","Schulz Lang, Ernesto; Dahmer, Marisa; Abram, Ulrich","Tetraphenylphosphonium tetrakis(1-methyl-1,2,3,4-tetrazole-5-thiolato-<i>S</i>)aurate(III) hemihydrate","Acta Crystallographica Section C","1999","55","6","854","856","10.1107/S0108270199004357","","","0.71073","MoKα","","0.043","0.024","","","","0.06","","","","","","1.056","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008595","7.208","0.002","6.291","0.004","14.432","0.005","90","","104.04","0.02","90","","634.9","0.5","293","","","","","","","","","","","4","P 1 c 1","P -2yc","7","","3-(2'-hydroxyphenylamino)-5,5-dimethyl-2-cyclohexenone","","- C14 H17 N O2 -","- C14 H17 N O2 -","- C28 H34 N2 O4 -","2","1","NA1416","Héctor Novoa de Armas; Norbert M. Blaton; Oswald M. Peeters; Camiel J. De Ranter; Margarita Suárez Navarro; Yamila Verdecia Reyes; Estael Ochoa Rodríguez; Esperanza Salfrán Solano","3-(2-Hydroxyphenylamino)-5,5-dimethylcyclohex-2-enone","Acta Crystallographica Section C","1999","55","6","1029","1031","10.1107/S0108270199004369","","","1.54184","CuKα","","0.044","0.043","","0.133","","0.133","","","1.139","","","1.139","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008596","24.0723","0.0005","6.6483","0.0001","5.3569","0.0001","90","","90","","90","","857.32","0.03","296","2","296","2","","","","","","","","2","P n a 21","P 2c -2n","33","","","","- Mo4 O11 -","- Mo4 O11 -","- Mo16 O44 -","4","1","OA1071","Hoong-Kun Fun; Ping Yang; Minoru Sasaki; Masasi Inoue; Hideoki Kadomatsu","γ-Mo~4~O~11~","Acta Crystallographica Section C","1999","55","6","841","843","10.1107/S0108270199000165","","","0.71073","MoKα","","0.039","0.038","","0.093","0.092","","","","1.293","1.292","1.292","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008597","7.712","0.005","9.617","0.005","16.155","0.003","90","","101.88","0.03","90","","1172.5","1","173.2","","173.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-t-butyl-3-(N,N-dimethylcarbamoyl)pyridine","","- C12 H18 N2 O -","- C12 H18 N2 O -","- C48 H72 N8 O4 -","4","1","OA1072","Yuji Mikata; Ryoko Maesaki","Unexpectedly produced 2-<i>tert</i>-butyl-5-(<i>N</i>,<i>N</i>-dimethylcarbamoyl)pyridine from 2-chloro-3-(<i>N</i>,<i>N</i>-dimethylcarbamoyl)pyridine with a <i>tert</i>-butyl Grignard reagent","Acta Crystallographica Section C","1999","55","6","973","975","10.1107/S0108270198013079","","","0.7107","MoKα","","0.0586","0.0512","","0.0907","0.0847","","","","1.419","1.42","1.42","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008598","6.8422","0.0008","12.4","0.001","12.609","0.001","90","","94.825","0.008","90","","1066","0.17","130","0.1","130","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-allyl-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane","","- C9 H17 N O3 Si -","- C9 H17 N O3 Si -","- C36 H68 N4 O12 Si4 -","4","1","OA1074","White, Jonathan M.; Jones, Scott","Low-temperature structure of allyl silatrane","Acta Crystallographica Section C","1999","55","6","962","963","10.1107/S0108270199002371","","","0.71069","MoKα","","0.03","0.028","","","","0.074","","","","","","1.059","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008599","9.6615","0.001","9.7829","0.001","18.4857","0.001","101.784","0.01","96.993","0.01","115.568","0.01","1498.7","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Dichloro[ferrocene-1,1'-diylbis(diphenylphosphine-P)]cobalt(II)","","- C34 H28 Cl2 Co Fe P2 -","- C34 H28 Cl2 Co Fe P2 -","- C68 H56 Cl4 Co2 Fe2 P4 -","2","1","OB1001","Park, Tae-Jin; Huh, Seong; Kim, Youngmee; Jun, Moo-Jin","Dichloro[ferrocene-1,1'-diylbis(diphenylphosphine-<i>P</i>)]cobalt(II)","Acta Crystallographica Section C","1999","55","6","848","850","10.1107/S0108270199001183","","","0.71073","MoKα","","0.078","0.036","","","","0.095","","","","","","1.034","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008600","9.641","0.004","10.251","0.004","13.893","0.005","90","","101","0.03","90","","1347.8","0.9","150","","150","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H32 N2 O7 -","- C26 H32 N2 O7 -","- C52 H64 N4 O14 -","2","1","OB1005","Kazuhiro Yamato; Hiroyuki Miyake; Ken Hirotsu; Yoshitane Kojima","<i>N</i>-<i>tert</i>-Butoxycarbonyl-<i>N</i>,<i>N</i>'-ethylene-bridged (<i>S</i>)-tyrosyl-(<i>S</i>)-tyrosine methyl ester","Acta Crystallographica Section C","1999","55","6","1023","1025","10.1107/S0108270199002449","","","0.7107","MoKα","","","0.039","","","0.042","","","","","1.962","1.962","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008601","9.713","0.002","12.079","0.003","7.716","0.002","93.11","0.02","106.85","0.02","81.92","0.02","857.7","0.4","224.4","","","","","","","","","","","5","P -1","-P 1","2","","Bis(2-methyl-8-quinolinolate)tin(II)","","- C20 H16 N2 O2 Sn -","- C20 H16 N2 O2 Sn -","- C40 H32 N4 O4 Sn2 -","2","1","OB1007","Kitamura, Chitoshi; Yoneda, Akio; Sugiura, Ken-ichi; Sakata, Yoshiteru","Bis(2-methyl-8-quinolinolato-<i>N</i>,<i>O</i>)tin(II)","Acta Crystallographica Section C","1999","55","6","876","878","10.1107/S0108270199002887","","","0.7107","MoKα","","0.034","0.031","","0.089","","0.089","","","1.551","","","1.551","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008602","11.6141","0.0015","15.9238","0.0014","15.115","0.002","90","","100.31","0.01","90","","2750.2","0.6","294","2","294","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H38 B9 P -","- C25 H38 B9 P -","- C100 H152 B36 P4 -","4","1","OS1036","Sillanpää, Reijo; Pedrajas, Josefina; Viñas, Clara; Teixidor, Frances; Kivekäs, Raikko","(PMePh~3~)(7,8-Et~2~-7,8-<i>nido</i>-C~2~B~9~H~10~)","Acta Crystallographica Section C","1999","55","6","1008","1009","10.1107/S0108270199002516","","","0.71069","MoKα","","0.1762","0.0657","","","","0.1491","","","","","","1.006","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008603","9.3229","0.0003","9.2536","0.0001","14.0823","0.0004","90","","90","","90","","1214.89","0.05","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","μ-oxalato-O,O',O'', O''')(2,2'-bipyridine-N,N')Fe(II)","","- C12 H8 Fe N2 O4 -","- C12 H8 Fe N2 O4 -","- C48 H32 Fe4 N8 O16 -","4","1","OS1041","Fun, Hoong-Kun; Shanmuga Sundara Raj, S.; Fang, Xia; Zheng, Li-Min; Xin, Xin-Quan","<i>catena</i>-Poly[[(2,2'-bipyridine)iron(II)]-μ-oxalato]","Acta Crystallographica Section C","1999","55","6","903","905","10.1107/S0108270199001924","","","0.71073","MoKα","","0.13","0.057","","0.092","0.072","","","","1.112","1.158","1.158","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008604","9.8412","0.0006","15.6366","0.0007","9.4044","0.0005","90","","90","","90","","1447.18","0.13","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","6,7-dihydroxy-1-(2-methoxypropyl)-1,2,3,4-tetrahydroisoquinolinium chloride hydrate","","- C13 H22 Cl N O4 -","- C13 H22 Cl N O4 -","- C52 H88 Cl4 N4 O16 -","4","1","OS1043","Domagała, Małgorzata; Rybarczyk, Agnieszka J.; Olszak, Tomasz A.; Brzezińska, Elżbieta","X-ray investigations of potential β-blockers. IV","Acta Crystallographica Section C","1999","55","6","1003","1005","10.1107/S0108270199002383","","","1.54178","CuKα","","0.035","0.029","","","","0.08","","","","","","1.04","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008605","6.9675","0.0001","9.5232","0.0002","11.0979","0.0003","97.556","0.001","104.298","0.001","95.403","0.001","701.2","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","5-(2-Chlorophenyl)-4-phenyl-4H-1,2,4-triazole-3-thione","","- C14 H10 Cl N3 S -","- C14 H10 Cl N3 S -","- C28 H20 Cl2 N6 S2 -","2","1","OS1044","Puviarasan, K.; Govindasamy, L.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Jayanthi, G.; Hoong-Kun Fun","5-(2-Chlorophenyl)-4-phenyl-3,4-dihydro-2<i>H</i>-1,2,4-triazole-3-thione","Acta Crystallographica Section C","1999","55","6","951","953","10.1107/S0108270199002796","","","0.71073","MoKα","","0.052","0.041","","","","0.109","","","","","","1.018","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008606","9.4282","0.0011","18.717","0.0012","19.6325","0.0012","90","","103","0.002","90","","3375.7","0.5","295","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H34 I2 N4 Ni O2 Zn -","- C31 H34 I2 N4 Ni O2 Zn -","- C124 H136 I8 N16 Ni4 O8 Zn4 -","4","1","OS1045","Arıcı, Cengiz; Ercan, Filiz; Atakol, Orhan; Akay, Abdülkadir; Ülkü, Dinçer","{[μ-Bis(salicylidene)-1,3-propanediaminato]-bis(3,5-dimethylpyridine)nickel(II)}diiodozinc(II)","Acta Crystallographica Section C","1999","55","6","928","930","10.1107/S0108270199002802","","","0.71073","MoKα","","","0.025","","","0.033","","","","","0.98","0.98","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008607","7.2691","0.0007","10.4214","0.0013","16.868","0.002","90","","90","","90","","1277.8","0.3","122","0.5","122","0.5","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(S)-2-amino-3-methyl-1-butanol-(2S,3S)-hydrogen-tartrate monohydrate","","- C9 H21 N O8 -","- C9 H21 N O8 -","- C36 H84 N4 O32 -","4","1","OS1047","Bruun, Rikke Mattsson; Larsen, Sine","(<i>S</i>)-2-Amino-3-methyl-1-butanol (2<i>S</i>,3<i>S</i>)-hydrogen tartrate monohydrate","Acta Crystallographica Section C","1999","55","6","956","958","10.1107/S0108270199003042","","","1.54184","CuKα","","0.0262","0.0256","","","","0.0731","","","","","","1.077","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008608","9.7934","0.0002","9.5005","0.0001","15.2958","0.0001","90","","102.297","0.001","90","","1390.5","0.03","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-methyl-3-(2-methylphenyl)-1,2,4-triazolo-[3,4-b][1,3]benzothiazole","","- C16 H13 N3 S -","- C16 H13 N3 S -","- C64 H52 N12 S4 -","4","1","OS1049","Puviarasan, K.; Govindasamy, L.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Jayanthi, G.; Hoong-Kun Fun","7-Methyl-3-(2-methylphenyl)-1,2,4-triazolo[3,4-<i>b</i>][1,3]benzothiazole, (I), and 7-methyl-3-(4-methylphenyl)-1,2,4-triazolo[3,4-<i>b</i>][1,3]benzothiazole, (II)","Acta Crystallographica Section C","1999","55","6","948","951","10.1107/S0108270199000864","","","0.71073","MoKα","","0.119","0.056","","","","0.163","","","","","","0.959","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008609","24.482","0.0012","7.5509","0.0004","7.506","0.0004","90","","90","","90","","1387.57","0.12","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","7-methyl-3-(4-methylphenyl)-1,2,4-triazolo-[3,4-b][1,3]benzothiazole","","- C16 H13 N3 S -","- C16 H13 N3 S -","- C64 H52 N12 S4 -","4","1","OS1049","Puviarasan, K.; Govindasamy, L.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Jayanthi, G.; Hoong-Kun Fun","7-Methyl-3-(2-methylphenyl)-1,2,4-triazolo[3,4-<i>b</i>][1,3]benzothiazole, (I), and 7-methyl-3-(4-methylphenyl)-1,2,4-triazolo[3,4-<i>b</i>][1,3]benzothiazole, (II)","Acta Crystallographica Section C","1999","55","6","948","951","10.1107/S0108270199000864","","","0.71073","MoKα","","0.064","0.048","","","","0.125","","","","","","1.016","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008610","6.573","0.005","10.687","0.005","30.531","0.005","90","","90","","90","","2144.7","1.9","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","2,4-dicholoro-5-nitrobenzoic sodium dihydrate","","- C7 H6 Cl2 N Na O6 -","- C7 H6 Cl2 N Na O6 -","- C56 H48 Cl16 N8 Na8 O48 -","8","1","QA0071","Morales, Angel Dago; Novoa de Armas, Héctor; Lisbet Xuárez Marill; Rolando Pellón Comdom; García-Granda, Santiago","Sodium 2,4-dichloro-5-nitrobenzoate dihydrate","Acta Crystallographica Section C","1999","55","6","IUC9900056","","10.1107/S0108270199099382","","","0.71069","MoKα","","0.122","0.057","","0.197","0.138","","","","1.204","1.266","1.266","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008611","7.507","0.001","7.507","0.001","7.507","0.001","92.29","0.02","92.29","0.02","92.29","0.02","422.02","0.1","293","2","293","2","","","","","","","","5","R -3 :R","-P 3*","148","Sodium iodide tris(1,4-dioxane)","","","- C12 H24 I Na O6 -","- C12 H24 I Na O6 -","- C12 H24 I Na O6 -","1","0.166667","QA0095","Belsky, Vitaly K.; Maslennikova, Vera I.","Sodium tris(1,4-dioxane) iodide","Acta Crystallographica Section C","1999","55","6","IUC9900057","","10.1107/S0108270199099370","","","0.71073","MoKα","","0.022","0.022","","","","0.063","","","","","","1.108","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008612","8.1525","0.0005","7.9948","0.0005","12.7269","0.0006","90","","108.008","0.004","90","","788.87","0.08","293","2","293","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","none","Bis(3-acetylamino-1,2,4-triazole-O,N^4^) dinitratocopper (II)","","- C8 H12 Cu N10 O8 -","- C8 H12 Cu N10 O8 -","- C16 H24 Cu2 N20 O16 -","2","0.5","QA0112","Virovets, Alexander V.; Naumov, Dmitry Yu.; Lavrenova, Ludmila G.; Bushuev, Mark B.","Bis(3-acetylamino-1,2,4-triazole-<i>O</i>,<i>N</i>^4^)bis(nitrato-<i>O</i>)copper(II)","Acta Crystallographica Section C","1999","55","6","IUC9900059","","10.1107/S0108270199099357","","","0.71069","MoKα","","0.04","0.034","","","","0.104","","","","","","1.08","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008613","6.676","0.001","5.567","0.0009","11.471","0.003","90","","103.88","0.04","90","","413.87","0.16","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","N,N'-Dimethyl-2,2'-biimidazole","","- C8 H10 N4 -","- C8 H10 N4 -","- C16 H20 N8 -","2","0.5","QA0113","Therrien, Bruno; Beauchamp, André L.","1,1'-Dimethyl-2,2'-biimidazole","Acta Crystallographica Section C","1999","55","6","IUC9900054","","10.1107/S0108270199099321","","","0.71069","MoKα","","0.048","0.036","","0.088","","0.084","","","0.911","","","1.027","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008614","11.046","0.001","12.545","0.001","13.624","0.001","90","","90","","90","","1887.9","0.3","298","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H24 Br4 -","- C17 H24 Br4 -","- C68 H96 Br16 -","4","1","QA0114","Auhmani, A.; Kossareva, E.; Lassaba, E.; Réglier, M.; Pierrot, M.; Benharref, A.","Cyclopropanation reactions on α-<i>cis</i>-himachalene and a β-himachalene","Acta Crystallographica Section C","1999","55","6","IUC9900055","","10.1107/S010827019909931X","","","0.71073","MoKα","","","0.041","","","0.071","","","","","1.65","1.65","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008615","11.018","0.001","12.278","0.001","13.299","0.001","90","","90","","90","","1799.1","0.3","298","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C17 H24 Cl4 -","- C17 H24 Cl4 -","- C68 H96 Cl16 -","4","1","QA0114","Auhmani, A.; Kossareva, E.; Lassaba, E.; Réglier, M.; Pierrot, M.; Benharref, A.","Cyclopropanation reactions on α-<i>cis</i>-himachalene and a β-himachalene","Acta Crystallographica Section C","1999","55","6","IUC9900055","","10.1107/S010827019909931X","","","0.71073","MoKα","","","0.048","","","0.131","","","","","1.484","1.484","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008616","9.599","0.001","11.922","0.001","13.517","0.001","90","","90","","90","","1546.9","0.2","298","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H24 Cl2 -","- C16 H24 Cl2 -","- C64 H96 Cl8 -","4","1","QA0114","Auhmani, A.; Kossareva, E.; Lassaba, E.; Réglier, M.; Pierrot, M.; Benharref, A.","Cyclopropanation reactions on α-<i>cis</i>-himachalene and a β-himachalene","Acta Crystallographica Section C","1999","55","6","IUC9900055","","10.1107/S010827019909931X","","","0.71073","MoKα","","","0.063","","","0.134","","","","","1.469","1.469","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008617","7.153","0.001","11.035","0.002","26.824","0.004","90","","90","","90","","2117.3","0.6","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(1S,2R)-di-p-methoxyphenyl ammonium alcohol-L-tartrate-water","","- C20 H27 N O10 -","- C20 H27 N O10 -","- C80 H108 N4 O40 -","4","1","QA0116","Jian, Liao; Chen, Daimo; Jiang, Yaozhong; Yu, Kaibei; Chan, Albert S. C.","[2-Hydroxy-(1<i>S</i>,2<i>R</i>)-1,2-bis(4-methoxyphenyl)ethyl]ammonium <small>L</small>-tartrate hydrate","Acta Crystallographica Section C","1999","55","6","IUC9900053","","10.1107/S0108270199099308","","","0.71073","MoKα","","0.067","0.036","","0.103","0.073","","","","0.826","0.973","0.973","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008618","5.993","0.004","5.993","0.004","12.574","0.008","90","","90","","90","","451.6","0.5","150","2","150","2","","","","","","","","4","I 41/a :2","-I 4ad","88","ammonium periodate","Ammonium tetraoxoiodate(VII)","","- H4 I N O4 -","- H4 I N O4 -","- H16 I4 N4 O16 -","4","0.25","QA0117","Levason, William; Webster, Michael","Ammonium tetraoxoiodate(VII)","Acta Crystallographica Section C","1999","55","6","IUC9900052","","10.1107/S0108270199099394","","","0.71073","MoKα","","0.022","0.018","","","","0.049","","","","","","1.091","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008619","7.3408","0.0002","8.632","0.0002","15.0033","0.0003","73.476","0.001","85.741","0.001","70.288","0.001","857.78","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","hexaaquonickel(II) diaquo-μ-triethylenetetraaminehexaacetatodinickel(II) tetrahydrate","","- C18 H48 N4 Ni3 O24 -","- C18 H48 N4 Ni3 O24 -","- C18 H48 N4 Ni3 O24 -","1","0.5","QA0118","Li, Dong-Feng; Liao, Zhan-Ru; Xiong, Yun","A dinuclear nickel(II) complex with triethylenetetraaminehexaacetic acid","Acta Crystallographica Section C","1999","55","6","IUC9900058","","10.1107/S0108270199099369","","","0.71073","MoKα","","0.033","0.028","","0.077","0.075","","","","1.026","1.08","1.08","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008620","15.7794","0.0004","4.8525","0.0002","9.8771","0.0003","90","","97.952","0.001","90","","749.01","0.04","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","DL-aminophenyl acetic acid","DL-2-amino-2-phenyl ethanoic acid","","- C8 H9 N O2 -","- C8 H9 N O2 -","- C32 H36 N4 O8 -","4","1","QA0123","Dalhus, Bjørn; Görbitz, Carl Henrik","<small>DL</small>-Aminophenylacetic acid","Acta Crystallographica Section C","1999","55","6","IUC9900061","","10.1107/S0108270199099291","","","0.71073","MoKα","","0.097","0.058","","0.158","","0.139","","","1.033","","","1.11","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008621","8.5125","0.0002","18.262","0.0004","11.2164","0.0002","90","","105.328","0.001","90","","1681.62","0.06","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C28 H24 Cl8 P2 Pd -","- C28 H24 Cl8 P2 Pd -","- C56 H48 Cl16 P4 Pd2 -","2","0.5","QA0124","Juanatey, Pilar; Suárez, Antonio; López, Margarita; Vila, José M.; Ortigueira, Juan M.; Fernández, Alberto","<i>cis</i>-[1,2-Bis(diphenylphosphino)ethene]dichloropalladium(II) bis(trichloromethane) solvate","Acta Crystallographica Section C","1999","55","6","IUC9900062","","10.1107/S0108270199099345","","","0.71073","MoKα","","0.054","0.041","","","","0.116","","","","","","1.028","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008622","9.6489","0.0009","13.0543","0.0011","14.1245","0.0007","90","","101.173","0.006","90","","1745.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","8-Chloro-11-(4-methylpiperazin-1-yl)dibenzo[b,f]-1,4-selenazepine","","- C18 H18 Cl N3 Se -","- C18 H18 Cl N3 Se -","- C72 H72 Cl4 N12 Se4 -","4","1","QA0125","Dupont, Léon; Pignon, Bernard; Christiaens, Léon","8-Chloro-11-(4-methylpiperazin-1-yl)dibenzo[<i>b</i>,<i>f</i>]-1,4-selenazepine","Acta Crystallographica Section C","1999","55","6","IUC9900064","","10.1107/S010827019909928X","","","1.5418","CuKα","","0.049","0.035","","","","0.1","","","","","","1.007","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008623","21.913","0.002","5.254","0.002","23.553","0.002","90","","112.41","0.02","90","","2506.9","1.1","293","2","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","6-(cyclohexylmethylene)salicylic acid","","- C14 H18 O3 -","- C14 H18 O3 -","- C112 H144 O24 -","8","1","QA0126","Bourne, Susan A; Green, Ivan R; Tocoli, Felismino E","Analogues of anacardic acids: 6-(cyclohexylmethyl)salicylic acid and 6-(2-cyclohexylethyl)salicylic acid","Acta Crystallographica Section C","1999","55","6","IUC9900063","","10.1107/S0108270199099278","","","0.7107","MoKα","","","0.0513","","","","0.1741","","","","","","1.056","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008624","12.2361","0.0008","17.152","0.002","6.4725","0.0006","90","","97.01","0.004","90","","1348.3","0.2","293","2","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6-(2'-cyclohexylethylene)salicylic acid","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","QA0126","Bourne, Susan A; Green, Ivan R; Tocoli, Felismino E","Analogues of anacardic acids: 6-(cyclohexylmethyl)salicylic acid and 6-(2-cyclohexylethyl)salicylic acid","Acta Crystallographica Section C","1999","55","6","IUC9900063","","10.1107/S0108270199099278","","","0.7107","MoKα","","","0.0628","","","","0.2205","","","","","","1.075","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008625","11.9149","0.0005","16.8717","0.0006","18.1365","0.0004","90","","106.193","0.006","90","","3501.2","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Triquinolinium hexanitratolanthate(III) monohydrate","","- C27 H26 La N9 O19 -","- C27 H26 La N9 O19 -","- C108 H104 La4 N36 O76 -","4","1","QA0127","Yong Cui; Fakun Zheng; Jiutong Chen; Jinshun Huang","Triquinolinium hexanitratolanthate(III) monohydrate","Acta Crystallographica Section C","1999","55","6","IUC9900065","","10.1107/S0108270199099333","","","0.71073","MoKα","","0.036","0.029","","0.066","","0.064","","","1.153","","","1.171","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008626","5.91","0.001","11.21","0.002","15.961","0.002","90","","90","","90","","1057.4","0.3","292","2","292","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H15 O2 P -","- C11 H15 O2 P -","- C44 H60 O8 P4 -","4","1","QB0096","Deng, Jingen; He, Ze; Yu, Kaibai; Mi, Aiqiao; Jiang, Yaozhong","(2<i>R</i>,<i>S</i>~P~)-2-Hydroxymethyl-1-phenylphospholane 1-oxide","Acta Crystallographica Section C","1999","55","6","IUC9900060","","10.1107/S0108270199099266","","","0.71073","MoKα","","0.035","0.03","","0.075","0.074","","","","0.984","1.035","1.035","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008627","12.193","0.001","17.562","0.002","21.84","0.003","90","","97.71","0.01","90","","4634.4","0.9","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-poly[triphenyltin-μ-(N,N-dimethylthiocarbamoylacetato)-O:O']}","","- C23 H23 N O3 S Sn -","- C23 H23 N O3 S Sn -","- C184 H184 N8 O24 S8 Sn8 -","8","2","SK1236","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng","Triphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate, triphenyltin <i>N</i>,<i>N</i>-pentamethylenecarbamoylthioacetate and cyclopentyldiphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate","Acta Crystallographica Section C","1999","55","6","889","894","10.1107/S0108270199001286","","","0.71073","MoKα","","0.068","0.042","","","","0.108","","","","","","1.018","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008628","27.404","0.001","17.855","0.001","21.682","0.001","90","","98.11","0.01","90","","10502.9","0.9","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","catena-poly[triphenyltin-μ-(N,N-pentamethylenecarbamoylthioacetato)-O:O']}","","- C26 H27 N O3 S Sn -","- C26 H27 N O3 S Sn -","- C416 H432 N16 O48 S16 Sn16 -","16","2","SK1236","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng","Triphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate, triphenyltin <i>N</i>,<i>N</i>-pentamethylenecarbamoylthioacetate and cyclopentyldiphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate","Acta Crystallographica Section C","1999","55","6","889","894","10.1107/S0108270199001286","","","0.71073","MoKα","","0.104","0.057","","","","0.169","","","","","","1.095","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008629","12.307","0.002","17.528","0.002","21.781","0.004","90","","97.77","0.01","90","","4655.4","1.3","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Sn(C5H9)(C6H5)2(C5H8NO3S)]","catena-poly[cyclopentyldiphenyltin-μ-(N,N-dimethylthiocarbamoylacetato)-O:O']}","","- C22 H27 N O3 S Sn -","- C22 H27 N O3 S Sn -","- C176 H216 N8 O24 S8 Sn8 -","8","2","SK1236","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng","Triphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate, triphenyltin <i>N</i>,<i>N</i>-pentamethylenecarbamoylthioacetate and cyclopentyldiphenyltin <i>N</i>,<i>N</i>-dimethylthiocarbamoylacetate","Acta Crystallographica Section C","1999","55","6","889","894","10.1107/S0108270199001286","","","0.71073","MoKα","","0.138","0.062","","","","0.185","","","","","","1.049","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008630","8.9654","0.0003","9.6447","0.0003","20.0666","0.0005","78.475","0.001","81.518","0.001","83.786","0.001","1675.99","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","{4,4'-Dimethyl-6,6'-bis(1-morpholiniomethyl)-2,2'-[1,2- ethanediylbis(nitrilomethylidene-N)]diphenolato-O,O'}copper(II) diperchlorate monohydrate","","- C28 H40 Cl2 Cu N4 O13 -","- C28 H40 Cl2 Cu N4 O13 -","- C56 H80 Cl4 Cu2 N8 O26 -","2","1","SK1242","S. Shanmuga Sundara Raj; R. Thirumurugan; G. Shanmugam; Hoong-Kun Fun; J. Manonmani; M. Kandaswamy","{4,4'-Dimethyl-6,6'-bis(1-morpholiniomethyl)-2,2'-[1,2-ethanediylbis(nitrilomethylidene-<i>N</i>)]diphenolato-<i>O</i>,<i>O</i>'}copper(II) diperchlorate monohydrate","Acta Crystallographica Section C","1999","55","6","894","896","10.1107/S0108270199001298","","","0.71073","MoKα","","0.106","0.068","","","","0.182","","","","","","1.117","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008631","7.3215","0.0001","17.3709","0.0002","13.3435","0.0002","90","","90","","90","","1697.04","0.04","173","","173","","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C14 H18 Cl4 N2 Ti -","- C14 H18 Cl4 N2 Ti -","- C56 H72 Cl16 N8 Ti4 -","4","","SK1252","Hensen, Karl; Lemke, Alexander; Bolte, Michael","Addition compounds of titanium tetrachloride with aromatic nitrogen bases","Acta Crystallographica Section C","1999","55","6","863","867","10.1107/S0108270199000554","","","0.71073","MoKα","","0.0351","0.029","","0.068","0.0651","0.068","","","1.108","","","1.108","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008632","7.184","0.001","8.014","0.002","14.151","0.003","90","","90","","90","","814.7","0.3","173","","173","","","","","","","","","5","P m n a","-P 2ac 2","53","","","","- C12 H14 Cl4 N2 Ti -","- C12 H14 Cl4 N2 Ti -","- C24 H28 Cl8 N4 Ti2 -","2","0.25","SK1252","Hensen, Karl; Lemke, Alexander; Bolte, Michael","Addition compounds of titanium tetrachloride with aromatic nitrogen bases","Acta Crystallographica Section C","1999","55","6","863","867","10.1107/S0108270199000554","","","0.71073","MoKα","","0.0556","0.0471","","0.1086","0.1062","0.1086","","","1.31","","","1.31","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008633","7.8998","0.0002","9.9722","0.0003","16.0448","0.0005","107.54","0.001","93.784","0.001","99.551","0.001","1179.43","0.06","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H40 Cl16 N12 Ti3 -","- C24 H40 Cl16 N12 Ti3 -","- C24 H40 Cl16 N12 Ti3 -","1","0.5","SK1252","Hensen, Karl; Lemke, Alexander; Bolte, Michael","Addition compounds of titanium tetrachloride with aromatic nitrogen bases","Acta Crystallographica Section C","1999","55","6","863","867","10.1107/S0108270199000554","","","0.71073","MoKα","","0.0829","0.0463","","0.0933","0.0823","0.0933","","","1.039","","","1.039","","","","has coordinates","219800","2020-10-21","18:00:00",""
"2008634","7.888","0.001","8.643","0.001","29.832","0.001","90","","90","","90","","2033.8","0.4","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3R,6S,1'R)-3-(1-Naphth-1-yl-2-nitro-ethyl)-6-isopropyl-2,5- dimethoxy-3,6-dihydro-pyrazine","","- C21 H25 N3 O4 -","- C21 H25 N3 O4 -","- C84 H100 N12 O16 -","4","1","SK1254","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 1. Compounds derived from <i>cyclo</i>(Gly-<small>L</small>-Val)","Acta Crystallographica Section C","1999","55","6","964","968","10.1107/S0108270199001304","","","1.5418","CuKα","","0.0358","0.0352","","","","0.113","","","","","","0.968","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008635","8.88","0.002","6.748","0.002","17.73","0.004","90","","100.42","0.03","90","","1044.9","0.5","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H27 N3 O6 -","- C19 H27 N3 O6 -","- C38 H54 N6 O12 -","2","1","SK1254","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 1. Compounds derived from <i>cyclo</i>(Gly-<small>L</small>-Val)","Acta Crystallographica Section C","1999","55","6","964","968","10.1107/S0108270199001304","","","0.71069","MoKα","","0.1453","0.0694","","","","0.1701","","","","","","1.126","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008636","8.514","0.001","9.301","0.001","20.119","0.002","90","","90","","90","","1593.2","0.3","293","","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H24 N2 O4 -","- C14 H24 N2 O4 -","- C56 H96 N8 O16 -","4","1","SK1254","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 1. Compounds derived from <i>cyclo</i>(Gly-<small>L</small>-Val)","Acta Crystallographica Section C","1999","55","6","964","968","10.1107/S0108270199001304","","","0.71069","MoKα","","0.0481","0.0436","","","","0.121","","","","","","1.049","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008637","8.211","0.001","9.254","0.001","20.861","0.002","90","","90","","90","","1585.1","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3R,6S)-3-[(R)-Hydroxy-phenyl-methyl]-6-isopropyl-2,5-dimethoxy- 3,6-dihydro-pyrazine","","- C16 H22 N2 O3 -","- C16 H22 N2 O3 -","- C64 H88 N8 O12 -","4","1","SK1254","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 1. Compounds derived from <i>cyclo</i>(Gly-<small>L</small>-Val)","Acta Crystallographica Section C","1999","55","6","964","968","10.1107/S0108270199001304","","","0.71069","MoKα","","0.0518","0.0432","","0.1213","0.1147","","","","1.136","1.18","1.18","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008638","5.803","0.001","10.486","0.001","14.762","0.001","90","","90.05","0.01","90","","898.27","0.19","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(3RS,6SR)-3,6-Dibenzyl-2,5-dimethoxy-3,6-dihydro-pyrazine","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C40 H44 N4 O4 -","2","0.5","SK1255","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 2. Benzyl-substituted compounds","Acta Crystallographica Section C","1999","55","6","968","973","10.1107/S010827019801645X","","","0.71069","MoKα","","0.0426","0.0369","","0.1076","0.1025","","","","1.041","1.088","1.088","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008639","10.998","0.001","11.513","0.001","14.464","0.001","90","","90","","90","","1831.4","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3S,6S)-3,6-Dibenzyl-2,5-dimethoxy-3,6-dihydro-pyrazine","","- C20 H22 N2 O2 -","- C20 H22 N2 O2 -","- C80 H88 N8 O8 -","4","1","SK1255","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 2. Benzyl-substituted compounds","Acta Crystallographica Section C","1999","55","6","968","973","10.1107/S010827019801645X","","","0.71069","MoKα","","0.0514","0.0418","","0.1032","0.0971","","","","1.08","1.121","1.121","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008640","5.88","0.001","7.449","0.001","11.197","0.001","98.41","0.01","90.13","0.01","91.97","0.01","484.86","0.11","293","","293","","","","","","","","","5","P 1","P 1","1","","(3R,6S)-3-Benzyl-6-pentafluorophenyl-methyl-2,5-dimethoxy- 3,6-dihydro-pyrazine","","- C20 H17 F5 N2 O2 -","- C20 H17 F5 N2 O2 -","- C20 H17 F5 N2 O2 -","1","1","SK1255","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 2. Benzyl-substituted compounds","Acta Crystallographica Section C","1999","55","6","968","973","10.1107/S010827019801645X","","","1.5418","CuKα","","0.0386","0.0371","","0.1137","0.1107","","","","1.05","1.056","1.056","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008641","6.441","0.001","9.036","0.001","32.996","0.004","90","","90","","90","","1920.4","0.4","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3R,6S)-3-Benzyl-6-(cyclohexyl-methyl)-2,5-dimethoxy- 3,6-dihydro-pyrazine","","- C20 H28 N2 O2 -","- C20 H28 N2 O2 -","- C80 H112 N8 O8 -","4","1","SK1255","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 2. Benzyl-substituted compounds","Acta Crystallographica Section C","1999","55","6","968","973","10.1107/S010827019801645X","","","0.71069","MoKα","","0.1064","0.0626","","0.1584","0.1344","","","","1.046","1.167","1.167","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008642","6.86","0.001","16.461","0.001","20.386","0.002","90","","90","","90","","2302","0.4","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H30 N2 O4 -","- C24 H30 N2 O4 -","- C96 H120 N8 O16 -","4","1","SK1255","Bolte, Michael; Benecke, Bernd; Egert, Ernst","Bis-lactim ethers of cyclic dipeptides. 2. Benzyl-substituted compounds","Acta Crystallographica Section C","1999","55","6","968","973","10.1107/S010827019801645X","","","0.71069","MoKα","","0.0637","0.0429","","0.1078","0.0964","","","","1.032","1.112","1.112","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008643","5.7445","0.0008","5.7445","0.0008","17.235","0.005","90","","90","","120","","492.55","0.17","293","2","293","2","","","","","","","","5","P -3 c 1","-P 3 2""c","165","Bi nitro aluminate","Tetracalcium dialuminium hydroxide binitrate tetrahydrate","","- Al2 Ca4 H20 N2 O22 -","- Al2 Ca4 H12 N2.0004 O22.0016 -","- Al2 Ca4 H12 N2.0004 O22.0016 -","1","0.0833333","SK1257","Renaudin, Guillaume; François, Michel","The lamellar double-hydroxide (LDH) compound with composition 3CaO^.^Al~2~O~3~^.^Ca(NO~3~)~2~^.^10H~2~O","Acta Crystallographica Section C","1999","55","6","835","838","10.1107/S0108270199003066","","","0.71073","MoKα","","0.039","0.036","","","","0.1","","","","","","1.164","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008644","13.492","0.0002","9.6317","0.0001","16.9975","0.0003","90","","90","","90","","2208.84","0.06","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","Diazidobis-1,10-phenanthroline manganese(II)","","- C24 H16 Mn N10 -","- C24 H16 Mn N10 -","- C96 H64 Mn4 N40 -","4","0.5","SK1267","Shen, Zhen; Zuo, Jing-Lin; Chinnakali, Kandasamy; Fun, Hoong-Kun; You, Xiao-Zeng","Diazidobis(1,10-phenanthroline-<i>N</i>,<i>N</i>')manganese(II)","Acta Crystallographica Section C","1999","55","6","901","903","10.1107/S010827019900181X","","","0.71073","MoKα","","0.048","0.037","","","","0.118","","","","","","1.063","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008645","11.6166","0.0009","8.2634","0.0008","18.2929","0.0018","90","","98.856","0.007","90","","1735","0.3","295","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 Cl2 Cu N2 O2 Zn -","- C17 H16 Cl2 Cu N2 O2 Zn -","- C68 H64 Cl8 Cu4 N8 O8 Zn4 -","4","1","SK1278","Tatar, Leyla; Atakol, Orhan; Ülkü, Dinçer; Aksu, Mecit","{[μ-Bis(salicylidene)-1,3-propanediaminato]-copper(II)}dichlorozinc(II)","Acta Crystallographica Section C","1999","55","6","923","925","10.1107/S0108270199003091","","","0.71073","MoKα","","","0.031","","","","0.038","","","","","","0.99","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008646","16.4555","0.0009","16.4555","0.0009","44.178","0.005","90","","90","","120","","10360","1.4","296","2","296","2","","","","","","","","7","R 3 c :H","R 3 -2""c","161","","μ~3~-iodine-2:3:4κ^3^I-sulfido-1κS-tri-μ~3~-sulfido-1:2:3κ^3^S; 1:2:4κ^3^S;-1:3:4κ^3^S-tris(triphenylphosphine)-2κP;3κP;4κP","","- C72 H60 Ag3 I P4 S5 W -","- C72 H60 Ag3 I P4 S5 W -","- C432 H360 Ag18 I6 P24 S30 W6 -","6","0.333333","TA1221","Jin, Qiong-Hua; Xin, Xiu-Lan; Deng, Yu-Heng; Yu, Kai-Bei","μ~3~-Iodo-2:3:4κ^3^<i>I</i>-tri-μ~3~-sulfido-1:2:3κ^3^<i>S</i>;1:2:4κ^3^<i>S</i>;1:3:4κ^3^<i>S</i>-sulfido-1κ<i>S</i>-tris(triphenylphosphine)-2κ<i>P</i>,3κ<i>P</i>,4κ<i>P</i>-trisilvertungsten‒triphenylphosphine sulfide (1/1)","Acta Crystallographica Section C","1999","55","6","860","863","10.1107/S0108270199002978","","","0.71073","MoKα","","","0.029","","","","0.071","","","","","","1.007","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008647","7.552","0.002","18.013","0.003","8.057","0.002","90","","105.02","0.02","90","","1058.6","0.4","296.2","","296.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H24 Cl4 Ru2 -","- C19.992 H18.624 Cl4 Ru2 -","- C39.984 H37.248 Cl8 Ru4 -","2","0.5","TA1223","Mark Bown; Martin A. Bennett","Di-μ-chloro-bis{chloro[(4a,5,6,7,8,8a-η^6^)-1,2,3,4-tetrahydronaphthalene]ruthenium(II)}","Acta Crystallographica Section C","1999","55","6","852","854","10.1107/S0108270199002589","","","0.7107","MoKα","","0.038","0.027","","0.036","","0.035","","","1.792","","","1.916","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008648","6.264","0.002","9.035","0.004","22.362","0.009","90","","90","","90","","1265.6","0.9","152","2","152","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-D-3,4-anhydro-1,2:5,6-di-O-isopropylidene-allo-inositol","","- C12 H18 O5 -","- C12 H18 O5 -","- C48 H72 O20 -","4","1","TA1231","Falshaw, Andrew; Gainsford, Graeme J.; Lensink, Cornelis","1-<small>D</small>-3,4-Anhydro-1,2:5,6-di-<i>O</i>-isopropylidene-<i>allo</i>-inositol","Acta Crystallographica Section C","1999","55","6","958","960","10.1107/S0108270199002607","","","0.71073","MoKα","","0.095","0.051","","0.093","0.081","","","","1.042","1.128","1.128","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008649","6.411","0.002","20.092","0.002","8.93","0.002","90","","103.24","0.02","90","","1119.7","0.5","248","","248","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H17 N O2 -","- C12 H17 N O2 -","- C48 H68 N4 O8 -","4","1","TA1232","Yoshihara, Ryouko; Hosomi, Hiroyuki; Aoyama, Hiromu; Ohba, Shigeru","<i>N</i>-(Isopropyl)norbornane-<i>endo</i>-2,3-dicarboximide","Acta Crystallographica Section C","1999","55","6","960","962","10.1107/S0108270199002619","","","1.54184","CuKα","","","0.065","","","","0.151","","","","","","1.96","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008650","9.0204","0.0001","13.9921","0.0002","15.898","0.0001","106.022","0.001","90.673","0.001","98.479","0.001","1904.63","0.04","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(μ-hydrido)(μ-2-hydroxyethoxy)decacarbonyltriosmium","","- C12 H6 O12 Os3 -","- C12 H6 O12 Os3 -","- C48 H24 O48 Os12 -","4","2","TA1235","Leong, Weng Kee; Lum, Mien Wei","Decacarbonyl(μ-hydrido)(μ-2-hydroxyethoxy)triosmium","Acta Crystallographica Section C","1999","55","6","881","882","10.1107/S0108270199002620","","","0.71073","MoKα","","0.075","0.051","","","","0.141","","","","","","1.006","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008651","9.656","0.001","5.592","0.001","15.788","0.001","90","","102.68","0.01","90","","831.7","0.18","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","1,2:3,4:5,6-Tri-O-isopropylidene-D-manitol","","- C15 H26 O6 -","- C15 H26 O6 -","- C30 H52 O12 -","2","1","BK1441","Ping Liu; Ting-Bin Wen; Jian-Kai Cheng","1,2:3,4:5,6-Tri-<i>O</i>-isopropylidene-<small>D</small>-mannitol","Acta Crystallographica Section C","1999","55","7","1179","1181","10.1107/S0108270199002759","","","0.71073","MoKα","","0.044","0.04","","0.099","0.098","","","","1.058","1.091","1.091","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008652","8.0857","0.0009","8.5118","0.0005","10.4161","0.0007","88.788","0.007","73.155","0.008","77.352","0.007","668.78","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-(4-carboxyl-2,6-dichlorophenylimino)imidazolidine dihydrate","","- C10 H13 Cl2 N3 O4 -","- C10 H13 Cl2 N3 O4 -","- C20 H26 Cl4 N6 O8 -","2","1","BK1445","E.M.Elssfah; K.Chinnakali; H.K.Fun; I.W.Mathison; E.K.Gan; M.Zubaid; T.W.Sam; C.Y.Tan","3,5-Dichloro-4-(imidazolidin-2-ylideneammonio)benzoate dihydrate","Acta Crystallographica Section C","1999","55","7","1115","1117","10.1107/S0108270199003832","","","0.71073","MoKα","","0.053","0.0383","","0.1104","0.1049","","","","1.045","1.162","1.162","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008653","7.5453","0.0003","12.0114","0.0005","13.5984","0.0005","109.342","0.001","99.98","0.001","98.593","0.001","1116.54","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H11 N3 O S -","- C11 H11 N3 O S -","- C44 H44 N12 O4 S4 -","4","2","BK1448","Puviarasan, K.; Govindasamy, L.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Jayanthi, G.; Hoong-Kun Fun","3-Cyclopropyl-1,2,4-triazolo[3,4-<i>b</i>]benzothiazole monohydrate","Acta Crystallographica Section C","1999","55","7","1119","1121","10.1107/S0108270199004448","","","0.71073","MoKα","","0.0421","0.0362","","","","0.1032","","","","","","1.052","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008654","17.1543","0.0008","10.7312","0.0005","20.6138","0.001","90","","101.618","0.001","90","","3717","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H45 Cl P2 Ru -","- C46 H45 Cl P2 Ru -","- C184 H180 Cl4 P8 Ru4 -","4","1","BK1451","Ilia A. Guzei; M. Angeles Paz-Sandoval; Román Torres-Lubian; Patricia Juarez-Saavedra","Chloro(pentamethyl-η^5^-cyclopentadienyl)bis(triphenylphosphine)ruthenium(II)","Acta Crystallographica Section C","1999","55","7","1090","1092","10.1107/S010827019900253X","","","0.71073","MoKα","","0.0485","0.0301","","","","0.0649","","","","","","1.038","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008655","5.275","0.003","9.747","0.004","11.451","0.005","96.44","0.03","84.11","0.03","78.88","0.04","569.4","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","aziridinyl","Bis(2,2-dimethylaziridinyl)phosphinic amide","","- C8 H18 N3 O P -","- C8 H18 N3 O P -","- C16 H36 N6 O2 P2 -","2","1","BK1457","Hempel, Andrew; Camerman, Norman; Mastropaolo, Donald; Camerman, Arthur","Bis(2,2-dimethylaziridinyl)phosphinic amide","Acta Crystallographica Section C","1999","55","7","1173","1175","10.1107/S0108270199003248","","","1.54178","CuKα","","0.045","0.042","","","","0.116","","","","","","1.08","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008656","18.409","0.002","7.2898","0.0006","5.6649","0.0004","90","","94.96","0.01","90","","757.37","0.12","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4-(1H-1,2,4-triazol-1-yl)phenol","","- C8 H7 N3 O -","- C8 H7 N3 O -","- C32 H28 N12 O4 -","4","1","BM1323","Foces-Foces, C.; Cabildo, P.; Claramunt, R. M.; Elguero, J.","4-(1<i>H</i>-1,2,4-Triazol-1-yl)phenol","Acta Crystallographica Section C","1999","55","7","1160","1163","10.1107/S0108270199003558","","","1.5418","CuKα","","0.061","0.051","","0.044","0.039","","","","0.903","0.895","0.895","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008657","8.41","0.002","11.116","0.002","12.122","0.002","95.24","0.03","108.29","0.03","93.24","0.03","1067.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Tetrakis(μ-phenylacetato-O:O')bis[(quinoline-N)cobalt(II)]","","- C50 H42 Co2 N2 O8 -","- C50 H42 Co2 N2 O8 -","- C50 H42 Co2 N2 O8 -","1","0.5","BM1324","Yong Cui; Fakun Zheng; Jinshun Huang","Tetrakis(μ-phenylacetato-<i>O</i>:<i>O</i>')bis[(quinoline-<i>N</i>)cobalt(II)]","Acta Crystallographica Section C","1999","55","7","1067","1069","10.1107/S0108270199004321","","","0.71073","MoKα","","0.056","0.047","","0.12","","0.116","","","1.041","","","1.084","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008658","20.412","0.003","20.412","0.003","10.482","0.002","90","","90","","90","","4367.3","1.2","120","","120","","","","","","","","","5","P 42/n :2","-P 4bc","86","","{μ-2,6-Bis(N-tert-butyliminomethylene)pyridine}rhodium(I) phenoxide","","- C21 H28 N3 O Rh -","- C21 H28 N3 O Rh -","- C168 H224 N24 O8 Rh8 -","8","1","BM1325","Kooijman, Huub; Kaagman, Jan Willem; Mach, Karel; Spek, Anthony L.; Schreurs, Antoine M.M.; Haarman, Hendrikus F.; Vrieze, Kees; Elsevier, Cornelis J.","[2,6-Bis(<i>N</i>-<i>tert</i>-butyliminomethyl)pyridine-κ^3^<i>N</i>](phenolato-κ<i>O</i>)rhodium(I)","Acta Crystallographica Section C","1999","55","7","1052","1054","10.1107/S0108270199003868","","","0.71073","MoKα","","0.06","0.057","","","","0.123","","","","","","1.454","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008659","10.581","0.001","10.089","0.001","5.8151","0.0008","90","","103.894","0.002","90","","602.61","0.12","296","","296","","","","","","","","","4","C 1 2/c 1","-C 2yc","","","","","- K Na O6 V2 -","- K Na O6 V2 -","- K4 Na4 O24 V8 -","4","0.5","BR1213","Yongkui Shan; Songping D. Huang","A potassium sodium double salt of metavanadate, KNa(VO~3~)~2~","Acta Crystallographica Section C","1999","55","7","1048","1050","10.1107/S0108270198017995","","","0.7107","MoKα","","0.035","0.025","","0.044","","0.037","","","0.87","","","0.831","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008660","17.749","0.003","9.021","0.003","9.059","0.002","90","","90","","90","","1450.5","0.6","293","2","293","2","","","","","","","","2","C m c a","-C 2ac 2","64","","pentabarium tetraantimonide","","- Ba5 Sb4 -","- Ba5 Sb4 -","- Ba20 Sb16 -","4","","BR1235","Derrien, Gaelle; Monconduit, Laure; Tillard, Monique; Belin, Claude","Pentabarium tetraantimonide, β-Ba~5~Sb~4~: a more symmetrical arrangement for the Ba~5~Sb~4~ compound","Acta Crystallographica Section C","1999","55","7","1044","1046","10.1107/S0108270199003984","","","0.71069","MoKα","","0.111","0.043","","","","0.102","","","","","","0.926","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008661","9.684","0.003","9.479","0.003","8.156","0.003","90","","95.33","0.02","90","","745.4","0.4","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,12-Diaza-6,9-diazoniadispiro[5.2.5.2]hexadecane dichloride","","- C12 H26 Cl2 N4 -","- C12 H26 Cl2 N4 -","- C24 H52 Cl4 N8 -","2","0.5","BR1236","Chernyshev, Vladimir V.; Yatsenko, Alexandr V.; Tafeenko, Victor A.; Makarov, Vadim A.; Sonneveld, Eduard J.; Schenk, Hendrik","3,12-Diaza-6,9-diazoniadispiro[5.2.5.2]hexadecane dichloride from X-ray powder data","Acta Crystallographica Section C","1999","55","7","1099","1101","10.1107/S0108270199004138","","","1.54059","CuKα~1~","","","","","","","","","","2.33","","","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008662","9.198","0.001","10.559","0.001","10.593","0.001","68.94","0.01","79.01","0.01","67.41","0.01","884.8","0.2","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H26 N2 O2 -","- C19 H26 N2 O2 -","- C38 H52 N4 O4 -","2","1","","Sievert, Mark; Nagel, Norbert; Bock, Hans; Dienelt, Rüdiger","Diisopropylammonium diphenylmethylnitronate at 200 K","Acta Crystallographica Section C","1999","55","","1149","1152","","","","","","","","0.0448","","","0.0965","","","","","","","","","","","has coordinates","31976","2020-10-21","18:00:00",""
"2008663","7.2665","0.0003","10.9212","0.0004","13.2862","0.0004","90","","96.477","0.001","90","","1047.65","0.07","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2-hydroxyethyl)diisopropylammonium chloride","","- C8 H20 Cl N O -","- C8 H20 Cl N O -","- C32 H80 Cl4 N4 O4 -","4","1","DE1104","Mahmoudkhani, Amir Hossein; Langer, Vratislav","(2-Hydroxyethyl)diisopropylammonium chloride and its derivatives","Acta Crystallographica Section C","1999","55","7","1163","1167","10.1107/S010827019900356X","","","0.71073","MoKα","","0.078","0.047","","","","0.124","","","","","","1.031","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008664","8.9772","0.0002","8.069","0.0001","15.3032","0.0002","90","","95.937","0.001","90","","1102.57","0.03","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2-chloroethyl)diisopropylammonium chloride","","- C8 H19 Cl2 N -","- C8 H19 Cl2 N -","- C32 H76 Cl8 N4 -","4","1","DE1104","Mahmoudkhani, Amir Hossein; Langer, Vratislav","(2-Hydroxyethyl)diisopropylammonium chloride and its derivatives","Acta Crystallographica Section C","1999","55","7","1163","1167","10.1107/S010827019900356X","","","0.71073","MoKα","","0.043","0.03","","","","0.08","","","","","","1.062","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008665","25.091","0.0006","6.7447","0.0002","13.3049","0.0002","90","","90","","90","","2251.61","0.09","297","2","297","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","diisopropyl(2-mercaptoethyl)ammonium chloride","","- C8 H20 Cl N S -","- C8 H20 Cl N S -","- C64 H160 Cl8 N8 S8 -","8","2","DE1104","Mahmoudkhani, Amir Hossein; Langer, Vratislav","(2-Hydroxyethyl)diisopropylammonium chloride and its derivatives","Acta Crystallographica Section C","1999","55","7","1163","1167","10.1107/S010827019900356X","","","0.71073","MoKα","","0.039","0.032","","","","0.079","","","","","","1.09","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008666","10.003","0.001","14.744","0.001","17.242","0.002","90","","92.14","0.01","90","","2541.1","0.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Diaquabis(2,2'-bipyridine)nickel (II) Diperchlorate","","- C20 H20 Cl2 N4 Ni O10 -","- C20 H20 Cl2 N4 Ni O10 -","- C80 H80 Cl8 N16 Ni4 O40 -","4","1","FG1527","Rodríguez-Martín, Yolanda; González-Platas, Javier; Ruiz-Pérez, Catalina","Diaquabis(2,2'-bipyridine-<i>N</i>,<i>N</i>')nickel(II) diperchlorate","Acta Crystallographica Section C","1999","55","7","1087","1090","10.1107/S0108270199003881","","","0.71073","MoKα","","0.085","0.045","","","","0.143","","","","","","1.012","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008667","9.573","0.001","10.19","0.001","19.213","0.002","90","","90.32","0.01","90","","1874.2","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(5,6-Dimethyl-1,10-phenanthroline-N,N')(nitrato-O)(salicylaldehydato-O,O) copper(II)","","- C21 H17 Cu N3 O5 -","- C21 H17 Cu N3 O5 -","- C84 H68 Cu4 N12 O20 -","4","1","FR1120","Gasque, Laura; Moreno-Esparza, Rafael; Ruiz-Ramírez, Lena; Medina-Dickinson, Gerardo","(5,6-Dimethyl-1,10-phenanthroline)(nitrato)(salicylaldehydato)copper(II)","Acta Crystallographica Section C","1999","55","7","1063","1065","10.1107/S0108270199001018","","","0.71073","MoKα","","0.083","0.045","","","0.103","0.118","","","","","","1.056","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008668","10.67","0.001","11.752","0.001","12.099","0.001","83.93","0.01","72.21","0.01","74.02","0.01","1388.4","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Aqua(4,7-diphenyl-1,10-phenanthroline)(salicylaldehydato)copper(II) nitrate monohydrate","","- C31 H25 Cu N3 O7 -","- C31 H25 Cu N3 O7 -","- C62 H50 Cu2 N6 O14 -","2","1","FR1122","Gasque, Laura; Moreno-Esparza, Rafael; Ruiz-Ramírez, Lena; Medina-Dickinson, Gerardo","Aqua(4,7-diphenyl-1,10-phenanthroline)(salicylaldehydato)copper(II) nitrate monohydrate","Acta Crystallographica Section C","1999","55","7","1065","1067","10.1107/S0108270199001572","","","0.71073","MoKα","","0.078","0.051","","","0.127","0.144","","","","","","1.019","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008669","17.432","0.004","17.339","0.004","11.538","0.004","90","","124.49","0.02","90","","2874.4","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","1,4-bis(2'-formylphenyl)-1,4-dioxabutane bisthiosemicarbazone","2,2'-ethylenedioxydibenzaldehyde bis(thiosemicarbazone) bis(dimethyl sulfoxide)","","- C22 H32 N6 O4 S4 -","- C22 H32 N6 O4 S4 -","- C88 H128 N24 O16 S16 -","4","0.5","FR1153","Xu-Hui Zhu; Xiao-Feng Chen; Yong-Jiang Liu; Cun-Ying Duan; Xiao-Zeng You; Yu-Peng Tian; Fu-Xing Xie","2,2'-Ethylenedioxydibenzaldehyde bis(thiosemicarbazone) bis(dimethyl sulfoxide)","Acta Crystallographica Section C","1999","55","7","1175","1176","10.1107/S0108270199002334","","","0.71073","MoKα","","0.056","0.04","","0.111","0.102","","","","1.024","1.064","1.064","","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:33",""
"2008670","10.6433","0.0012","20.6568","0.0013","8.5187","0.0011","90","","91.762","0.002","90","","1872","0.3","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H38 Cd3 N4 O8 -","- C38 H38 Cd3 N4 O8 -","- C76 H76 Cd6 N8 O16 -","2","0.5","FR1176","Atakol, Orhan; Aksu, Mecit; Ercan, Filiz; Arici, Cengiz; Tahir, M. Nawaz; Ülkü, Dinçer","A linear trinuclear Cd^II^–Cd^II^–Cd^II^ complex with a μ-acetato bridge: bis{(μ-acetato)[μ-bis(salicylidene)-1,3-propanediaminato]cadmium(II)}cadmium(II)","Acta Crystallographica Section C","1999","55","7","1072","1075","10.1107/S0108270199004333","","","0.71073","MoKα","","","0.028","","","0.037","","","","","0.9","0.9","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008671","17.0422","0.0003","13.5414","0.0002","13.1573","0.0002","90","","109.06","0.001","90","","2869.92","0.08","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-(4-Benzylpiperidin-1-yl)glyoxal doixime","","- C14 H19 N3 O2 -","- C14 H19 N3 O2 -","- C112 H152 N24 O16 -","8","2","FR1184","Sema Öztürk; Şamil Işık; Mustafa Macit; Hoong-Kun Fun","1-(4-Benzylpiperidin-1-yl)glyoxal dioxime","Acta Crystallographica Section C","1999","55","7","1132","1134","10.1107/S0108270199004242","","","0.71073","MoKα","","0.059","0.044","","","","0.122","","","","","","1.028","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008672","7.691","0.001","9.1327","0.0008","10.982","0.001","75.815","0.008","71.109","0.008","89.304","0.01","705.67","0.14","296","","296","","","","","","","","","3","P -1","-P 1","2","2,2'-dihydroxy-5,5'-dimethoxybiphenyl-3,3'-dicarboxaldehyde","","","- C16 H14 O6 -","- C16 H14 O6 -","- C32 H28 O12 -","2","1","FR1197","Gerkin, Roger E.","Hydrogen bonding and C—H···O interactions in 2,2'-dihydroxy-5,5'-dimethoxybiphenyl-3,3'-dicarbaldehyde","Acta Crystallographica Section C","1999","55","7","1176","1179","10.1107/S010827019900445X","","","0.71073","MoKα","","","0.047","","","0.08","","","","","1.98","1.98","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008673","7.547","0.002","8.035","0.001","10.24","0.001","77.78","0.01","86.62","0.01","65.46","0.01","551.77","0.18","296","","296","","","","","","","","","4","P -1","-P 1","2","quinolinium-4-carboxylate trihydrate","","","- C10 H13 N O5 -","- C10 H13 N O5 -","- C20 H26 N2 O10 -","2","1","FR1203","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding in quinolinium-4-carboxylate trihydrate","Acta Crystallographica Section C","1999","55","7","1192","1195","10.1107/S0108270199004849","","","0.71073","MoKα","","","0.049","","","","0.078","","","","","","1.27","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008674","8.376","0.001","9.7236","0.0009","12.325","0.001","90","","96.9","0.01","90","","996.54","0.17","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(isopropylthio)benzoic acid","","","- C10 H12 O2 S -","- C10 H12 O2 S -","- C40 H48 O8 S4 -","4","1","FR1205","Gerkin, Roger E.","2-(Isopropylthio)benzoic acid","Acta Crystallographica Section C","1999","55","7","1190","1192","10.1107/S0108270199005582","","","0.71073","MoKα","","","0.046","","","","0.068","","","","","","1.66","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008675","11.568","0.001","14.356","0.002","16.243","0.001","90","","98.3","0.01","90","","2669.2","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","tetra(ethyl)ammonium tetraiodo(diethyldithiocarbamato)tellurate(IV)","tetra(ethyl)ammonium tetraiodo(diethyldithiocarbamato)tellurate(IV)","","- C13 H30 I4 N2 S2 Te -","- C13 H30 I4 N2 S2 Te -","- C52 H120 I16 N8 S8 Te4 -","4","1","GD1007","R. Krishna Kumar; G. Aravamudan; Kandasamy Sivakumar; Hoong-Kun Fun","Tetraethylammonium (<i>N</i>,<i>N</i>-diethyldithiocarbamato-<i>S</i>,<i>S</i>')tetraiodotellurate(IV)","Acta Crystallographica Section C","1999","55","7","1121","1123","10.1107/S0108270199003261","","","0.71073","MoKα","","0.059","0.037","","","","0.096","","","","","","0.934","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008676","17","0.002","14.369","0.002","13.485","0.002","90","","91.32","0.01","90","","3293.1","0.8","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Ni(t-salpd)","","","- C18 H18 N2 Ni O0.5 S2 -","- C18 H18 N2 Ni O0.5 S2 -","- C144 H144 N16 Ni8 O4 S16 -","8","2","GD1011","Gomes, Ligia; Pereira, Eulalia; de Castro, Baltazar","A nickel complex with a tetradentate N~2~S~2~ Schiff base ligand","Acta Crystallographica Section C","1999","55","7","1061","1063","10.1107/S0108270199004163","","","0.71073","MoKα","","0.067","0.043","","0.121","0.099","","","","1.215","1.217","1.217","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008677","9.968","0.003","4.475","0.002","14.906","0.002","90","","93.52","0.02","90","","663.7","0.4","296","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H8 N2 O3 -","- C5 H8 N2 O3 -","- C20 H32 N8 O12 -","4","1","GD1019","Okabe, Nobuo; Hayashi,Tomomi","Imidazole-4-acetic acid monohydrate","Acta Crystallographica Section C","1999","55","7","1142","1144","10.1107/S0108270199004023","","","0.71069","MoKα","","","0.072","","","","0.112","","","","","","1.21","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008678","15.5486","0.001","7.7295","0.0005","25.647","0.003","90","","96.005","0.006","90","","3065.4","0.5","290","1","290","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Di-2-(pyrrolyl)methylferrocene","Di-2-(pyrrolyl)methylferrocene","","- C19 H18 Fe N2 -","- C19 H18 Fe N2 -","- C152 H144 Fe8 N16 -","8","2","GD1024","Gallagher, John F.; Moriarty, Elena","Intermolecular (pyrrole)N—H···π(pyrrole) interactions in bis(2-pyrrolyl)methylferrocene, an organometallic porphyrin precursor","Acta Crystallographica Section C","1999","55","7","1079","1082","10.1107/S0108270199003625","","","0.7107","MoKα","","0.1019","0.0405","","","","0.0764","","","","","","0.932","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008679","6.842","0.002","12.156","0.003","14.184","0.003","90","","92.32","0.03","90","","1178.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-(2-Nitroprop-2-yl)quinoline-5-carbonitrile","","- C13 H11 N3 O2 -","- C13 H11 N3 O2 -","- C52 H44 N12 O8 -","4","1","GS1022","Ján Lokaj; Viktor Kettmann; Vladimír Macháček; Aleš Halama","6-(2-Nitroprop-2-yl)quinoline-5-carbonitrile","Acta Crystallographica Section C","1999","55","7","1101","1103","10.1107/S0108270199002772","","","0.71073","MoKα","","0.108","0.047","","0.122","0.094","","","","0.908","1.125","1.125","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008680","8.067","0.003","9.699","0.004","12.191","0.004","90","","100.19","0.03","90","","938.8","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,6,7,8,8a,9-hexahydrothieno[2,3-f]indolizine-6,9-dione","","- C10 H9 N O2 S -","- C10 H9 N O2 S -","- C40 H36 N4 O8 S4 -","4","1","GS1027","Ján Lokaj; Viktor Kettmann; Stephan Marchalin","4,6,7,8,8a,9-Hexahydrothieno[3,2-<i>f</i>]indolizine-6,9-dione","Acta Crystallographica Section C","1999","55","7","1103","1105","10.1107/S0108270199001055","","","0.71073","MoKα","","0.088","0.048","","0.134","0.091","","","","0.968","1.105","1.105","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008681","6.6557","0.0008","20.988","0.003","9.5188","0.0015","90","","95.473","0.014","90","","1323.6","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","7-Iodo-3-isopropylamino-4H-1,2,4-benzothiadiazine 1,1-dioxide","","- C10 H12 I N3 O2 S -","- C10 H12 I N3 O2 S -","- C40 H48 I4 N12 O8 S4 -","4","1","GS1034","Dupont, Léon; Pirotte, Bernard; de Tullio, Pascal","7-Iodo-3-isopropylamino-4<i>H</i>-1,2,4-benzothiadiazine 1,1-dioxide","Acta Crystallographica Section C","1999","55","7","1152","1154","10.1107/S0108270199000669","","","1.5418","CuKα","","0.0864","0.0512","","","","0.1406","","","","","","0.926","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008682","8.5295","0.0004","11.4017","0.0005","11.5115","0.0005","85.406","0.001","72.81","0.001","80.316","0.001","1053.71","0.08","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","2,2-Di(2-methoxyphenyl)-4-methyl[2H]benzo[h]chromene","","- C28 H24 O3 -","- C28 H24 O3 -","- C56 H48 O6 -","2","1","HA1251","Kandasamy Chinnakali; Kamaraj Sriraghavan; Hoong-Kun Fun; Vayalakkavoor T.Ramakrishnan","2,2-Bis(2-methoxyphenyl)-4-methyl-2<i>H</i>-benzo[<i>h</i>]chromene","Acta Crystallographica Section C","1999","55","7","1123","1125","10.1107/S0108270199001845","","","0.71073","MoKα","","0.068","0.048","","","","0.141","","","","","","1.027","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008683","6.421","0.0002","16.6897","0.0003","11.7575","0.0003","90","","98.738","0.001","90","","1245.36","0.06","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","9a-propargyl-1,2,3,10-tetrahydrofluorene-3,9-dione","","- C16 H12 O2 -","- C16 H12 O2 -","- C64 H48 O8 -","4","1","HA1252","Kandasamy Chinnakali; Hoong-Kun Fun; Desikan Rajagopal; Sambasivam Swaminathan; Kamaraj Sriraghavan","9a-Propargyl-1,2,3,9-tetrahydrofluorene-3,9-dione","Acta Crystallographica Section C","1999","55","7","1135","1136","10.1107/S0108270199001857","","","0.71073","MoKα","","0.082","0.056","","","","0.135","","","","","","1.119","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008684","22.8032","0.001","7.639","0.002","16.986","0.002","90","","106.29","0.01","90","","2840.1","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","N,N'-Diphenylguanidinium dihydrogen phosphate","","- C13 H16 N3 O4 P -","- C13 H16 N3 O4 P -","- C104 H128 N24 O32 P8 -","8","1","HA1254","Pereira Silva, P. S.; Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; Alte da Veiga, L.","<i>N</i>,<i>N</i>'-Diphenylguanidinium dihydrogen phosphate","Acta Crystallographica Section C","1999","55","7","1096","1099","10.1107/S0108270199004084","","","0.71073","MoKα","","0.042","0.027","","","","0.08","","","","","","1.035","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008685","7.887","0.009","8.358","0.004","13.98","0.01","90","0.06","103.49","","90","","896.1","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","trans-bis(acetato-O)bis(2-amino-6-methylpyridine-N)copper(II)","","- C16 H22 Cu N4 O4 -","- C16 H22 Cu N4 O4 -","- C32 H44 Cu2 N8 O8 -","2","0.5","HA1255","Lah, Nina; Golič, Ljubo; Šegedin, Primož; Leban, Ivan","<i>trans</i>-Bis(acetato-<i>O</i>)bis(2-amino-6-methylpyridine-<i>N</i>)copper(II)","Acta Crystallographica Section C","1999","55","7","1056","1058","10.1107/S0108270199004345","","","0.71073","MoKα","","0.073","0.034","","","","0.086","","","","","","1.035","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008686","11.507","0.002","15.225","0.005","24.573","0.009","90","","90","","90","","4305","2","110","1","110","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(1S,2R)-1-Amino-2-methoxycyclohexane-1-carboxamide hydrochloride 0.25 hydrate","","- C8 H17.5 Cl N2 O2.25 -","- C8 H17.5 Cl N2 O2.25 -","- C128 H280 Cl16 N32 O36 -","16","4","JZ1343","Pai Fondekar, Kamalesh; Volk, Franz-Josef; Weckert, Edgar; Frahm, August W.","(1<i>S</i>,2<i>R</i>)-1-Amino-2-methoxycyclohexane-1-carboxamide hydrochloride 0.25-hydrate","Acta Crystallographica Section C","1999","55","7","1167","1170","10.1107/S0108270199003522","","","0.71069","MoKα","","0.025","0.024","","","","0.063","","","","","","1.056","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008687","16.185","0.007","9.11","0.003","17.535","0.008","90","","116.85","0.02","90","","2306.7","1.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","pentacarbonyl-cyclopentadiene-(μ-dicylclohexylphosphanido)manganese-rhodium","","- C22 H27 Mn O5 P Rh -","- C22 H27 Mn O5 P Rh -","- C88 H108 Mn4 O20 P4 Rh4 -","4","1","JZ1346","Flörke, Ulrich; Haupt, Hans-Jürgen","Pentacarbonyl-1κ^4^<i>C</i>,2κ<i>C</i>-[2(η^5^)-cyclopentadienyl]-μ-dicyclohexylphosphido-1:2κ^2^<i>P</i>-manganeserhodium(<i>Mn</i>—<i>Rh</i>)","Acta Crystallographica Section C","1999","55","7","1051","1052","10.1107/S0108270199004175","","","0.71073","MoKα","","0.094","0.047","","0.1","","0.083","","","1.025","","","1.072","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008688","13.73","0.005","11.334","0.003","13.848","0.005","90","","109.15","0.02","90","","2035.7","1.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","tripropargylammonium chloride","","","- C9 H10 Cl N -","- C9 H10 Cl N -","- C72 H80 Cl8 N8 -","8","2","","Steiner, Thomas; Schreurs, Antoine M. M.; Kroon, Jan","Tris(prop-2-ynyl)ammonium chloride","Acta Crystallographica Section C","1999","55","","1156","1168","","","","","","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008689","10.516","0.007","11.484","0.006","11.705","0.007","113.89","0.04","112.11","0.04","95.83","0.04","1142.3","1.4","150","","150","","","","","","","","","6","P -1","-P 1","2","","","","- C24 H70 Fe2 Na2 O8 S6 -","- C24 H70 Fe2 Na2 O8 S6 -","- C24 H70 Fe2 Na2 O8 S6 -","1","0.5","KA1304","Ralf Hauptmann; Jörg Lackmann; Changneng Chen; Gerald Henkel","Di-μ-aqua-bis[(trimethanol-<i>O</i>)sodium] <i>anti</i>-bis(μ-2-propanethiolato-<i>S</i>:<i>S</i>)bis[bis(2-propanethiolato-<i>S</i>)iron(II)] and bis(benzyltrimethylammonium) <i>anti</i>-bis(μ-2-propaneselenolato-<i>Se</i>:<i>Se</i>)bis[bis(2-propaneselenolato-<i>Se</i>)iron(II)]","Acta Crystallographica Section C","1999","55","7","1084","1087","10.1107/S0108270199003704","","","0.71073","MoKα","","","0.0451","","","","0.1201","","","","1.04","1.04","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008690","10.322","0.008","10.482","0.007","13.259","0.008","97.64","0.005","103.98","0.05","115.43","0.005","1210.5","1.5","150","","150","","","","","","","","","5","P -1","-P 1","2","","","","- C38 H74 Fe2 N2 Se6 -","- C38 H74 Fe2 N2 Se6 -","- C38 H74 Fe2 N2 Se6 -","1","0.5","KA1304","Ralf Hauptmann; Jörg Lackmann; Changneng Chen; Gerald Henkel","Di-μ-aqua-bis[(trimethanol-<i>O</i>)sodium] <i>anti</i>-bis(μ-2-propanethiolato-<i>S</i>:<i>S</i>)bis[bis(2-propanethiolato-<i>S</i>)iron(II)] and bis(benzyltrimethylammonium) <i>anti</i>-bis(μ-2-propaneselenolato-<i>Se</i>:<i>Se</i>)bis[bis(2-propaneselenolato-<i>Se</i>)iron(II)]","Acta Crystallographica Section C","1999","55","7","1084","1087","10.1107/S0108270199003704","","","0.71073","MoKα","","","0.0341","","","","0.0827","","","","1.016","1.016","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008691","11.356","0.001","9.843","0.001","14.452","0.002","90","","91.56","0.01","90","","1614.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Chloro-1-(α-chloroacetyl)-1,2,3,4-tetrahydro-4-methylquinoline-2- spirocyclohexane","","- C17 H21 Cl2 N O -","- C17 H21 Cl2 N O -","- C68 H84 Cl8 N4 O4 -","4","1","KA1310","Henao-Martínez, José Antonio; Palma, Alirio R.; Kouznetsov, Vladimir V.; Aguirre-Hernández, Gerardo; Fernando-Ortega, Chicote; Soriano-García, Manuel","6-Chloro-1-(α-chloroacetyl)-1,2,3,4-tetrahydro-4-methylquinoline-2-spirocyclohexane","Acta Crystallographica Section C","1999","55","7","1181","1183","10.1107/S0108270199003376","","","0.71073","MoKα","","0.109","0.053","","0.177","0.133","","","","1.157","1.257","1.257","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008692","9.485","0.0013","11.769","0.002","14.596","0.002","104.889","0.012","96.663","0.012","90.451","0.009","1562.8","0.4","135","","","","","","","","","","","4","P -1","-P 1","2","","(±)-(3'aα,4'β,6'aα)-1',3',3'a,6'a-Tetrahydro-5,5,N,N- tetramethyl-spiro[1,3-dioxane-2,2'(1'H)-pentalene]-4'- acetamide","","- C17 H27 N O3 -","- C17 H27 N O3 -","- C68 H108 N4 O12 -","4","2","KA1316","Jan W. Bats; Öhlinger, Stefan H.; Mulzer, Johann","(+/-)-(3'aα,4'α,6'aα)-3',3'a,4',6'a-Tetrahydro-5,5,<i>N</i>,<i>N</i>-tetramethylspiro[1,3-dioxane-2,2'(1'<i>H</i>)-pentalene]-4'-acetamide, a triclinic crystal structure with local monoclinic pseudosymmetry","Acta Crystallographica Section C","1999","55","7","1158","1160","10.1107/S0108270199003765","","","0.71073","MoKα","","","0.056","","","0.052","","","","","1.07","1.07","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008693","9.2544","0.0001","14.5543","0.0004","9.6994","0.0002","90","","105.435","0.001","90","","1259.31","0.05","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","4-(4-methylphenyl)-3-phenyl-4H-1,2,4-triazole","","- C15 H13 N3 -","- C15 H13 N3 -","- C60 H52 N12 -","4","1","LN1079","Kandasamy Chinnakali; Hoong-Kun Fun; Annamalai Senthilvelan; Kamaraj Sriraghavan; Vayalakkavoor T. Ramakrishnan","4-(4-Methylphenyl)-3-phenyl-4<i>H</i>-1,2,4-triazole","Acta Crystallographica Section C","1999","55","7","1136","1138","10.1107/S0108270199002693","","","0.71073","MoKα","","0.074","0.046","","","","0.12","","","","","","1.043","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008694","11.944","0.0002","16.541","0.0003","24.4068","0.0004","71.432","0.001","78.541","0.001","74.63","0.001","4372.89","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Trimethyl (5SR,6SR)-1,3-dichloro-8-(diethylamino)-5,6-dihydro-5- hydroxyisoquinoline-5,6,7-tricarboxylate","","- C19 H22 Cl2 N2 O7 -","- C19 H22 Cl2 N2 O7 -","- C152 H176 Cl16 N16 O56 -","8","4","LN1080","Tarun Kumar Sarkar; Sunil Kumar Ghosh; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun","Trimethyl (5<i>SR</i>,6<i>SR</i>)-1,3-dichloro-8-diethylamino-5,6-dihydro-5-hydroxyisoquinoline-5,6,7-tricarboxylate","Acta Crystallographica Section C","1999","55","7","1140","1142","10.1107/S010827019900311X","","","0.71073","MoKα","","0.121","0.055","","","","0.168","","","","","","1.006","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008695","11.7954","0.0005","7.6537","0.0003","46.732","0.002","90","","90","","90","","4218.9","0.3","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(2RS,5RS)-2,5-bis[3-(4-methylphenyl)-3-oxopropyl]cyclopentan-1-one","","- C25 H28 O3 -","- C25 H28 O3 -","- C200 H224 O24 -","8","1","LN1083","H. Surya Prakash Rao; S. P. Senthilkumar; Kandasamy Chinnakali; Hoong-Kun Fun","(2<i>RS</i>,5<i>RS</i>)-2,5-Bis[3-(4-methylphenyl)-3-oxopropyl]cyclopentan-1-one","Acta Crystallographica Section C","1999","55","7","1130","1132","10.1107/S0108270199004151","","","0.71073","MoKα","","0.107","0.068","","","","0.148","","","","","","1.14","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008696","11.67","0.003","8.538","0.002","34.208","0.01","90","","92.58","0.02","90","","3405","1.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Diaqua-[2-(2,6-dichloroanilino)phenyl]acetate magnesium","","- C28 H36 Cl4 Mg N2 O12 -","- C28 H36 Cl4 Mg N2 O12 -","- C112 H144 Cl16 Mg4 N8 O48 -","4","1","NA1405","Castellari, Carlo; Comelli, Fabio; Ottani, Stefano","A hydrated diclofenac salt of the hexaaquamagnesium ion","Acta Crystallographica Section C","1999","55","7","1054","1056","10.1107/S0108270199004096","","","0.71069","MoKα","","0.207","0.047","","","","0.158","","","","","","0.931","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008697","5.474","0.003","5.51","0.003","36.15","0.01","90","0.009","90","0.009","90","0.009","1090.3","0.9","293","","293","","","","","","","","","4","B b 21 m","B -2 -2b","36","","dicalcium disodium tetraniobium tridecaoxide","","- Ca2 Na2 Nb4 O13 -","- Ca2.01 Na1.99 Nb4 O13 -","- Ca8.04 Na7.96 Nb16 O52 -","4","0.5","OA1080","Chiba, Koji; Ishizawa, Nobuo; Oishi, Shuji","A Ruddlesden‒Popper-type layered perovskite, Na~2~Ca~2~Nb~4~O~13~","Acta Crystallographica Section C","1999","55","7","1041","1044","10.1107/S0108270199001134","","","0.7107","MoKα","","0.044","0.044","","0.026","0.026","","","","1.993","1.993","1.993","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2008698","9.563","0.001","9.657","0.001","6.935","0.002","100.89","0.02","102.54","0.02","90.26","0.01","613.2","0.2","299","","299","","","","","","","","","5","P -1","-P 1","2","","","","- C11 H9 Cl2 N O5 -","- C11 H9 Cl2 N O5 -","- C22 H18 Cl4 N2 O10 -","2","1","OA1082","Ishida, Hiroyuki; Kashino, Setsuo","Pyridinium and 1,2-diazinium salts of chloranilic acid","Acta Crystallographica Section C","1999","55","7","1149","1152","10.1107/S0108270199003777","","","0.71073","MoKα","","0.08","0.055","","0.058","","0.049","","","1.33","","","1.33","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008699","3.799","0.001","20.292","0.005","9.675","0.002","90","","99.69","0.02","90","","735.2","0.3","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 Cl2 N4 O4 -","- C14 H10 Cl2 N4 O4 -","- C28 H20 Cl4 N8 O8 -","2","0.5","OA1082","Ishida, Hiroyuki; Kashino, Setsuo","Pyridinium and 1,2-diazinium salts of chloranilic acid","Acta Crystallographica Section C","1999","55","7","1149","1152","10.1107/S0108270199003777","","","0.71073","MoKα","","0.06","0.048","","0.078","","0.061","","","1.55","","","1.55","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008700","10.796","0.003","7.755","0.002","19.315","0.002","90","","90.8","0.01","90","","1617","0.6","297","","273.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","exo-[(RS,SR)-N,N'-Bis(salicylidene)-2,3-butanediaminato]oxovanadium(IV)","","","- C18 H18 N2 O3 V -","- C18 H18 N2 O3 V -","- C72 H72 N8 O12 V4 -","4","1","OA1084","Hoshina, Gakuse; Tsuchimoto, Masanobu; Ohba, Shigeru","<i>exo</i>-[(<i>RS</i>,<i>SR</i>)-<i>N</i>,<i>N</i>'-Bis(salicylidene)-2,3-butanediaminato]oxovanadium(IV)","Acta Crystallographica Section C","1999","55","7","1082","1084","10.1107/S0108270199004187","","","0.71073","MoKα","","0.061","0.036","","","","0.064","","","","","","1.262","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008701","16.014","0.002","16.097","0.001","9.7547","0.0007","95.827","0.006","104.757","0.007","84.81","0.008","2413.6","0.4","248.2","","248","","","","","","","","","3","P -1","-P 1","2","2,2,8,8-tetramethoxy-1a,9-bis(methylacrylato)- 1,4-etheno-octahydronaphthalene-6-ene-3,7-dione","dimethyl 8,8-dimethoxy-7-oxo-1,4-(1,1-dimethoxy-2-oxoethano)- 1,4,4a,7,8,8a-hexahydronaphthalene-2,4a-diyldiacrylate","","- C24 H28 O10 -","- C24 H27.5 O10 -","- C96 H110 O40 -","4","2","OA1086","Yoshihara, Ryouko; Mori, Kazuki; Nishiyama, Shigeru; Yamamura, Syousuke; Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","An asatone-type neolignan and its photocage product","Acta Crystallographica Section C","1999","55","7","1144","1147","10.1107/S0108270199004205","","","1.54184","CuKα","","","0.05","","","","0.102","","","","","","1.62","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008702","15.356","0.003","8.659","0.003","17.271","0.004","90","","94.31","0.02","90","","2290","1.1","248","","248","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","dimethyl 6,6,12,12-tetramethoxy-5,11-dioxotetracyclo[6.2.2.0^3,10^.0^4,9^] dodecane-2,9-diyldiacrylate","","- C24 H28 O10 -","- C24 H28 O10 -","- C96 H112 O40 -","4","1","OA1086","Yoshihara, Ryouko; Mori, Kazuki; Nishiyama, Shigeru; Yamamura, Syousuke; Hosomi, Hiroyuki; Ohba, Shigeru; Ito, Yoshikatsu","An asatone-type neolignan and its photocage product","Acta Crystallographica Section C","1999","55","7","1144","1147","10.1107/S0108270199004205","","","1.54184","CuKα","","","0.063","","","","0.122","","","","","","1.571","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008703","10.1673","0.0001","10.1932","0.0002","15.4592","0.0002","90","","102.048","0.001","90","","1566.86","0.04","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","deoxycholic acid, tris(hydroxymethyl) amino methane, water","tris(hydroxymethyl)methyl ammonium 3α,12α-dihydroxy-5β-cholan-24-oate trihydrate","","- C28 H57 N O10 -","- C28 H57 N O10 -","- C56 H114 N2 O20 -","2","1","OS1052","Tusvik, Per Helge; Mostad, Arvid; Dalhus, Bjørn; Rosenqvist, Einar","A 1:1 complex between deoxycholate and tris(hydroxymethyl)methylammonium","Acta Crystallographica Section C","1999","55","7","1113","1115","10.1107/S0108270199004370","","","0.71073","MoKα","","0.042","0.035","","0.092","0.084","","","","1.057","1.04","1.04","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008704","9.9166","0.0002","4.7247","0.0001","15.3292","0.0003","90","","102.349","0.001","90","","701.6","0.02","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-Norvaline:D-Norleucine","","- C11 H24 N2 O4 -","- C11 H24 N2 O4 -","- C22 H48 N4 O8 -","2","1","OS1053","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. II. The <small>D</small>-norleucine series","Acta Crystallographica Section C","1999","55","7","1105","1112","10.1107/S0108270199003649","","","0.71073","MoKα","","0.0567","0.0448","","0.1271","0.1161","","","","1.049","1.053","1.053","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008705","9.8756","0.0002","4.7029","0.0001","16.4192","0.0003","90","","107.328","0.0007","90","","727.96","0.03","110","2","110","2","","","","","","","","5","P 1 21 1","P 2yb","4","","L-Methionine:D-Norleucine","","- C11 H24 N2 O4 S -","- C11 H24 N2 O4 S -","- C22 H48 N4 O8 S2 -","2","1","OS1053","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. II. The <small>D</small>-norleucine series","Acta Crystallographica Section C","1999","55","7","1105","1112","10.1107/S0108270199003649","","","0.71073","MoKα","","0.028","0.0254","","0.0697","0.0682","","","","1.059","1.07","1.07","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008706","29.5751","0.0004","4.7386","0.0001","9.9402","0.0001","90","","102.711","0.0008","90","","1358.92","0.04","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","","L-Valine:D-Norleucine","","- C11 H24 N2 O4 -","- C11 H24 N2 O4 -","- C44 H96 N8 O16 -","4","1","OS1053","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. II. The <small>D</small>-norleucine series","Acta Crystallographica Section C","1999","55","7","1105","1112","10.1107/S0108270199003649","","","0.71073","MoKα","","0.0496","0.038","","0.1057","0.0951","","","","1.052","1.049","1.049","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008707","31.4433","0.0004","4.7622","0.0001","9.9363","0.0002","90","","100.838","0.0004","90","","1461.32","0.05","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","","L-alloIsoleucine:D-Norleucine","","- C12 H26 N2 O4 -","- C12 H26 N2 O4 -","- C48 H104 N8 O16 -","4","1","OS1053","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. II. The <small>D</small>-norleucine series","Acta Crystallographica Section C","1999","55","7","1105","1112","10.1107/S0108270199003649","","","0.71073","MoKα","","0.0485","0.0394","","0.1052","0.098","","","","1.075","1.066","1.066","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008708","5.1778","0.0001","27.8078","0.0005","5.3995","0.0001","90","","112.303","0.001","90","","719.28","0.02","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-Leucine:D-Norleucine","","- C12 H26 N2 O4 -","- C12 H26 N2 O4 -","- C24 H52 N4 O8 -","2","1","OS1053","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. II. The <small>D</small>-norleucine series","Acta Crystallographica Section C","1999","55","7","1105","1112","10.1107/S0108270199003649","","","0.71073","MoKα","","0.067","0.0587","","0.1354","0.1308","","","","1.192","1.22","1.22","","","","","has coordinates,has disorder","301791","2025-08-18","23:15:33",""
"2008709","15.423","0.002","18.571","0.004","5.8691","0.0008","90","","90","","90","","1681","0.5","120","2","120","2","","","","","","","","3","P n m a","-P 2ac 2n","62","1,1-di(4-methoxy phenyl)-3,3-dimethyl-2-butanone","","","- C20 H24 O3 -","- C20 H24 O3 -","- C80 H96 O12 -","4","0.5","QA0119","Srinivasan S. Kuduva; Amy K. Katz; H. L. Carrell; Gautam R. Desiraju","1,1-Bis(4-methoxyphenyl)-3,3-dimethylbutan-2-one","Acta Crystallographica Section C","1999","55","7","IUC9900073","","10.1107/S0108270199099230","","","0.71073","MoKα","","0.113","0.059","","","","0.177","","","","","","0.905","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008710","5.1387","0.0002","22.5026","0.001","10.141","0.0004","90","","101.69","","90","","1148.32","0.08","174","2","174","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,5-dibromophthalic acid monoethylester","","- C10 H8 Br2 O4 -","- C10 H8 Br2 O4 -","- C40 H32 Br8 O16 -","4","1","QA0129","Britton, Doyle","Ethyl hydrogen 4,5-dibromophthalate","Acta Crystallographica Section C","1999","55","7","IUC9900071","","10.1107/S0108270199099229","","","0.71073","MoKα","","0.046","0.035","","0.078","","0.074","","","1.095","","","1.132","","","","has coordinates,has disorder","301791","2025-08-18","23:15:33",""
"2008711","6.7579","0.0012","6.8393","0.001","11.0376","0.0017","90","","101.307","0.014","90","","500.25","0.14","140","2","140","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1'-deoxy-1'-(3-fluorophenyl)-β-D-ribofuranose","","- C11 H13 F O4 -","- C11 H13 F O4 -","- C22 H26 F2 O8 -","2","1","QA0131","Bats, Jan W.; Parsch, Jörg; Engels, Joachim W.","1-Deoxy-1-(3-fluorophenyl)-β-<small>D</small>-ribofuranose","Acta Crystallographica Section C","1999","55","7","IUC9900070","","10.1107/S0108270199099205","","","0.71073","MoKα","","0.038","0.035","","","","0.091","","","","","","1.44","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008712","7.5544","0.0017","8.5939","0.0012","14.489","0.002","77.136","0.011","86.8","0.015","88.879","0.016","915.6","0.3","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C7 H10 N2 O3 S -","- C7 H10 N2 O3 S -","- C28 H40 N8 O12 S4 -","4","2","QA0133","Kennedy, Alan R.; Khalaf, Abedawn I.; Pitt, Andrew R.; Scobie, Martin; Suckling, Colin J.; Urwin, John; Waigh, Roger D.; Young, Stephen C.","Methyl 2-amino-4-(methoxymethyl)thiazole-5-carboxylate","Acta Crystallographica Section C","1999","55","7","IUC9900072","","10.1107/S0108270199099199","","","0.71069","MoKα","","0.068","0.035","","","","0.105","","","","","","1.022","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008713","11.938","0.008","24.421","0.005","7.8395","0.0012","90","","90","","90","","2285.5","1.6","298.2","","298.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H28 N2 O4 -","- C25 H28 N2 O4 -","- C100 H112 N8 O16 -","4","1","QA0134","K. Vyas; K. Shashi Rekha; P. Rajender Kumar; S. Raju; M. R. Sarma; G. Om Reddy","A diketopiperazine derivative of quinapril","Acta Crystallographica Section C","1999","55","7","IUC9900077","","10.1107/S0108270199099187","","","1.5418","CuKα","","0.062","0.058","","0.077","","0.076","","","1.834","","","1.847","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008714","13.2435","0.0019","5.1116","0.0008","15.52","0.003","90","","102.2","0.013","90","","1026.9","0.3","133","2","133","2","","","","","","","","4","C 1 2 1","C 2y","5","","1'-deoxy-1'-(2-fluorophenyl)-β-D-ribofuranose","","- C11 H13 F O4 -","- C11 H13 F O4 -","- C44 H52 F4 O16 -","4","1","QA0135","Bats, Jan W.; Parsch, Jörg; Engels, Joachim W.","1-Deoxy-1-(2-fluorophenyl)-β-<small>D</small>-ribofuranose","Acta Crystallographica Section C","1999","55","7","IUC9900069","","10.1107/S0108270199099217","","","0.71073","MoKα","","0.034","0.032","","","","0.09","","","","","","1.194","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008715","24.015","0.004","10.396","0.004","10.41","0.004","90","","91.48","0.02","90","","2598.1","1.5","298","","298","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","8-Methyltricyclo[9.3.0.0^3,7^]tetradec-3-ene-5,10-dione","","","- C15 H20 O2 -","- C15 H20 O2 -","- C120 H160 O16 -","8","1","QA0136","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","8-Methyltricyclo[9.3.0.0^3,7^]tetradec-3-ene-5,10-dione and 7,12-dihydroxy-9,12-dimethyltetracyclo[8.2.1.0^1,5^.0^7,11^]tridecan-13-one methanol solvate","Acta Crystallographica Section C","1999","55","7","IUC9900068","","10.1107/S0108270199099175","","","0.71073","MoKα","","","0.0536","","","","0.1118","","","","","","1.128","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008716","15.096","0.002","8.434","0.001","25.095","0.001","90","","105.02","0.01","90","","3085.9","0.6","298","","298","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","7,12-dihydroxy-9,12-dimethyltetracyclo[8.2.1.0^1,5^.0^7,11^]tridecan- 13-one monomethanol solvate","","","- C16 H26 O4 -","- C16 H26 O4 -","- C128 H208 O32 -","8","1","QA0136","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","8-Methyltricyclo[9.3.0.0^3,7^]tetradec-3-ene-5,10-dione and 7,12-dihydroxy-9,12-dimethyltetracyclo[8.2.1.0^1,5^.0^7,11^]tridecan-13-one methanol solvate","Acta Crystallographica Section C","1999","55","7","IUC9900068","","10.1107/S0108270199099175","","","0.71073","MoKα","","","0.0495","","","","0.0915","","","","","","1.316","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008717","5.8094","0.0013","10.466","0.003","19.605","0.005","90","","90.998","0.019","90","","1191.8","0.5","130","2","130","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","Biphenylene","","- C12 H8 -","- C12 H8 -","- C72 H48 -","6","1.5","QA0137","Boese, Roland; Bläser, Dieter; Latz, Rüdiger","Redetermination of biphenylene at 130K","Acta Crystallographica Section C","1999","55","7","IUC9900067","","10.1107/S0108270199099163","","","0.71073","MoKα","","0.064","0.052","","","","0.149","","","","","","1.031","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008718","15.373","0.003","6.536","0.001","17.8","0.004","90","","100.61","0.01","90","","1757.9","0.6","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 O2 -","- C11 H10 O2 -","- C88 H80 O16 -","8","2","QA0139","Söntgen, Olaf; Bolte, Michael","1,4,4a,5,8,8a-Hexahydro-1,4-methanonaphthalene-5,8-dione","Acta Crystallographica Section C","1999","55","7","IUC9900076","","10.1107/S0108270199099151","","","0.71073","MoKα","","0.078","0.048","","","","0.12","","","","","","1.018","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008719","10.3746","0.0004","13.7857","0.0005","7.9098","0.0004","90","","96.637","0.002","90","","1123.69","0.08","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(4-cyano-2,6-dichlorophenylimino)imidazolidine","","- C10 H8 Cl2 N4 -","- C10 H8 Cl2 N4 -","- C40 H32 Cl8 N16 -","4","1","QB0091","E. M. Elssfah; K. Chinnakali; H.-K. Fun; I. W. Mathison; E. K. Gan; M. Zubaid; T. W. Sam; K. S. Khoo","Substituted clonidine derivatives. I. 3,5-Dichloro-4-(imidazolidin-2-ylideneamino)benzonitrile and 3,5-dichloro-4-(1,3-diisobutyrylimidazolidin-2-ylideneamino)benzonitrile","Acta Crystallographica Section C","1999","55","7","IUC9900066","","10.1107/S010827019909914X","","","0.71073","MoKα","","0.153","0.068","","","","0.158","","","","","","1.035","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008720","9.8442","0.0013","18.997","0.003","10.9399","0.0012","90","","108.079","0.01","90","","1944.9","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-cyano-2,6-dichlorophenylimino)-1,3-diisobutyrylimidazolidine","","- C18 H20 Cl2 N4 O2 -","- C18 H20 Cl2 N4 O2 -","- C72 H80 Cl8 N16 O8 -","4","1","QB0091","E. M. Elssfah; K. Chinnakali; H.-K. Fun; I. W. Mathison; E. K. Gan; M. Zubaid; T. W. Sam; K. S. Khoo","Substituted clonidine derivatives. I. 3,5-Dichloro-4-(imidazolidin-2-ylideneamino)benzonitrile and 3,5-dichloro-4-(1,3-diisobutyrylimidazolidin-2-ylideneamino)benzonitrile","Acta Crystallographica Section C","1999","55","7","IUC9900066","","10.1107/S010827019909914X","","","0.71073","MoKα","","0.127","0.044","","","","0.077","","","","","","0.96","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008721","5.26","0.0007","5.26","0.0007","8.801","0.002","90","","90","","120","","210.88","0.06","293","2","293","2","","","","","","","","4","P 63 2 2","P 6c 2c","182","potassium iron silicate","potassium iron silicate","","- Fe0.97 K0.97 O4 Si1.03 -","- Fe0.97 K0.97 O3.99999 Si1.03 -","- Fe1.94 K1.94 O7.99998 Si2.06 -","2","0.166667","QB0099","Robert Hammond; Jacques Barbier","Hexagonal β-KFeSiO~4~","Acta Crystallographica Section C","1999","55","7","IUC9900075","","10.1107/S0108270199099242","","","0.56086","AgKα","","0.032","0.0189","","0.0563","0.0452","","","","0.982","1.114","1.114","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008722","18.749","0.003","18.749","0.003","8.684","0.002","90","","90","","120","","2643.7","0.9","293","2","293","2","","","","","","","","4","P 63","P 6c","173","potassium iron germanate","potassium iron germanium tetraoxide","","- Fe Ge K O4 -","- Fe Ge K O4 -","- Fe24 Ge24 K24 O96 -","24","4","QB0100","Robert Hammond; Jacques Barbier","Low-temperature KFeGeO~4~","Acta Crystallographica Section C","1999","55","7","IUC9900074","","10.1107/S0108270199099254","","","0.56086","AgKα","","0.055","0.041","","0.11","0.095","","","","0.939","1.023","1.023","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008723","17.862","0.001","17.862","0.001","17.862","0.001","90","","90","","90","","5698.9","0.6","295","","293","2","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","N,N',N''-Trimethyl-N,N',N''-tris(3-methylphenyl)-1,3,5- benzenetricarboxamide","","- C33 H33 N3 O3 -","- C33 H33 N3 O3 -","- C264 H264 N24 O24 -","8","0.333333","SK1189","Herbstein, Frank H.","<i>N</i>,<i>N</i>',<i>N</i>''-Trimethyl-<i>N</i>,<i>N</i>',<i>N</i>''-tris(3-methylphenyl)-1,3,5-benzenetricarboxamide is cubic (space group <i>Pa</i>øverline{3}) and not orthorhombic (space group <i>Pbca</i>). Erratum","Acta Crystallographica Section C","1999","55","7","1196","","10.1107/S0108270198013924","","","1.5405","CuKα","","","0.067","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008724","15.556","0.0012","15.556","0.0012","15.556","0.0012","90","","90","","90","","3764.4","0.5","193","2","193","2","","","","","","","","6","P 21 3","P 2ac 2ab 3","198","","Ruthenium(II)-tris(bipyridine)-sodium(I)-tris(μ-oxalato)ruthenate(III)","","- C36 H24 N6 Na O12 Ru2 -","- C36 H24 N6 Na O12 Ru2 -","- C144 H96 N24 Na4 O48 Ru8 -","4","0.333333","SK1212","Pellaux, Rene; Decurtins, Silvio; Schmalle, Helmut W.","Three anionic polymeric networks: sodium(I)–ruthenium(III), sodium(I)–rhodium(III) and sodium(I)–aluminium(III) μ-oxalato complexes with tris(2,2'-bipyridine)ruthenium(II) cations","Acta Crystallographica Section C","1999","55","7","1075","1079","10.1107/S0108270199003339","","","0.71073","MoKα","","0.039","0.031","","","","0.063","","","","","","1.026","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008725","15.515","0.002","15.515","0.002","15.515","0.002","90","","90","","90","","3734.7","0.8","296","2","296","2","","","","","","","","7","P 21 3","P 2ac 2ab 3","198","","Ruthenium(II)-tris(bipyridine)-sodium(I)-tris(μ-oxalato)rhodate(III)","","- C36 H24 N6 Na O12 Rh Ru -","- C36 H24 N6 Na O12 Rh Ru -","- C144 H96 N24 Na4 O48 Rh4 Ru4 -","4","0.333333","SK1212","Pellaux, Rene; Decurtins, Silvio; Schmalle, Helmut W.","Three anionic polymeric networks: sodium(I)–ruthenium(III), sodium(I)–rhodium(III) and sodium(I)–aluminium(III) μ-oxalato complexes with tris(2,2'-bipyridine)ruthenium(II) cations","Acta Crystallographica Section C","1999","55","7","1075","1079","10.1107/S0108270199003339","","","0.71073","MoKα","","0.034","0.023","","","","0.065","","","","","","1.126","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008726","15.407","0.004","15.407","0.004","15.407","0.004","90","","90","","90","","3657.2","1.6","296","2","296","2","","","","","","","","7","P 21 3","P 2ac 2ab 3","198","","Ruthenium(II)-tris(bipyridine)-sodium(I)-tris(μ-oxalato)aluminate(III)","","- C36 H24 Al N6 Na O12 Ru -","- C36 H24 Al N6 Na O12 Ru -","- C144 H96 Al4 N24 Na4 O48 Ru4 -","4","0.333333","SK1212","Pellaux, Rene; Decurtins, Silvio; Schmalle, Helmut W.","Three anionic polymeric networks: sodium(I)‒ruthenium(III), sodium(I)‒rhodium(III) and sodium(I)‒aluminium(III) μ-oxalato complexes with tris(2,2'-bipyridine)ruthenium(II) cations","Acta Crystallographica Section C","1999","55","7","1075","1079","10.1107/S0108270199003339","","","0.71073","MoKα","","0.099","0.041","","","","0.107","","","","","","1.145","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008727","6.36","0.001","9.059","0.002","13.224","0.002","90","","90.4","0.02","90","","761.9","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Dipotassium tellurium trisulfide","","","- K2 S3 Te -","- K2 S3 Te -","- K8 S12 Te4 -","4","1","SK1244","Rumpf, Christian; Näther, Christian; Bensch, Wolfgang","K~2~TeS~3~","Acta Crystallographica Section C","1999","55","7","1046","1047","10.1107/S0108270198018265","","","0.71073","MoKα","","0.031","0.023","","0.061","0.057","","","","1.174","1.217","1.217","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008728","10.395","0.002","13.32","0.003","21.162","0.002","90","","100.414","0.009","90","","2881.9","0.9","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[Diaquatetrachlorotetramethylditin] - [dichlorodimethyl(tris-2-pyridyl-1,3,5-triazine)tin] (1/2)","","- C22 H26 Cl4 N6 O Sn2 -","- C22 H26 Cl4 N6 O Sn2 -","- C88 H104 Cl16 N24 O4 Sn8 -","4","1","SK1251","Lo, Kong Mun; Kumar Das, V. G.; Ng, Seik Weng","Di-μ-chloro-bis(aquachlorodimethyltin)‒dichlorodimethyl[2,4,6-tris(2-pyridyl)-1,3,5-triazine]tin (1/2)","Acta Crystallographica Section C","1999","55","7","1058","1061","10.1107/S0108270199004928","","","0.71073","MoKα","","0.065","0.041","","","","0.088","","","","","","0.977","","","","has coordinates","198932","2020-10-21","18:00:00",""
"2008729","26.28","0.004","26.285","0.003","18.449","0.002","90","","102.696","0.01","90","","12432","3","136","2","136","2","","","","","","","","3","P 1 c 1","P -2yc","7","","2,5-Diisopropylidene-3,4-bis-(2-methoxycarbonyl-2-methylpropoxycarbonyl)-hex- 3-enedioic acid bis(2-methoxycarbonyl-2-methylpropyl)ester","","- C38 H56 O16 -","- C38 H56 O16 -","- C456 H672 O192 -","12","6","SK1272","Bats, Jan W.; Rivas Nass, Andreas; Hashmi, A. Stephen K.","Low-temperature phase of bis(2-methoxycarbonyl-2-methylpropyl) 2,5-diisopropylidene-3,4-bis(2-methoxycarbonyl-2-methylpropoxycarbonyl)hex-3-enedioate, a crystal structure with six independent pseudo-related molecules","Acta Crystallographica Section C","1999","55","7","1183","1186","10.1107/S0108270199003078","","","0.71073","MoKα","","0.2369","0.078","","","","0.157","","","","","","1.011","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008730","7.5028","0.0003","17.3288","0.0006","26.1306","0.0009","90","","90","","90","","3397.4","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","9-Hydroxy-4-methyl-8-phenylthio-7,8,9,10-tetrahydrobenzo[h]coumarin","","- C20 H18 O3 S -","- C20 H18 O3 S -","- C160 H144 O24 S8 -","8","2","SK1273","Kandasamy Chinnakali; Kamaraj Sriraghavan; Hoong-Kun Fun; Vayalakkavoor T. Ramakrishnan","9-Hydroxy-4-methyl-8-phenylthio-7,8,9,10-tetrahydrobenzo[<i>h</i>]coumarin","Acta Crystallographica Section C","1999","55","7","1125","1127","10.1107/S0108270199002814","","","0.71073","MoKα","","0.111","0.065","","","","0.158","","","","","","1.132","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008731","13.4416","0.0004","6.4787","0.0002","21.7352","0.0006","90","","104.065","0.001","90","","1836.05","0.09","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(8RS-5SR-7SR)-7-Benzoyl-8-hydroxy-8-phenylspiro[4.5]decan-1-one","","- C23 H24 O3 -","- C23 H24 O3 -","- C92 H96 O12 -","4","1","SK1274","H. Surya Prakash Rao; K. Jayalakshmi; Kandasamy Chinnakali; Hoong-Kun Fun","(8<i>RS</i>,5<i>SR</i>,7<i>SR</i>)-7-Benzoyl-8-hydroxy-8-phenylspiro[4.5]decan-1-one","Acta Crystallographica Section C","1999","55","7","1117","1119","10.1107/S0108270199002826","","","0.71073","MoKα","","0.095","0.054","","","","0.142","","","","","","1.051","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008732","8.321","0.008","8.321","0.008","48.92","0.02","90","","90","","90","","3387","5","293","2","293","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","(R)-Spiro[(2R)-N-acetyl-2-phenyl-1,3-thiazolidine-5,3'-(3a'R,6a'S)- 5',6'-dimethyl-3a',6a'-dihydro-3H-furo[2,3-b]furan-2-one]","","- C18 H19 N O4 S -","- C18 H19 N O4 S -","- C144 H152 N8 O32 S8 -","8","1","SK1275","Ramos Silva, M.; Matos Beja, A.; Paixão, J. A.; Alte da Veiga, L.; Barbosa, D. M.; Soares, M. I. L.; Pinho e Melo, T. M. V. D.; Rocha Gonsalves, A. M. d'A.","(<i>R</i>)-Spiro[(2<i>R</i>)-<i>N</i>-acetyl-2-phenyl-1,3-thiazolidine-4,3'-(3a'<i>R</i>,6a'<i>S</i>)-5',6a'-dimethyl-3a',-6a'-dihydro-3<i>H</i>-furo[2,3-<i>b</i>]furan-2-one]","Acta Crystallographica Section C","1999","55","7","1094","1096","10.1107/S010827019900308X","","","1.5418","CuKα","","0.0518","0.0444","","","","0.1212","","","","","","1.048","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008733","14.752","0.005","23.919","0.008","12.505","0.006","90","","90","","90","","4412","3","293","2","293","2","","","","","","","","3","C 2 2 21","C 2c 2","20","","3α,4β-Diacetoxy-17a-oxa-17a-homo-5α-androstan-17-one","","- C23 H34 O6 -","- C23 H34 O6 -","- C184 H272 O48 -","8","1","SK1276","Andrade, L. C. R.; Paixão, J. A.; de Almeida, M. J.; Tavares da Silva, E. J.; Sá e Melo, M. L.; Campos Neves, A. S.","17-Oxo-17a-oxa-17a-homo-5α-androstan-3α,4β-diyl diacetate","Acta Crystallographica Section C","1999","55","7","1186","1188","10.1107/S0108270199002838","","","0.7093","MoKα","","0.1598","0.033","","","","0.09","","","","","","0.927","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008734","8.9148","0.0003","10.1052","0.0003","10.8606","0.0003","95.565","0.001","108.976","0.001","101.414","0.001","893.08","0.05","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Methyl-(2R,4aR,8aR)-2-(4-methylbenzyl)-3-oxoperhydro-2-naphthalenecarboxylate","","- C20 H26 O3 -","- C20 H26 O3 -","- C40 H52 O6 -","2","1","SK1279","S. Rajamathe; D. Sethumadhavan; H. Surya Prakash Rao; Kandasamy Chinnakali; Hoong-Kun Fun","Methyl (2<i>RS</i>,4a<i>RS</i>,8a<i>RS</i>)-2-(4-methylbenzyl)-3-oxoperhydronaphthalene-2-carboxylate","Acta Crystallographica Section C","1999","55","7","1127","1128","10.1107/S0108270199003108","","","0.71073","MoKα","","0.066","0.049","","","","0.147","","","","","","1.03","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008735","12.103","0.001","5.63","0.001","26.795","0.001","90","","93.655","0.006","90","","1822.1","0.4","296.2","","296.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Z)-N-Benzyl-2,3-dihydro-2-(2-methoxybenzylidine)-4H-1,4-benzoxazine","","- C23 H21 N O2 -","- C23 H21 N O2 -","- C92 H84 N4 O8 -","4","1","SK1280","Susim Maiti; Monika Mukherjee; Gopeswar Chaudhuri; Madeleine Helliwell; Nitya G. Kundu","(<i>Z</i>)-<i>N</i>-Benzyl-2,3-dihydro-2-(2-methoxybenzylidene)-4<i>H</i>-1,4-benzoxazine","Acta Crystallographica Section C","1999","55","7","1154","1156","10.1107/S0108270199003340","","","1.5418","CuKα","","0.06","0.046","","0.127","","0.12","","","1.015","","","1.079","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008736","18.0675","0.0009","7.7986","0.0004","9.2847","0.0004","90","","90","","90","","1308.23","0.11","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","4,4a,4b,5,6,7,9,9a-Octahydro-1,4-methano-7-methyl-5-nitro-1H-fluoren-9-one","","- C15 H17 N O3 -","- C15 H17 N O3 -","- C60 H68 N4 O12 -","4","1","SK1281","Dipakranjan Mal; Nirmal Kumar Hazra; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun","4,4a,4b,5,6,7,9,9a-Octahydro-1,4-methano-7-methyl-5-nitro-1<i>H</i>-fluoren-9-one","Acta Crystallographica Section C","1999","55","7","1129","1130","10.1107/S0108270199003352","","","0.71073","MoKα","","0.044","0.037","","","","0.098","","","","","","1.05","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008737","12.8678","0.0005","11.4996","0.0004","10.0894","0.0003","90","","90","","90","","1492.97","0.09","293","2","293","2","","","","","","","","7","P b c n","-P 2n 2ab","60","","Copper(I) complex of 4-amino-5-oxo-3-thioxo-6-methyl-2,3,4,5-tetra-hydro- 1,2,4-triazine","","- C8 H12 Cl Cu N8 O2 S2 -","- C8 H12 Cl Cu N8 O2 S2 -","- C32 H48 Cl4 Cu4 N32 O8 S8 -","4","0.5","SK1282","Razak, Ibrahim Abdul; Chinnakali, Kandasamy; Fun, Hoong-Kun; Yang, Ping; Zeng, Wen-Ru; Xie, Fu-Xin; Tian, Yu-Peng; Zhang, Hao","A copper(I) complex of 4-amino-3-thioxo-6-methyl-2,3,4,5-tetrahydro-1,2,4-triazin-5-one","Acta Crystallographica Section C","1999","55","7","1092","1093","10.1107/S0108270199003893","","","0.71073","MoKα","","0.052","0.035","","","","0.08","","","","","","1.04","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008738","15.1789","0.0006","15.8689","0.0006","9.2735","0.0003","90","","102.396","0.001","90","","2181.66","0.14","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl(5SR,6SR)-1,3-dichloro-8-(diethylamino)-5,6-dihydro-5-hydroxy-6- phenyl-7-nitro-5-isoquinolinecarboxylate","","- C21 H21 Cl2 N3 O5 -","- C21 H21 Cl2 N3 O5 -","- C84 H84 Cl8 N12 O20 -","4","1","SK1283","Tarun Kumar Sarkar; Sunil Kumar Ghosh; Gur Dayal Nigam; Kandasamy Chinnakali; Hoong-Kun Fun","Methyl (5<i>SR</i>,6<i>SR</i>)-1,3-dichloro-8-diethylamino-5,6-dihydro-5-hydroxy-7-nitro-6-phenylisoquinoline-5-carboxylate","Acta Crystallographica Section C","1999","55","7","1138","1140","10.1107/S010827019900390X","","","0.71073","MoKα","","0.054","0.039","","","","0.108","","","","","","1.03","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008739","7.596","0.007","27.69","0.02","7.276","0.011","93.117","0.009","91.114","0.011","82.374","0.008","1514","3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","tris(fluorene)-tetrakis(1,3,5-trinitrobenzene)","","- C31.5 H21 N6 O12 -","- C31.5 H21 N6 O12 -","- C63 H42 N12 O24 -","2","1","SX1080","Raúl A. Mariezcurrena; Silvia Russi; Alvaro W. Mombrú; Leopoldo Suescun; Helena Pardo; Osvaldo L. Tombesi; María A. Frontera","Mixed stacking and stoichiometry in a π-molecular complex between fluorene and 1,3,5-trinitrobenzene","Acta Crystallographica Section C","1999","55","7","1170","1173","10.1107/S0108270199003662","","","0.71069","MoKα","","0.0984","0.0505","","","","0.1838","","","","","","1.046","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008740","8.1017","0.0012","22.918","0.004","8.9358","0.0011","90","","94.453","0.008","90","","1654.1","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-(3,4-dimethoxyphenyl)-5a,6,8,9-tetrahydro-1H,7H- pyrano[4,3-b][1]benzopyran-1-one","","- C20 H20 O5 -","- C20 H20 O5 -","- C80 H80 O20 -","4","1","SX1082","Robinson, Paul D.; Beatty, Alicia; Hua, Duy H.; Chen, Yi; Meyers, Cal Y.; Perchellet, Elisabeth M.; Ladesich, James B.; Perchellet, Jean-Pierre","Racemic 3-(3,4-dimethoxyphenyl)-5a,6,8,9-tetrahydro-1<i>H</i>,7<i>H</i>-pyrano[4,3-<i>b</i>][1]benzopyran-1-one, an active antitumor agent","Acta Crystallographica Section C","1999","55","7","1188","1190","10.1107/S0108270199003315","","","0.71073","MoKα","","0.073","0.054","","","","0.15","","","","","","1.056","","","","has coordinates,has disorder","301791","2025-08-18","23:15:33",""
"2008741","26.413","0.004","9.4429","0.0008","14.2752","0.0012","90","","100.703","0.009","90","","3498.5","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C38 H30 Co Pd S4 -","- C38 H30 Co Pd S4 -","- C152 H120 Co4 Pd4 S16 -","4","0.5","TA1234","Sheu, Chou-Fu; Lee, Jung-Si","Charge-transfer salt of bis(<i>cis</i>-1,2-diphenylethene-1,2-dithiolato)palladate(1 ‒) with cobaltocenium, and neutral bis(<i>cis</i>-1,2-diphenylethene-1,2-dithiolato)palladium","Acta Crystallographica Section C","1999","55","7","1069","1072","10.1107/S0108270199004564","","","0.71073","MoKα","","0.058","0.039","","0.098","0.088","","","","1.072","1.105","1.105","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008742","5.9472","0.0006","11.2387","0.001","18.6239","0.0013","90","","91.659","0.007","90","","1244.28","0.19","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H20 Pd S4 -","- C28 H20 Pd S4 -","- C56 H40 Pd2 S8 -","2","0.5","TA1234","Sheu, Chou-Fu; Lee, Jung-Si","Charge-transfer salt of bis(<i>cis</i>-1,2-diphenylethene-1,2-dithiolato)palladate(1 ‒) with cobaltocenium, and neutral bis(<i>cis</i>-1,2-diphenylethene-1,2-dithiolato)palladium","Acta Crystallographica Section C","1999","55","7","1069","1072","10.1107/S0108270199004564","","","0.71073","MoKα","","0.029","0.023","","0.064","0.06","","","","1.052","1.058","1.058","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008743","6.5333","0.0002","7.9424","0.0004","10.2197","0.0004","90","","100.966","0.002","90","","520.62","0.04","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","Cobalt nitropentaammiacate hexafluorosilicon","","","- Co F6 H15 N6 O2 Si -","- Co F6 H15 N6 O2 Si -","- Co2 F12 H30 N12 O4 Si2 -","2","0.5","AV1028","Naumov, Dmitry Yu.; Kashcheeva, Natalia E.; Boldyreva, Elena V.; Howard, Judith A. K.","Pentaamminenitrocobalt(III) hexafluorosilicate(IV) at 293 and 150K","Acta Crystallographica Section C","1999","55","8","1205","1208","10.1107/S0108270199005764","","","0.71073","MoKα","","0.054","0.044","","","","0.077","","","","","","1.144","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008744","6.5034","0.0002","7.9206","0.0003","10.1816","0.0004","90","","100.911","0.002","90","","514.98","0.03","150","2","150","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","Cobalt nitropentaammiacate hexafluorosilicon","","","- Co F6 H15 N6 O2 Si -","- Co F6 H15 N6 O2 Si -","- Co2 F12 H30 N12 O4 Si2 -","2","0.5","AV1028","Naumov, Dmitry Yu.; Kashcheeva, Natalia E.; Boldyreva, Elena V.; Howard, Judith A. K.","Pentaamminenitrocobalt(III) hexafluorosilicate(IV) at 293 and 150K","Acta Crystallographica Section C","1999","55","8","1205","1208","10.1107/S0108270199005764","","","0.71073","MoKα","","0.035","0.031","","","","0.063","","","","","","1.135","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008745","11.3231","0.0007","11.3446","0.0007","13.9047","0.0009","90","","98.676","0.001","90","","1765.7","0.19","296","1","296","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 Cl2 Co N4 -","- C16 H16 Cl2 Co N4 -","- C64 H64 Cl8 Co4 N16 -","4","1","BK1432","Yongkui Shan; Mayra E. Cádiz; Pedro L. Sánchez; Songping D. Huang","Dichlorobis(1-methyl-1<i>H</i>-benzimidazole-<i>N</i>^3^)cobalt(II)","Acta Crystallographica Section C","1999","55","8","1262","1263","10.1107/S0108270199004904","","","0.7107","MoKα","","0.047","0.043","","0.076","","0.07","","","1.19","","","1.33","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008746","12.7274","0.0003","5.5573","0.0002","15.161","0.0003","90","","102.935","0.0012","90","","1045.13","0.05","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","Neotame","[N-[N-(3,3-dimethylbutyl)-L-a-aspartyl]-L-phenylalanine 1-methyl ester]","","- C20 H32 N2 O6 -","- C20 H32 N2 O6 -","- C40 H64 N4 O12 -","2","1","BK1453","Wink, Donald J.; Schroeder, Stephen A.; Prakash, Indra; Lam, Kin-Chung; Rheingold, A. L.","Neotame, an alkylated dipeptide and high intensity sweetener","Acta Crystallographica Section C","1999","55","8","1365","1368","10.1107/S0108270199005284","","","0.71073","MoKα","","0.062","0.058","","","","0.182","","","","","","1.411","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008747","10.33","0.001","10.33","0.001","20.222","0.004","90","","90","","90","","2157.9","0.5","203","","203","","","","","","","","","5","I 41/a :2","-I 4ad","88","","tetrachlorotetra(2-propanol)uranium(IV)","","- C12 H32 Cl4 O4 U -","- C12 H32 Cl4 O4 U -","- C48 H128 Cl16 O16 U4 -","4","0.25","BK1458","Gordon, Pamela L.; Thompson, Julia A.; Watkin, John G.; Burns, Carol J.; Sauer, Nancy N.; Scott, Brian L.","Tetrachlorotetrakis(propan-2-ol)uranium(IV) and tetrachlorotetrakis(propan-2-ol)thorium(IV)","Acta Crystallographica Section C","1999","55","8","1275","1278","10.1107/S0108270199004898","","","0.71073","MoKα","","0.027","0.021","","","","0.051","","","","","","1.07","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008748","10.447","0.001","10.447","0.001","20.395","0.001","90","","90","","90","","2225.9","0.3","203","","203","","","","","","","","","5","I 41/a :2","-I 4ad","88","","tetrachlorotetra(2-proponol)thorium(IV)","","- C12 H32 Cl4 O4 Th -","- C12 H32 Cl4 O4 Th -","- C48 H128 Cl16 O16 Th4 -","4","0.25","BK1458","Gordon, Pamela L.; Thompson, Julia A.; Watkin, John G.; Burns, Carol J.; Sauer, Nancy N.; Scott, Brian L.","Tetrachlorotetrakis(propan-2-ol)uranium(IV) and tetrachlorotetrakis(propan-2-ol)thorium(IV)","Acta Crystallographica Section C","1999","55","8","1275","1278","10.1107/S0108270199004898","","","0.71073","MoKα","","0.03","0.021","","","","0.045","","","","","","1.18","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008749","10.036","0.002","18.669","0.004","6.717","0.0013","90","","98.62","0.03","90","","1244.3","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","catena-(2,2' bipyridine-N,N')(μ ~3~ -sulfito O:O:O) cadmium(II), dihydrate.","","- C10 H12 Cd N2 O5 S -","- C10 H12 Cd N2 O5 S -","- C40 H48 Cd4 N8 O20 S4 -","4","1","BK1460","Miguel Harvey; Sergio Baggio; Ricardo Baggio; Helena Pardo","Poly[[[aqua(2,2'-bipyridine-<i>N</i>,<i>N</i>')cadmium(II)]-μ~3~-sulfito-<i>O</i>:<i>O</i>:<i>O</i>'] hydrate]","Acta Crystallographica Section C","1999","55","8","1278","1280","10.1107/S0108270199005296","","","0.71073","MoKα","","0.036","0.026","","","","0.075","","","","","","0.986","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008750","8.647","0.001","8.701","0.002","11.683","0.002","84.68","0.01","70.24","0.02","74.96","0.01","798.9","0.3","290","2","290","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H44 N6 O10 U -","- C22 H44 N6 O10 U -","- C22 H44 N6 O10 U -","1","0.5","BK1467","Zhengbai Cao; Tieliu Qi; Limin Zhu; De-Chun Zhang; Ronhua Zhou; Kai-Bei Yu","Bis(1,3-dibutylimidazolidin-2-one-<i>O</i>)bis(nitrato-<i>O</i>,<i>O</i>')dioxouranium(VI)","Acta Crystallographica Section C","1999","55","8","1270","1272","10.1107/S0108270199004916","","","0.71073","MoKα","","0.028","0.027","","0.066","","0.061","","","0.995","","","1.003","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008751","7.066","0.003","14.723","0.008","18.219","0.006","90","","90","","90","","1895.4","1.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N,N'-diphenylguanidinium (+)-L-hydrogentartrate monohydrate","","- C17 H21 N3 O7 -","- C17 H21 N3 O7 -","- C68 H84 N12 O28 -","4","1","BM1310","Paixão, J. A.; Pereira Silva, P. S.; Matos Beja, A.; Ramos Silva, M.; de Matos Gomes, E.; Belsley, M.","<i>N</i>,<i>N</i>'-Diphenylguanidinium hydrogen (+)-<small>L</small>-tartrate monohydrate","Acta Crystallographica Section C","1999","55","8","1287","1290","10.1107/S0108270199005119","","","0.71073","MoKα","","0.044","0.032","","","","0.084","","","","","","1.057","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008752","8.904","0.002","14.657","0.003","17.19","0.003","90","","92.266","0.005","90","","2241.6","0.8","40","2","30","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","μ-azido-[μ-4-(3-methyl-2-pyridylamino)-1-(3-methyl-2-pyridylimino)- 1,2-dihydrophthalazin-2-yl]bis[azidocopper(II)]","","- C20 H17 Cu2 N15 -","- C20 H17 Cu2 N15 -","- C80 H68 Cu8 N60 -","4","1","BM1313","Goeta, Andres E.; Thompson, Laurence K.; Sheppard, Christopher L.; Tandon, Santokh S.; Lehmann, Christian W.; Cosier, John; Webster, Craig; Howard, Judith A.K.","[Cu~2~{1,4-bis[(3-methyl-2-pyridyl)amino]phthalazine –H}(N~3~)~3~] at 40K","Acta Crystallographica Section C","1999","55","8","1243","1246","10.1107/S0108270199005648","","","0.71073","MoKα","","0.04","0.028","","0.069","0.063","","","","1.056","1.063","1.063","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008753","8.2739","0.0012","20.681","0.004","8.5913","0.0011","90","","104.937","0.012","90","","1420.4","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","N-(4-cyanophenyl)-carbazole","N-(4-cyanophenyl)-carbazole","","- C19 H12 N2 -","- C19 H12 N2 -","- C76 H48 N8 -","4","1","BM1320","Satyen Saha; Anunay Samanta","The twisted structure of 9-(4-cyanophenyl)carbazole","Acta Crystallographica Section C","1999","55","8","1299","1300","10.1107/S0108270199005752","","","0.71073","MoKα","","0.077","0.043","","","","0.115","","","","","","1.046","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008754","10.39","0.002","14.394","0.003","7.884","0.002","90","","90","","90","","1179.1","0.4","143","2","173","2","","","","","","","","4","F d d 2","F 2 -2d","43","","4-Iodopyridine","","- C5 H4 I N -","- C5 H4 I N -","- C40 H32 I8 N8 -","8","0.5","BM1321","Ahrens, Birte; Jones, Peter G.","4-Iodopyridine, a structure with very short nitrogen–iodine contacts","Acta Crystallographica Section C","1999","55","8","1308","1310","10.1107/S0108270199005521","","","0.71073","MoKα","","0.0181","0.0154","","","","0.0343","","","","","","1.127","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008755","7.765","0.001","9.692","0.002","18.855","0.003","90","","90","","90","","1419","0.4","143","2","143","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(6R,12R,14R)-(E,E)-12-Hydroxy-6,14-dimethyl-1,7-dioxa-3,9-cyclotetradecadiene- 2,8,11-trione","","- C14 H18 O6 -","- C14 H18 O6 -","- C56 H72 O24 -","4","1","BM1328","Höller, Ulrich; Wright, Anthony D.; König, Gabriele M.; Jones, Peter G.","Colletoketol","Acta Crystallographica Section C","1999","55","8","1310","1313","10.1107/S0108270199005533","","","0.71073","MoKα","","0.0543","0.041","","","","0.103","","","","","","1.067","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008756","9.165","0.003","36.319","0.003","8.353","0.004","90","","90","","90","","2780.4","1.6","213","1","213","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2,3,4,5,6,7-hexahydro-9,10-dimethoxy-1,2-benzothiazonin-3-one 1,1-dioxide","","- C13 H17 N O5 S -","- C13 H17 N O5 S -","- C104 H136 N8 O40 S8 -","8","1","BM1336","Linden, Anthony; Todorova, Tonya R.; Heimgartner, Heinz","2,3,4,5,6,7-Hexahydro-9,10-dimethoxy-1,2-benzothiazonin-3-one 1,1-dioxide","Acta Crystallographica Section C","1999","55","8","1375","1377","10.1107/S0108270199007489","","","0.71069","MoKα","","0.071","0.042","","","","0.115","","","","","","1.04","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008757","5.6804","0.0015","11.117","0.002","8.7621","0.0008","90","","94.27","0.013","90","","551.78","0.18","173","1","173","1","","","","","","","","5","P 1 21 1","P 2yb","4","","3,4,5,6,7,8-hexahydro-10,10-dimethyl-1,2,8-thiadiazecin-9(10H)-one 1,1-dioxide","","- C9 H18 N2 O3 S -","- C9 H18 N2 O3 S -","- C18 H36 N4 O6 S2 -","2","1","BM1340","Linden, Anthony; Todorova, Tonya R.; Heimgartner, Heinz","10,10-Dimethyl-1,2,8-thiadiazecan-9-one 1,1-dioxide","Acta Crystallographica Section C","1999","55","8","1378","1380","10.1107/S0108270199007611","","","0.71069","MoKα","","0.028","0.027","","","","0.072","","","","","","1.062","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008758","18.2534","0.0009","6.3271","0.0003","14.7428","0.0007","90","","90","","90","","1702.66","0.14","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- O20 P5 Ti3 Tl3 -","- O20 P5 Ti3 Tl3 -","- O80 P20 Ti12 Tl12 -","4","1","BR1228","Harrison, William T. A.","Thallium titanium phosphate, Tl~3~Ti~3~O(PO~4~)~3~(P~2~O~7~)","Acta Crystallographica Section C","1999","55","8","1200","1203","10.1107/S0108270199006721","","","0.71073","MoKα","","0.036","0.033","","","","0.087","","","","","","1.044","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008759","10.2499","0.0009","10.2499","0.0009","6.0322","0.0008","90","","90","","120","","548.84","0.1","153","2","153","2","","","","","","","","4","P 63","P 6c","173","","dysprosium copper germanium selenide","","- Cu Dy3 Ge Se7 -","- Cu Dy3 Ge Se7 -","- Cu2 Dy6 Ge2 Se14 -","2","0.333333","BR1239","Huang, Fu Qiang; Ibers, James A.","Dy~3~CuGeSe~7~","Acta Crystallographica Section C","1999","55","8","1210","1212","10.1107/S0108270199004606","","","0.71073","MoKα","","0.025","0.021","","","","0.053","","","","","","1.037","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008760","9.205","0.003","4.4822","0.001","17.8738","0.0013","90","","90","","90","","737.4","0.3","293","2","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ag Cl3 Rb2 -","- Ag Cl3 Rb2 -","- Ag4 Cl12 Rb8 -","4","0.5","BR1243","Hasselgren, Catrin; Jagner, Susan","Dirubidium <i>catena</i>-poly[dichloroargentate(I)-μ-chloro]","Acta Crystallographica Section C","1999","55","8","1208","1210","10.1107/S0108270199006277","","","0.71073","MoKα","","","0.035","","","","0.094","","","","","","1.046","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008761","4.7034","0.001","7.1735","0.0013","15.643","0.002","90","","90","","90","","527.79","0.16","293","2","293","2","","","","","","","","3","I m m m","-I 2 2","71","","trilithium tetrabarium tetraarsenide","","- As4 Ba3 Li4 -","- As4 Ba3 Li4 -","- As8 Ba6 Li8 -","2","0.125","BR1246","Monconduit, Laure; Belin, Claude","Lithium barium arsenide, Li~4~Ba~3~As~4~, containing isolated As^3-^ and As~2~^4-^ anions","Acta Crystallographica Section C","1999","55","8","1199","1200","10.1107/S0108270199006927","","","0.71069","MoKα","","0.042","0.038","","","","0.107","","","","","","1.217","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008762","25.119","0.003","11.104","0.004","7.57","0.003","90","","103.53","0.02","90","","2052.8","1.1","150","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","4-phenyl-1,2,3,5-dithiadiazolylium chloride","4-phenyl-1,2,3,5-dithiadiazolylium chloride","","- C7.5 H6 Cl2 N2 S2 -","- C7.5 H6 Cl2 N2 S2 -","- C60 H48 Cl16 N16 S16 -","8","1","CF1280","Smith, J. Nicholas B.; Rawson, Jeremy M.; Davies, John E.","A dithiadiazolylium chloride salt from the reaction of 4-phenyl-1,2,3,5-dithiadiazolyl with gold(I) chloride","Acta Crystallographica Section C","1999","55","8","1330","1332","10.1107/S0108270198018022","","","0.71073","MoKα","","0.068","0.044","","0.115","0.102","","","","1.082","1.123","1.123","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008763","8.783","0.001","13.629","0.002","15.411","0.002","90","","94.71","0.01","90","","1838.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraaqua(1,10-Phenanthroline)Nickel(II) Dinitrate Monohydrate","","- C12 H18 N4 Ni O11 -","- C12 H18 N4 Ni O11 -","- C48 H72 N16 Ni4 O44 -","4","1","CF1300","Namouchi Cherni, Saoussen; Driss, Ahmed; Jouini, Tahar","Tetraaqua(1,10-phenanthroline-<i>N</i>,<i>N</i>)nickel(II) dinitrate monohydrate","Acta Crystallographica Section C","1999","55","8","1248","1250","10.1107/S0108270199004874","","","0.71069","MoKα","","0.0499","0.0352","","0.0877","0.08","","","","1.053","1.091","1.091","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008764","11.957","0.003","12.966","0.003","13.041","0.003","114.31","0.02","109.41","0.02","94.62","0.02","1681.3","0.8","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","3,7:7,8:7,11-tri(μ-thiobenzoate-S:O)-10-(triphenylphosphine-P)-8,9- μH-7-nickela-nido-undecaborane","","- C24 H31 B10 Ni O3 P S3 -","- C24 H31 B10 Ni O3 P S3 -","- C48 H62 B20 Ni2 O6 P2 S6 -","2","1","CF1304","Dou, Jian-Min; Hu,Chun-Hua; Yao, Hai-Jun; Jin, Ruo-Shui; Zheng, Pei-Ju","A three-ring <i>exo</i>-polyhedral-cyclized nickelaundecaborane cluster: [(CH~3~COS)~3~NiB~10~H~7~(PPh~3~)]","Acta Crystallographica Section C","1999","55","8","1226","1228","10.1107/S0108270199004667","","","0.71073","MoKα","","0.088","0.045","","","","0.149","","","","","","1.047","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008765","12.235","0.004","13.719","0.007","16.974","0.007","90","","92.45","0.05","90","","2847","2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-butyl-5-methyl-6-(1-oxopyridin-2-yl)-1-{[2'-(1H-tetrazol-5-yl)biphenyl- 4-yl]methyl}-1H-imidazo[5,4-b]pyridine methanol solvate","","- C31 H32 N8 O2 -","- C31 H32 N8 O2 -","- C124 H128 N32 O8 -","4","1","CF1305","Heo, Yong-Seok; Yi, Kyu Yang; Yoo, Sung Eun; Shin, Whanchul","A non-peptide angiotensin II receptor antagonist: 2-butyl-6-methyl-5-(1-oxopyrid-2-yl)-1-{[2'-(1<i>H</i>-tetrazol-5-yl)biphenyl-4-yl]methyl}-1<i>H</i>-imidazo[5,4-<i>b</i>]pyridine methanol solvate","Acta Crystallographica Section C","1999","55","8","1345","1347","10.1107/S0108270199004679","","","0.71073","MoKα","","0.1475","0.0691","","","","0.1937","","","","","","1.022","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:33",""
"2008766","10.764","0.003","10.764","0.003","37.939","0.007","90","","90","","90","","4395.8","1.9","298.2","","298.2","","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","binaphthalene","","","- C26 H22 O6 -","- C26 H20.5 O6 -","- C208 H164 O48 -","8","1","CF1308","Tachi, Yoshimitsu; Nakayama, Shinya; Tani, Fumito; Ueno, Go; Naruta, Yoshinori","(<i>S</i>)-2,2'-Bis(methoxymethoxy)[1,1'-binaphthyl]-3,3'-dicarbaldehyde","Acta Crystallographica Section C","1999","55","8","1351","1353","10.1107/S0108270199004680","","","1.5418","CuKα","","0.0676","0.0413","","","","0.1287","","","","","","1.424","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2008767","14.623","0.007","9.729","0.005","19.228","0.01","90","","90","","90","","2736","2","180","2","180","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","Sodium nitrilotriacetatomagnesium pentahydrate","Sodium nitriloacetatomagnesate(1-) pentahydrate","","- C6 H16 Mg N Na O11 -","- C6 H16 Mg N Na O11 -","- C48 H128 Mg8 N8 Na8 O88 -","8","1","CF1309","Kaneyoshi, Masami; Bond, Andrew; Jones, William","Sodium (nitrilotriacetato)magnesate pentahydrate","Acta Crystallographica Section C","1999","55","8","1260","1262","10.1107/S0108270199004886","","","1.54178","CuKα","","0.039","0.03","","","","0.077","","","","","","1.062","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008768","8.3743","0.0004","9.6681","0.0007","10.7682","0.0009","100.195","0.006","104.465","0.005","105.408","0.005","785.71","0.1","293","2","292","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H15 Cl3 O2 Te -","- C12 H15 Cl3 O2 Te -","- C24 H30 Cl6 O4 Te2 -","2","1","DA1059","Zukerman-Schpector, J.; Camillo, Robinson L.; Comasseto, João V.; Cunha, Rodrigo L. O. R.; Chieffi, André; Zeni, Gilson; Caracelli, I.","Dichloro[(<i>E</i>)-2-chloro-1-(2-hydroxyprop-2-yl)vinyl](4-methoxyphenyl)tellurium(IV)","Acta Crystallographica Section C","1999","55","8","1339","1342","10.1107/S0108270199004813","","","0.71073","MoKα","","0.031","0.027","","","","0.073","","","","","","1.121","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008769","9.0494","0.0012","17.475","0.002","10.5357","0.001","90","","106.359","0.008","90","","1598.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","[bis(cyclohexylamine)cadmium(II) bis{tricyanocadmate(II)}]-toluene (1/1)","","- C25 H34 Cd3 N8 -","- C25 H34 Cd3 N8 -","- C50 H68 Cd6 N16 -","2","0.5","DA1061","Kim, Chong-Hyeak; Lee, Sueg-Geun; Suh, Il-Hwan","A three-dimensional host framework with small tetragonal and large hexagonal channels","Acta Crystallographica Section C","1999","55","8","1238","1241","10.1107/S0108270199004825","","","0.71073","MoKα","","0.055","0.039","","0.105","0.097","","","","1.042","1.093","1.093","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008770","10.598","0.002","10.88","0.003","18.824","0.001","75.17","0.01","80.87","0.01","73.72","0.02","2005.2","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H30 Fe O5 P2 Pt2 Se -","- C41 H30 Fe O5 P2 Pt2 Se -","- C82 H60 Fe2 O10 P4 Pt4 Se2 -","2","1","DA1064","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Tung, Shu-Fang; Dash, Aswini K.; Mathur, Pradeep","A selenium-bridged mixed-metal cluster, (CO)~5~(PPh~3~)~2~FePt~2~(μ~3~-Se)","Acta Crystallographica Section C","1999","55","8","1250","1253","10.1107/S0108270199004837","","","0.71073","MoKα","","0.087","0.045","","","","0.11","","","","","","0.92","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008771","8.0204","0.0005","9.0398","0.001","22.5974","0.0015","90","","96.362","0.006","90","","1628.3","0.2","123","2","123","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","dimer of 2-methylene-3,4-dihydo-1(2H)-naphthalenone","3,4-dihydronaphthyl[2,3-b]tetrahydropyran- 2-spiro-2'-3,4-dihydro-1(2H)-naphthalenone","","- C22 H20 O2 -","- C22 H20 O2 -","- C88 H80 O8 -","4","1","DA1069","Quail, J. Wilson; Pandeya, Surendra N.; Dimmock, Jonathan R.","3,4,5,6-Tetrahydro-2<i>H</i>-naphtho[1,2-<i>b</i>]pyran-2-spiro-2'-1',2',3',4'-tetrahydronaphthalene-1'-one","Acta Crystallographica Section C","1999","55","8","1349","1351","10.1107/S0108270199005417","","","0.71073","MoKα","","0.047","0.038","","","","0.199","","","","","","1.047","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008772","8.441","0.004","21.879","0.007","15.561","0.004","90","","95.72","0.03","90","","2859.5","1.8","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","1,2:1,3-di(μ-thioacetato-S:O)-1-(triphenylphosphine-P)-1-ruthena- closo-undecaborane","","- C22 H29 B10 O2 P Ru S2 -","- C22 H29 B10 O2 P Ru S2 -","- C88 H116 B40 O8 P4 Ru4 S8 -","4","1","FG1533","Nie, Yong; Hu, Chun-Hua; Sun, Jie; Jin, Ruo-Shui; Zheng, Pei-Ju","An <i>exo</i>-polyhedral bicyclic 11-vertex <i>closo</i>-ruthenaborane: [(PPh~3~)(CH~3~COS)~2~RuB~10~H~8~]","Acta Crystallographica Section C","1999","55","8","1224","1226","10.1107/S010827019900462X","","","0.71069","MoKα","","","0.047","","","","0.167","","","","","","1.138","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008773","12.248","0.002","14.377","0.001","19.15","0.002","90","","103.547","0.011","90","","3278.3","0.7","298","2","298","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Hydroxotriphenyltin 2,6-di(2-benzimidazolyl)pyridine hydrate (1:1:1)","","- C37 H31 N5 O2 Sn -","- C37 H31 N5 O2 Sn -","- C148 H124 N20 O8 Sn4 -","4","1","FG1540","Lo, Kong Mun; Kumar Das, V.G.; Ng, Seik Weng","Hydroxotriphenyltin 2,6-bis(1<i>H</i>-benzimidazol-2-yl)pyridine hydrate","Acta Crystallographica Section C","1999","55","8","1234","1236","10.1107/S0108270199004072","","","0.71073","MoKα","","0.088","0.052","","","","0.127","","","","","","0.959","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008774","20.0869","0.0002","13.7875","0.0005","9.4187","0.0006","90","","102.672","0.002","90","","2544.95","0.19","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","3-Butyl-5-hydroxy-4-iodo-hexahydro-pyrolo[1,2-c][1,3] oxazin-1-one","","- C11 H18 I N O3 -","- C11 H18 I N O3 -","- C88 H144 I8 N8 O24 -","8","2","FG1542","Batey, Robert A.; MacKay, D. Bruce; Lough, Alan J.","3-Butyl-5-hydroxy-4-iodohexahydropyrrolo[1,2-<i>c</i>][1,3]oxazin-1-one","Acta Crystallographica Section C","1999","55","8","1362","1363","10.1107/S0108270199004497","","","0.71073","MoKα","","0.0336","0.0249","","","","0.0624","","","","","","1.03","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008775","11.966","0.003","8.602","0.001","23.688","0.003","90","","101.09","0.01","90","","2392.7","0.7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(±)-2-Aza-3,9-dioxotricyclo[4.4.4.0^1,6^]tetradecane","","- C13 H19 N O2 -","- C13 H19 N O2 -","- C104 H152 N8 O16 -","8","1","FG1543","Zwege, Daniel; Thompson, Hugh W.; Brunskill, Andrew P. J.; Lalancette, Roger A.","(+/-)-2-Aza-3,9-dioxotricyclo[4.4.4.0^1,6^]tetradecane: dimeric and catemeric hydrogen bonding in two polymorphs of a propellanoid keto lactam","Acta Crystallographica Section C","1999","55","8","1370","1373","10.1107/S0108270199004485","","","0.71073","MoKα","","0.149","0.065","","","","0.162","","","","","","1.01","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008776","11.135","0.002","7.626","0.002","13.58","0.002","90","","90.62","0.01","90","","1153.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(±)-2-Aza-3,9-dioxotricyclo[4.4.4.0^1,6^]tetradecane","","- C13 H19 N O2 -","- C13 H19 N O2 -","- C52 H76 N4 O8 -","4","1","FG1543","Zwege, Daniel; Thompson, Hugh W.; Brunskill, Andrew P. J.; Lalancette, Roger A.","(+/-)-2-Aza-3,9-dioxotricyclo[4.4.4.0^1,6^]tetradecane: dimeric and catemeric hydrogen bonding in two polymorphs of a propellanoid keto lactam","Acta Crystallographica Section C","1999","55","8","1370","1373","10.1107/S0108270199004485","","","0.71073","MoKα","","0.1","0.06","","","","0.151","","","","","","1.03","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008777","12.6008","0.0011","11.349","0.003","15.634","0.002","90","","94.888","0.009","90","","2227.6","0.7","293","1","293","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Aquotrimethyltin(4-(4-chlorophenyl)-2-phenyl-5-thiazoleacetate)","Aqua[4-(4-chlorophenyl)-2-phenylthiazole-5-acetate-O]trimethyltin(IV)","","- C20 H22 Cl N O3 S Sn -","- C20 H22 Cl N O3 S Sn -","- C80 H88 Cl4 N4 O12 S4 Sn4 -","4","1","FG1550","Parvez, Masood; Ali, Saqib; Mazhar, Muhammad; Bhatti, M. Hussain; Khokhar, M. Nawaz","Aqua[4-(4-chlorophenyl)-2-phenylthiazole-5-acetato-<i>O</i>]trimethyltin(IV)","Acta Crystallographica Section C","1999","55","8","1280","1282","10.1107/S0108270199005120","","","1.54178","CuKα","","0.055","0.043","","","","0.114","","","","","","1.025","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008778","7.581","0.001","8.663","0.001","11.475","0.001","90","","106.44","0.01","90","","722.8","0.15","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","DM08","","- C15 H22 O3 -","- C15 H22 O3 -","- C30 H44 O6 -","2","1","FR1146","Branco, Marcelo Cardoso; Gambardella, Maria Teresa do P.; Vasconcellos, Mario L. A. A.; Barreiros, Uendel G.","(1<i>R</i>,2<i>R</i>,3<i>R</i>,3'<i>R</i>,4<i>R</i>)-3-[(2-Furyl)hydroxymethyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol, a new camphor-based chiral auxiliary","Acta Crystallographica Section C","1999","55","8","1295","1297","10.1107/S0108270199000645","","","0.71073","MoKα","","0.11","0.052","","0.122","0.11","","","","0.905","1.184","1.184","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008779","10.1962","0.0002","10.1962","0.0002","21.0571","0.0007","90","","90","","90","","2189.15","0.09","293","2","293","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","Dichloro-(tetrahydrogen-ethylenediamine-tetraacetate)-palladium(II) hexahydrate","","- C10 H28 Cl2 N2 O14 Pd -","- C10 H28 Cl2 N2 O14 Pd -","- C40 H112 Cl8 N8 O56 Pd4 -","4","0.5","FR1173","Xue-mei Luo; Xiao-hua Chen; Shanmuga Sundara Raj, S.; Hoong-Kun Fun; Long-gen Zhu","Dichloro(ethylenediaminetetraacetic acid)palladium(II) hexahydrate","Acta Crystallographica Section C","1999","55","8","1220","1222","10.1107/S0108270199005958","","","0.71073","MoKα","","0.039","0.032","","","","0.081","","","","","","1.085","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008780","9.6507","0.0002","14.277","0.0003","15.0369","0.0004","75.17","0.001","82.067","0.001","83.358","0.001","1976.65","0.08","301","2","301","2","","","","","","","","6","P -1","-P 1","2","","Bis [bis(triphenylphosphoranylidene)ammonium] μ-tetrathiaoxalato-bis[(1,3-dithiol-2-thione-4,5-dithiolato)nickelate(II)]","","- C80 H60 N2 Ni2 P4 S14 -","- C80 H60 N2 Ni2 P4 S14 -","- C80 H60 N2 Ni2 P4 S14 -","1","0.5","FR1185","Geiser, Urs; Mercuri, Maria Laura; Parakka, James P.","Bis[bis(triphenylphosphoranylidene)ammonium] μ-tetrathiaoxalato-bis[(2-thioxo-1,3-dithiole-4,5-dithiolato)nickelate(II)]","Acta Crystallographica Section C","1999","55","8","1253","1255","10.1107/S0108270199004692","","","0.71073","MoKα","","0.095","0.059","","","","0.122","","","","","","1.105","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008781","9.919","0.007","19.331","0.007","11.08","0.008","90","","96.53","0.06","90","","2111","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","(2S*,4S*,5R*,5'S*)-4-methyl-2-(3'-methyl-2'- isoxazolin-5'-yl)-5-phenyl-3-(toluene-4""- sulfonyl)oxazolidin","","- C21 H24 N2 O4 S -","- C21 H24 N2 O4 S -","- C84 H96 N8 O16 S4 -","4","1","FR1188","Rochon, Fernande D.; Breau, Livain","(2<i>S</i>*,4<i>S</i>*,5<i>R</i>*)-4-Methyl-2-[(5<i>S</i>*)-3-methyl-4,5-dihydroisoxazol-5-yl]-5-phenyl-3-(toluene-4-sulfonyl)oxazolidine","Acta Crystallographica Section C","1999","55","8","1373","1375","10.1107/S0108270199005557","","","0.71073","MoKα","","0.191","0.066","","0.098","0.074","","","","1.037","1.265","1.265","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008782","6.955","0.0008","14.4941","0.0011","12.2793","0.0008","90","","101.523","0.007","90","","1212.88","0.19","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","trans-N-(6-Bromocyclohex-2-enyl)pyridinium bromide","","- C11 H13 Br2 N -","- C11 H13 Br2 N -","- C44 H52 Br8 N4 -","4","1","FR1193","Han, Xinghua; Baker, Ronald J.; Masnovi, John","<i>trans</i>-(6-Bromo-2-cyclohexen-1-yl)pyridinium bromide","Acta Crystallographica Section C","1999","55","8","1360","1361","10.1107/S0108270199004709","","","0.7093","MolybdenumKα","","0.045","0.045","","0.041","","0.041","","","","","","1.78","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008783","7.1732","0.0017","21.285","0.006","12.28","0.003","90","","92.05","0.02","90","","1873.7","0.8","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","[Aquo(1,10-phenanthroline)(L-prolinato)copper(II)] nitrate hydrate","","- C34 H40 Cu2 N8 O14 -","- C34 H40 Cu2 N8 O14 -","- C68 H80 Cu4 N16 O28 -","2","1","FR1195","Venkatraman, Ramaiyer; Zubkowski, Jeffrey D.; Valente, Edward J.","Aqua(1,10-phenanthroline)(<small>L</small>-prolinato)copper(II) nitrate monohydrate","Acta Crystallographica Section C","1999","55","8","1241","1243","10.1107/S0108270199005570","","","0.71073","MoKα","","0.075","0.042","","","","0.101","","","","","","0.744","","","","has coordinates","199607","2020-10-21","18:00:00",""
"2008784","5.6134","0.0001","9.9847","0.0003","21.5896","0.0002","90","","93.639","0.001","90","","1207.62","0.04","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","α-cyano-β-hydroxy-β-methyl-N-(2,5-dibromophenyl)propenamide","","- C11 H8 Br2 N2 O2 -","- C11 H8 Br2 N2 O2 -","- C44 H32 Br8 N8 O8 -","4","1","FR1196","Ghosh, Sutapa","α-Cyano-<i>N</i>-(2,5-dibromophenyl)-β-hydroxybut-2-enamide","Acta Crystallographica Section C","1999","55","8","1364","1365","10.1107/S0108270199005727","","","0.71073","MoKα","","0.0532","0.0402","","","","0.0996","","","","","","1.007","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008785","11.511","0.004","22.022","0.003","12.521","0.002","90","","107.71","0.02","90","","3023.6","1.3","294","","294.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H68 Cl6 N10 Ni2 O16 -","- C48 H68 Cl6 N10 Ni2 O16 -","- C96 H136 Cl12 N20 Ni4 O32 -","2","0.5","FR1198","Bing Tong; Richard E. Norman; Shih-Chi Chang","Di-μ-chloro-bis{[tris(2-pyridylmethyl)amine-κ^4^<i>N</i>]nickel(II)} bis(triethylammonium) tetraperchlorate","Acta Crystallographica Section C","1999","55","8","1236","1238","10.1107/S010827019900596X","","","0.7107","MoKα","","0.097","0.045","","0.06","","0.054","","","1.672","","","1.96","","","","has coordinates","196234","2020-10-21","18:00:00",""
"2008786","6.905","0.003","11.05","0.006","16.835","0.002","90","","90","","90","","1284.5","0.9","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","iodo(di-n-propyldithiocarbamato)selenium(II)","catena-μ-iodo-(di-n-propyldithiocarbamato)selenium(II)","","- C7 H14 I N S2 Se -","- C7 H14 I N S2 Se -","- C28 H56 I4 N4 S8 Se4 -","4","1","GD1008","S. Rajashree; G. Aravamudan; Kandasamy Sivakumar","The first mixed iodide–dithiocarbamate complex of selenium(II): <i>catena</i>-poly[[(di-<i>n</i>-propyldithiocarbamato-<i>S</i>,<i>S</i>')selenium(II)]-μ-iodo]","Acta Crystallographica Section C","1999","55","8","1320","1322","10.1107/S0108270199003996","","","0.71069","MoKα","","0.051","0.035","","","","0.094","","","","","","1.092","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008787","12.758","0.003","6.964","0.001","16.053","0.003","90","","90","","90","","1426.3","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C6 H7 N3 O3 -","- C6 H7 N3 O3 -","- C48 H56 N24 O24 -","8","1","GD1027","Zaleski, Jacek; Daszkiewicz, Zdzisław; Kyzioł, Janusz B.","4-(<i>N</i>-Methylnitramino)pyridine 1-oxide","Acta Crystallographica Section C","1999","55","8","1292","1295","10.1107/S0108270199004552","","","0.71073","MoKα","","0.1236","0.0585","","","","0.1804","","","","","","1.092","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008788","12.756","0.003","6.87","0.001","15.74","0.003","90","","90","","90","","1379.4","0.5","90","0.1","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-(N-Methylnitramino)-pyridine 1-oxide","","- C6 H7 N3 O3 -","- C6 H7 N3 O3 -","- C48 H56 N24 O24 -","8","1","GD1027","Zaleski, Jacek; Daszkiewicz, Zdzisław; Kyzioł, Janusz B.","4-(<i>N</i>-Methylnitramino)pyridine 1-oxide","Acta Crystallographica Section C","1999","55","8","1292","1295","10.1107/S0108270199004552","","","0.71073","MoKα","","0.1045","0.0575","","","","0.1462","","","","","","1.153","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008789","7.9167","0.0007","22.1936","0.0016","9.9382","0.0011","90","","96.612","0.011","90","","1734.5","0.3","294","1","294","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","N-Ferrocenoyl glycine benzyl ester","N-Ferrocenoyl glycine benzyl ester","","- C20 H19 Fe N O3 -","- C20 H19 Fe N O3 -","- C80 H76 Fe4 N4 O12 -","4","1","GD1028","Gallagher, John F.; Kenny, Peter T.M.; Sheehy, Michael J.","Intramolecular C—H···O and intermolecular N—H···O and C—H···O interactions in <i>N</i>-ferrocenoylglycine benzyl ester, an effective dihydrogen phosphate anion sensing agent","Acta Crystallographica Section C","1999","55","8","1257","1260","10.1107/S010827019900520X","","","0.7107","MolybdenumKα","","0.0703","0.0427","","","","0.0851","","","","","","1.02","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008790","7.338","0.001","8.6269","0.0005","8.877","0.001","80.98","0.01","84.62","0.01","72.65","0.01","529.09","0.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[bis(benzimidazole-N^3^)copper(II)-μ-suberato-O,O':O'',O''']","","- C22 H24 Cu N4 O4 -","- C22 H24 Cu N4 O4 -","- C22 H24 Cu N4 O4 -","1","0.5","JZ1349","Sieroń, Lesław; Bukowska-Strzyżewska, Maria","<i>catena</i>-Poly[[bis(benzimidazole-<i>N</i>^3^)copper(II)]-μ-suberato-<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''] and <i>catena</i>-poly[[[bis(benzimidazole-<i>N</i>^3^)copper(II)]-μ-sebacato-<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''] dihydrate]","Acta Crystallographica Section C","1999","55","8","1230","1234","10.1107/S0108270199005399","","","1.54178","CuKα","","0.0319","0.0317","","","","0.0876","","","","","","1.083","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008791","6.85","0.004","9.071","0.003","11.208","0.004","74.68","0.03","74.46","0.03","71.13","0.03","622.7","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","catena-Poly[bis(benzimidazole-N^3^)copper(II)-μ-sebacato-O,O':O'',O'''] Dihydrate","","- C24 H32 Cu N4 O6 -","- C24 H32 Cu N4 O6 -","- C24 H32 Cu N4 O6 -","1","0.5","JZ1349","Sieroń, Lesław; Bukowska-Strzyżewska, Maria","<i>catena</i>-Poly[[bis(benzimidazole-<i>N</i>^3^)copper(II)]-μ-suberato-<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''] and <i>catena</i>-poly[[[bis(benzimidazole-<i>N</i>^3^)copper(II)]-μ-sebacato-<i>O</i>,<i>O</i>':<i>O</i>'',<i>O</i>'''] dihydrate]","Acta Crystallographica Section C","1999","55","8","1230","1234","10.1107/S0108270199005399","","","1.54178","CuKα","","0.0473","0.042","","","","0.115","","","","","","1.084","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008792","5.2214","0.0001","13.1487","0.0002","13.4792","0.0002","119.075","0.001","91.46","0.001","90.094","0.001","808.43","0.02","293","","293","","","","","","","","","4","P -1","-P 1","2","","4,6-Bis(benzyloxy)-1,3,5-triazin-2-amine","","- C17 H16 N4 O2 -","- C17 H16 N4 O2 -","- C34 H32 N8 O4 -","2","1","JZ1354","Bolte, Michael; Sommer, Andrea; Noe, Christian Roland","4,6-Bis(benzyloxy)-1,3,5-triazin-2-ylamine","Acta Crystallographica Section C","1999","55","8","1304","1306","10.1107/S0108270199005971","","","0.71073","MoKα","","0.0522","0.0429","","0.1201","0.1114","0.1201","","","1.13","","","1.13","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008793","11.124","0.002","14.78","0.003","7.129","0.001","90","","93.17","0.03","90","","1170.3","0.4","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-(4-Methylbenzoyl)benzoic acid","","- C15 H12 O3 -","- C15 H12 O3 -","- C60 H48 O12 -","4","1","JZ1357","Degen, Alexander; Bolte, Michael","2-(p-Toluoyl)benzoic acid","Acta Crystallographica Section C","1999","55","8","1306","1308","10.1107/S0108270199006150","","","0.71073","MoKα","","0.134","0.058","","","","0.128","","","","","","1.032","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008794","5.0861","0.001","12.198","0.002","13.76","0.002","90","","96.07","0.015","90","","848.9","0.3","293","2","292","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C6 H8 N4 O4 -","- C6 H8 N4 O4 -","- C24 H32 N16 O16 -","4","1","KA1296","Velikova, Velichka; Bakardjeva,Snejana; Angelova,Olyana","<i>N</i>-(2-Pyridinium)urea nitrate","Acta Crystallographica Section C","1999","55","8","1328","1330","10.1107/S0108270199000876","","","0.71073","MoKα","","0.0665","0.0475","","","","0.1338","","","","","","1.068","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008795","9.019","0.003","17.061","0.004","9.458","0.004","90","","93.9","0.04","90","","1452","0.9","223","2","223","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C17 H40 Cl3 N O11 Pt S -","- C17 H40 Cl3 N O11 Pt S -","- C34 H80 Cl6 N2 O22 Pt2 S2 -","2","1","KA1320","Bruhn, Clemens; Gravenhorst, Olaf; Wagner, Christoph; Steinborn, Dirk","(<small>L</small>-2-Ammonio-4-methylsulfinylbutanoic acid-κ<i>S</i>)trichloroplatinum(II)‒18-crown-6‒water (1/1/2)","Acta Crystallographica Section C","1999","55","8","1255","1257","10.1107/S0108270199005132","","","0.71073","MoKα","","0.0369","0.0342","","0.0854","","0.0841","","","1.054","","","1.071","","","","has coordinates,has disorder","199607","2020-10-21","18:00:00",""
"2008796","9.4376","0.0007","13.168","0.002","10.035","0.002","90","","96.71","0.02","90","","1238.6","0.3","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","m-nitroglutethimide","3-(3'-nitrophenyl)-3-ethylpiperidine-2,6-dione","","- C13 H14 N2 O4 -","- C13 H14 N2 O4 -","- C52 H56 N8 O16 -","4","1","KA1321","Danilovski, Aleksandar; Vinković, Mladen; Filić, Darko","Nitro derivatives of glutethimide","Acta Crystallographica Section C","1999","55","8","1300","1304","10.1107/S0108270199005673","","","1.54178","CuKα","","0.0518","0.0388","","","","0.1114","","","","","","1.084","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008797","8.5629","0.0018","8.8741","0.0015","10.594","0.002","114.483","0.008","108.831","0.008","92.235","0.008","679.3","0.2","293","","293","","","","","","","","","4","P -1","-P 1","2","o,p-dinitroglutethimide","3-(2',4'-dinitrophenyl)-3-ethylpiperidine-2,6-dione","","- C13 H13 N3 O6 -","- C13 H13 N3 O6 -","- C26 H26 N6 O12 -","2","1","KA1321","Danilovski, Aleksandar; Vinković, Mladen; Filić, Darko","Nitro derivatives of glutethimide","Acta Crystallographica Section C","1999","55","8","1300","1304","10.1107/S0108270199005673","","","1.54178","CuKα","","0.0512","0.0392","","","","0.1141","","","","","","1.026","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008798","6.804","0.0008","10.0373","0.001","18.682","0.002","90","","90","","90","","1275.9","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","7-Deaza-2'-deoxyisoguanosine","","","- C11 H16 N4 O5 -","- C11 H16 N4 O5 -","- C44 H64 N16 O20 -","4","1","KA1322","Seela, Frank; Wei, Changfu; Reuter, Hans; Kastner, Guido","7-Deaza-2'-deoxyisoguanosine adopts the form of an N1—H,2-keto tautomer","Acta Crystallographica Section C","1999","55","8","1335","1337","10.1107/S0108270199005685","","","0.71073","MoKα","","0.0553","0.0423","","","","0.1024","","","","","","1.078","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008799","8.1754","0.0009","8.2776","0.0009","25.696","0.004","84.509","0.011","84.279","0.012","89.941","0.009","1722.3","0.4","152","2","152","2","","","","","","","","4","P -1","-P 1","2","","2-Aminobenzimidazolium Nitrate","","- C7 H8 N4 O3 -","- C7 H8 N4 O3 -","- C56 H64 N32 O24 -","8","4","KA1323","Bats, Jan W.; Gördes, Dirk; Schmalz, Hans-Günther","2-Aminobenzimidazolium nitrate at 152K, a triclinic crystal structure with pronounced local pseudo-symmetry","Acta Crystallographica Section C","1999","55","8","1325","1328","10.1107/S0108270199004710","","","0.71073","MoKα","","0.0571","0.0432","","","","0.1042","","","","","","1.675","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008800","9.0064","0.0014","10.8717","0.0011","17.585","0.002","90","","103.717","0.011","90","","1672.7","0.4","173","2","173","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C42 H34 O2 P2 Pt -","- C42 H34 O2 P2 Pt -","- C84 H68 O4 P4 Pt2 -","2","1","LN1077","Lesley, M.J. Gerald; Clegg, William; Marder, Todd B.; Norman, Nicholas C.; Orpen, A. Guy; Scott, Andrew J.; Starbuck, Jonathan","Three Pt^II^ catecholate and 1,2-dithiocatecholate complexes","Acta Crystallographica Section C","1999","55","8","1272","1275","10.1107/S0108270199005715","","","0.71073","MoKα","","0.0391","0.0348","","0.0806","0.0797","","","","0.97","1.023","1.023","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008801","9.0177","0.0007","10.9977","0.0008","17.9351","0.0012","90","","102.093","0.002","90","","1739.2","0.2","160","2","160","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C42 H34 P2 Pt S2 -","- C42 H34 P2 Pt S2 -","- C84 H68 P4 Pt2 S4 -","2","1","LN1077","Lesley, M.J. Gerald; Clegg, William; Marder, Todd B.; Norman, Nicholas C.; Orpen, A. Guy; Scott, Andrew J.; Starbuck, Jonathan","Three Pt^II^ catecholate and 1,2-dithiocatecholate complexes","Acta Crystallographica Section C","1999","55","8","1272","1275","10.1107/S0108270199005715","","","0.71073","MoKα","","0.0192","0.0184","","0.0465","0.0456","","","","1.124","1.113","1.113","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008802","10.338","0.002","16.142","0.003","26.162","0.004","90","","93.952","0.01","90","","4355.4","1.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C45 H77 O2 P2 Pt -","- C45 H77 O2 P2 Pt -","- C180 H308 O8 P8 Pt4 -","4","1","LN1077","Lesley, M.J. Gerald; Clegg, William; Marder, Todd B.; Norman, Nicholas C.; Orpen, A. Guy; Scott, Andrew J.; Starbuck, Jonathan","Three Pt^II^ catecholate and 1,2-dithiocatecholate complexes","Acta Crystallographica Section C","1999","55","8","1272","1275","10.1107/S0108270199005715","","","0.71073","MoKα","","0.1158","0.0558","","0.092","0.0767","","","","1.029","1.102","1.102","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008803","10.866","0.002","12.39","0.001","11.845","0.001","90","","101.2","0.01","90","","1564.3","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(E)-3-{[2-(dimethoxythiophosphoryl)- 2-methylhydrazino]methylidene}-3,4-dihydro-2H-1-benzopyran-2,4-dione","","- C13 H15 N2 O5 P S -","- C13 H15 N2 O5 P S -","- C52 H60 N8 O20 P4 S4 -","4","1","NA1410","Rybarczyk, Agnieszka J.; Olszak, Tomasz A.; Małecka, Magdalena; Nawrot-Modranka, Jolanta","X-ray investigations of benzopyran derivatives substituted at position 3","Acta Crystallographica Section C","1999","55","8","1313","1315","10.1107/S0108270199004734","","","0.71073","MoKα","","0.093","0.038","","","","0.11","","","","","","0.943","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008804","7.666","0.003","15.521","0.002","7.47","0.002","101.53","0.02","115.5","0.03","91.91","0.03","778.8","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","3-{[2-(dimethoxythiophosphoryl)- 2-methylhydrazino]carbonyl}-3,4-dihydro-2H-1-benzopyran-2,4-dione","","- C13 H15 N2 O5 P S -","- C13 H15 N2 O5 P S -","- C26 H30 N4 O10 P2 S2 -","2","1","NA1410","Rybarczyk, Agnieszka J.; Olszak, Tomasz A.; Małecka, Magdalena; Nawrot-Modranka, Jolanta","X-ray investigations of benzopyran derivatives substituted at position 3","Acta Crystallographica Section C","1999","55","8","1313","1315","10.1107/S0108270199004734","","","0.71073","MoKα","","0.045","0.035","","","","0.119","","","","","","1.085","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008805","8.9162","0.0001","9.6764","0.0001","20.0766","0.0001","78.536","0.001","81.52","0.001","83.922","0.001","1673.78","0.03","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","{4,4'-Dimethyl-6,6'-bis(morpholinomethyl)-2,2'-[1,3- propanediylbis(nitrilomethylidene)]diphenolato-O,N,N',O'}manganese(II) diperchlorate monohydrate","","- C28 H38 Cl2 Mn N4 O13 -","- C28 H38 Cl2 Mn N4 O13 -","- C56 H76 Cl4 Mn2 N8 O26 -","2","1","NA1412","R. Thirumurugan; S. Shanmuga Sundara Raj; G. Shanmugam; Hoong-Kun Fun; J. Manonmani; M. Kandaswamy","{4,4'-Dimethyl-6,6'-bis(morpholinomethyl)-2,2'-[1,3-propanediylbis(nitrilomethylidene)]diphenolato-<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}manganese(II) diperchlorate monohydrate","Acta Crystallographica Section C","1999","55","8","1218","1220","10.1107/S0108270199005016","","","0.71073","MoKα","","0.073","0.064","","","","0.207","","","","","","1.09","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008806","10.546","0.001","14.229","0.001","10.807","0.001","90","","99.75","0.01","90","","1598.3","0.2","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","N,N' - Bis[2-hydroxy-3-morpholinomethyl)-5-methyl]benzyl ethylenediamino copper(II) perchlorate. dihydrate","","- C28 H45 Cl Cu N4 O10 -","- C28 H45 Cl Cu N4 O10 -","- C56 H90 Cl2 Cu2 N8 O20 -","2","1","NA1413","Shanmuga Sundara Raj, S.; Velmurugan, D.; Gunasekaran, K.; Fun, Hoong-Kun; Manonmani, J.; Kandaswamy, M.","{4,4'-Dimethyl-6'-morpholiniomethyl-6-mor-pholinomethyl-2,2'[1,2-ethanediylbis(iminomethylene)]diphenolato}copper(II) perchlorate dihydrate","Acta Crystallographica Section C","1999","55","8","1222","1224","10.1107/S0108270199005776","","","0.71073","MoKα","","0.03","0.028","","","","0.074","","","","","","1.017","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008807","8.4551","0.0002","8.9044","0.0002","10.7293","0.0003","91.142","0.001","107.437","0.001","113.035","0.001","700.5","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-Benzoyl-N'-methyl-N'-phenyl thiourea","","- C15 H14 N2 O S -","- C15 H14 N2 O S -","- C30 H28 N4 O2 S2 -","2","1","NA1414","S. Shanmuga Sundara Raj; K. Puviarasan; D. Velmurugan; G. Jayanthi; Hoong-Kun Fun","N—H···S hydrogen bonding in <i>N</i>-benzoyl-<i>N</i>'-methyl-<i>N</i>'-phenylthiourea and <i>N</i>-benzoyl-<i>N</i>'-(3,4-dimethylphenyl)thiourea","Acta Crystallographica Section C","1999","55","8","1318","1320","10.1107/S0108270199005788","","","0.71073","MoKα","","0.069","0.041","","","","0.104","","","","","","0.925","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008808","5.4664","0.0001","28.0208","0.0004","9.8585","0.0001","90","","94.262","0.001","90","","1505.88","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-Benzoyl-N'-(3,4-dimethylphenyl)thiourea","","- C16 H16 N2 O S -","- C16 H16 N2 O S -","- C64 H64 N8 O4 S4 -","4","1","NA1414","S. Shanmuga Sundara Raj; K. Puviarasan; D. Velmurugan; G. Jayanthi; Hoong-Kun Fun","N—H···S hydrogen bonding in <i>N</i>-benzoyl-<i>N</i>'-methyl-<i>N</i>'-phenylthiourea and <i>N</i>-benzoyl-<i>N</i>'-(3,4-dimethylphenyl)thiourea","Acta Crystallographica Section C","1999","55","8","1318","1320","10.1107/S0108270199005788","","","0.71073","MoKα","","0.077","0.053","","","","0.165","","","","","","1.056","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008809","7.498","0.004","9.666","0.005","28.04","0.02","90","","90","","90","","2032","2","293","","","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","(S)-8-Chloro-4,5,6,7-tetrahydro-5-methyl-6-(3-methyl-2-butenyl)imidazo [4,5,1-jk][1,4]benzodiazepinium-2(1H)-thione Bromide Methanol Solvate","","- C17 H25 Br Cl N3 O S -","- C17 H25 Br Cl N3 O S -","- C68 H100 Br4 Cl4 N12 O4 S4 -","4","1","NA1419","Peeters, Oswald M.; Blaton, Norbert M.; De Ranter, Camiel J.","(<i>S</i>)-8-Chloro-5-methyl-6-(3-methylbut-2-enyl)-2-thioxo-1<i>H</i>-4,5,6,7-tetrahydroimidazo[4,5,1-<i>jk</i>][1,4]benzodiazepinium bromide methanol solvate","Acta Crystallographica Section C","1999","55","8","1322","1325","10.1107/S0108270199005892","","","0.71073","MoKα","","0.082","0.046","","0.108","","0.108","","","1.052","","","1.052","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008810","10.78","0.003","11.004","0.003","12.108","0.002","90","","90","","90","","1436.3","0.6","298.2","","298.2","","","","","","","","","6","P c a 21","P 2c -2ac","29","Tetrakis(methylamine)oxalatocobalt(III)","","","- C6 H20 Cl Co N4 O8 -","- C6 H20 Cl Co N4 O8 -","- C24 H80 Cl4 Co4 N16 O32 -","4","1","OA1068","Kitamura, Yoichi; Azuma, Nagao; Matsuda, Taro; Tanabe, Yoichi","Tetrakis(methylamine-<i>N</i>)(oxalato-<i>O</i>^1^,<i>O</i>^2^)cobalt(III) perchlorate and tetrakis(ethylamine-<i>N</i>)(oxalato-<i>O</i>^1^,<i>O</i>^2^)cobalt(III) perchlorate monohydrate","Acta Crystallographica Section C","1999","55","8","1267","1270","10.1107/S0108270199005594","","","0.7107","MoKα","","","0.064","","","","0.048","","","","","","1.287","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008811","10.128","0.003","13.538","0.003","14.994","0.003","90","","103.23","0.01","90","","2001.3","0.8","298.2","","298.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Tetrakis(ethylamine)oxalatocobalt(III)","","","- C10 H30 Cl Co N4 O9 -","- C10 H30 Cl Co N4 O9 -","- C40 H120 Cl4 Co4 N16 O36 -","4","1","OA1068","Kitamura, Yoichi; Azuma, Nagao; Matsuda, Taro; Tanabe, Yoichi","Tetrakis(methylamine-<i>N</i>)(oxalato-<i>O</i>^1^,<i>O</i>^2^)cobalt(III) perchlorate and tetrakis(ethylamine-<i>N</i>)(oxalato-<i>O</i>^1^,<i>O</i>^2^)cobalt(III) perchlorate monohydrate","Acta Crystallographica Section C","1999","55","8","1267","1270","10.1107/S0108270199005594","","","0.7107","MoKα","","","0.066","","","","0.045","","","","","","1.259","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008812","13.093","0.002","8.836","0.001","14.724","0.001","90","","92.913","0.008","90","","1701.2","0.3","296","5","296","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 N4 O3 S Zn -","- C14 H18 N4 O3 S Zn -","- C56 H72 N16 O12 S4 Zn4 -","4","1","OA1085","Noriko Chikaraishi Kasuga; Yayoi Hara; Chisa Koumo; Kiyoshi Sekino; Kenji Nomiya","Two novel zinc(II) complexes of <i>N</i>'-[1-(2-pyridyl)ethylidene]morpholine-4-carbothiohydrazide","Acta Crystallographica Section C","1999","55","8","1264","1267","10.1107/S0108270199004199","","","0.71069","MoKα","","0.067","0.036","","0.109","0.095","","","","1.029","1.075","1.075","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008813","9.5284","0.0015","10.829","0.002","8.863","0.003","91.94","0.03","94","0.02","101.698","0.013","892.3","0.4","293","3","293","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H16 N6 O7 S Zn -","- C12 H16 N6 O7 S Zn -","- C24 H32 N12 O14 S2 Zn2 -","2","1","OA1085","Noriko Chikaraishi Kasuga; Yayoi Hara; Chisa Koumo; Kiyoshi Sekino; Kenji Nomiya","Two novel zinc(II) complexes of <i>N</i>'-[1-(2-pyridyl)ethylidene]morpholine-4-carbothiohydrazide","Acta Crystallographica Section C","1999","55","8","1264","1267","10.1107/S0108270199004199","","","0.71069","MoKα","","0.119","0.04","","0.12","0.093","","","","0.959","1.023","1.023","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008814","25.493","0.0013","49.577","0.003","9.1095","0.0005","90","","90","","90","","11513.2","1.1","223","2","223","2","","","","","","","","8","F d d 2","F 2 -2d","43","","","","- C60 H58 Cl6 N2 Ni O2 P2 Pd2 -","- C60 H58 Cl6 N2 Ni O2 P2 Pd2 -","- C480 H464 Cl48 N16 Ni8 O16 P16 Pd16 -","8","0.5","OA1087","Kamiyama, Asako; Kajiwara, Takashi; Ito, Tasuku","A trinuclear Pd~2~Ni complex, [(C~6~H~5~)~4~ P]~2~[(PdCl~3~)~2~{Ni(C~12~H~18~N~2~O~2~)}]","Acta Crystallographica Section C","1999","55","8","1282","1284","10.1107/S0108270199005545","","","0.71073","MoKα","","0.021","0.019","","","","0.047","","","","","","0.959","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008815","12.565","0.002","10.784","0.001","14.512","0.001","90","","105.716","0.008","90","","1892.9","0.4","296.2","","296.2","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,11-dithia[3.3.1]paracyclophane","","","- C23 H22 S2 -","- C23 H22 S2 -","- C92 H88 S8 -","4","1","OB1006","Itoh, Kuniaki; Nishikawa, Kazuyoshi; Hashimoto, Masao; Yamada, Hiroaki","2,11-Dithia[3.3.1]paracyclophane, (I), and 2,11-dithia[3.3.2]paracyclophane, (II)","Acta Crystallographica Section C","1999","55","8","1357","1360","10.1107/S0108270199004503","","","0.7107","MoKα","","","0.0613","","","0.0535","","","","","1.341","1.341","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008816","14.345","0.003","7.585","0.003","19.248","0.002","90","","105.57","0.01","90","","2017.5","0.9","298.2","","298.2","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2,11-dithia[3.3.2]paracyclophane","","","- C24 H24 S2 -","- C24 H24 S2 -","- C96 H96 S8 -","4","1","OB1006","Itoh, Kuniaki; Nishikawa, Kazuyoshi; Hashimoto, Masao; Yamada, Hiroaki","2,11-Dithia[3.3.1]paracyclophane, (I), and 2,11-dithia[3.3.2]paracyclophane, (II)","Acta Crystallographica Section C","1999","55","8","1357","1360","10.1107/S0108270199004503","","","1.5418","CuKα","","","0.0421","","","0.0444","","","","","1.484","1.484","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008817","13.939","0.005","16.806","0.005","15.596","0.004","90","","107.11","0.02","90","","3491.8","1.9","298","","298","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Bis(tetrahydrofuran)(meso-tetraethylporphyrinato)iron(III) perchlorate","","- C36 H44 Cl Fe N4 O6 -","- C36 H44 Cl Fe N4 O6 -","- C144 H176 Cl4 Fe4 N16 O24 -","4","0.5","OB1008","Ohgo, Yoshiki; Saitoh, Takashi; Nakamura, Mikio","(<i>meso</i>-Tetraethylporphyrinato)bis(tetrahydrofuran)iron(III) perchlorate","Acta Crystallographica Section C","1999","55","8","1284","1286","10.1107/S0108270199005429","","","0.71069","MoKα","","0.117","0.054","","","","0.157","","","","","","1.05","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008818","7.8427","0.0012","10.2644","0.0013","16.961","0.002","90","","90","","90","","1365.4","0.3","122","2","122","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","5,7-diphenyl[1,2,4]triazolo[1,5-a]pyrimidine","","- C17 H12 N4 -","- C17 H12 N4 -","- C68 H48 N16 -","4","1","OS1048","Surdykowski, Andrzej; Szłyk, Edward; Larsen, Sine","5,7-Diphenyl[1,2,4]triazolo[1,5-<i>a</i>]pyrimidine at 122K","Acta Crystallographica Section C","1999","55","8","1337","1339","10.1107/S0108270199004631","","","1.54184","CuKα","","0.0315","0.0311","","","","0.0809","","","","","","1.02","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008819","8.217","0.002","16.7363","0.0011","12.029","0.004","90","","100.53","0.04","90","","1626.4","0.7","208","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-difluoro-chloro-tris(pyridine)-osmium-(III)","","- C15 H15 Cl F2 N3 Os -","- C15 H15 Cl F2 N3 Os -","- C60 H60 Cl4 F8 N12 Os4 -","4","1","OS1051","Kolf, Stephan; Preetz, Wilhelm","<i>trans</i>-Chlorodifluorotris(pyridine-<i>N</i>)osmium(III)","Acta Crystallographica Section C","1999","55","8","1216","1218","10.1107/S010827019900205X","","","0.71069","MoKα","","0.03","0.02","","","","0.059","","","","","","0.934","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008820","7.203","0.001","7.67","0.002","12.197","0.002","90","","99.1","0.03","90","","665.4","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H14 N2 O -","- C17 H14 N2 O -","- C34 H28 N4 O2 -","2","1","OS1054","Govindasamy, L.; Velmurugan, D.; Rajendran, T.M.","An N···H—O intramolecular strong hydrogen bond in <i>N</i>-(2-aminophenyl)naphthaldimine","Acta Crystallographica Section C","1999","55","8","1368","1369","10.1107/S0108270199004527","","","1.54178","CuKα","","0.0344","0.0318","","","","0.1067","","","","","","1.039","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008821","10.2215","0.0002","20.8692","0.0004","12.87","0.0001","90","","98.13","0.001","90","","2717.77","0.08","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H26 N2 O6 S -","- C30 H26 N2 O6 S -","- C120 H104 N8 O24 S4 -","4","1","OS1056","Govindasamy, L.; Velmurugan, D.; Shanmuga Sundara Raj, S.; Hoong-Kun Fun","Dimethyl α-(2-benzyl-1-methyl-4-phenylsulfonylpyrrolo[3,4-<i>b</i>]indol-3-yl)maleate","Acta Crystallographica Section C","1999","55","8","1315","1317","10.1107/S010827019900565X","","","0.71073","MoKα","","0.07","0.0487","","","","0.1756","","","","","","1.129","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008822","8.7236","0.0018","9.748","0.003","8.134","0.0019","98.28","0.02","109.745","0.016","100.48","0.02","624.2","0.3","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H19 N O2 -","- C15 H19 N O2 -","- C30 H38 N2 O4 -","2","1","OS1062","Stájer, Géza; Virág, Miklós; Sillanpää, Reijo","Two isomers of 1,4a,5,7,8,9,9a,10,11,12a-decahydro-1,4-methanocyclopenta[<i>b</i>]pyrrolo[1,6a-<i>a</i>][3,1]benzoxazin-11-one","Acta Crystallographica Section C","1999","55","8","1342","1344","10.1107/S0108270199005600","","","0.71069","MoKα","","0.077","0.0429","","","","0.1061","","","","","","1.036","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008823","18.5108","0.0018","6.644","0.004","21.2349","0.0015","90","","105.69","0.006","90","","2514.3","1.5","294","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H19 N O2 -","- C15 H19 N O2 -","- C120 H152 N8 O16 -","8","1","OS1062","Stájer, Géza; Virág, Miklós; Sillanpää, Reijo","Two isomers of 1,4a,5,7,8,9,9a,10,11,12a-decahydro-1,4-methanocyclopenta[<i>b</i>]pyrrolo[1,6a-<i>a</i>][3,1]benzoxazin-11-one","Acta Crystallographica Section C","1999","55","8","1342","1344","10.1107/S0108270199005600","","","0.71069","MoKα","","0.0785","0.0431","","","","0.1179","","","","","","1.026","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008824","5.3724","0.0004","5.3724","0.0004","11.7932","0.0016","90","","90","","90","","340.38","0.06","297","1","297","1","","","","","","","","3","I 41/a :2","-I 4ad","88","none","Silver Perrhenate","","- Ag O4 Re -","- Ag O4 Re -","- Ag4 O16 Re4 -","4","0.25","QA0115","Dmitry Yu. Naumov; Alexander V. Virovets; Sergey V. Korenev; Alexander I. Gubanov","Silver perrhenate, AgReO~4~","Acta Crystallographica Section C","1999","55","8","IUC9900097","","10.1107/S0108270199099138","","","0.71073","MoKα","","0.025","0.022","","","","0.049","","","","","","1.133","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008825","7.464","0.0016","7.85","0.0019","11.778","0.004","90","0.02","99.4","0.02","90","0.02","680.8","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","[2-Amino-4,6-dimethyl-1,3,5-triazine]","","- C5 H8 N4 -","- C5 H8 N4 -","- C20 H32 N16 -","4","1","QA0130","Becker, Michael; Jansen, Martin","2-Amino-4,6-dimethyl-1,3,5-triazine","Acta Crystallographica Section C","1999","55","8","IUC9900094","","10.1107/S0108270199099060","","","0.71079","MoKα","","0.074","0.064","","","","0.205","","","","","","1.113","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008826","22.478","0.004","9.718","0.002","8.734","0.002","90","","102.62","0.03","90","","1861.8","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis(N-ethyl-N-iso-propyldithiocarbamato)lead(II)","","- C12 H24 N2 Pb S4 -","- C12 H24 N2 Pb S4 -","- C48 H96 N8 Pb4 S16 -","4","0.5","QA0132","Ng, Seik Weng","Space-group revision for bis(<i>N</i>-ethyl-<i>N</i>-isopropyldithiocarbamato)lead(II)","Acta Crystallographica Section C","1999","55","8","IUC9900091","","10.1107/S0108270199099102","","","0.71073","MoKα","","0.053","0.032","","","","0.084","","","","","","1.069","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008827","11.904","0.004","12.042","0.002","15.436","0.004","90","","112.48","0.02","90","","2044.6","1","173","","173","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H32 Br2 Li2 N4 -","- C12 H32 Br2 Li2 N4 -","- C48 H128 Br8 Li8 N16 -","4","1","QA0138","Henderson, Kenneth W.; Kennedy, Alan R.; Kerr, William J.; Moran, Paul H.","Redetermination of di-μ-bromo-bis[(<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetramethylethylenediamine-<i>N</i>,<i>N</i>')lithium]","Acta Crystallographica Section C","1999","55","8","IUC9900078","","10.1107/S0108270199099096","","","0.71069","MoKα","","0.1066","0.0363","","0.0486","0.0403","","","","","1.228","1.228","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008828","11.473","0.001","7.28","0.001","12.546","0.001","90","0.001","91.02","0.001","90","0.001","1047.72","0.19","298","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 N4 -","- C11 H10 N4 -","- C44 H40 N16 -","4","1","QA0140","Achamlade, S.; El Hallaoui, A.; Hasnaoui, A.; Elachqar, A.; El Hajji, S.; Bellan, J.; Lopez, J.; Pierrot, M.","1-Propargyl-5-<i>p</i>-tolyl-1<i>H</i>-tetrazole and 2-propargyl-5-<i>p</i>-tolyl-1<i>H</i>-tetrazole","Acta Crystallographica Section C","1999","55","8","IUC9900081","","10.1107/S0108270199099059","","","0.71073","MoKα","","","0.05","","","","0.078","","","","","","1.072","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008829","6.8758","0.0004","13.7186","0.0007","22.187","0.001","90","0.01","94.666","0.003","90","0.01","2085.88","0.19","298","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 N4 -","- C11 H10 N4 -","- C88 H80 N32 -","8","2","QA0140","Achamlade, S.; El Hallaoui, A.; Hasnaoui, A.; Elachqar, A.; El Hajji, S.; Bellan, J.; Lopez, J.; Pierrot, M.","1-Propargyl-5-<i>p</i>-tolyl-1<i>H</i>-tetrazole and 2-propargyl-5-<i>p</i>-tolyl-1<i>H</i>-tetrazole","Acta Crystallographica Section C","1999","55","8","IUC9900081","","10.1107/S0108270199099059","","","0.71073","MoKα","","","0.047","","","","0.064","","","","","","1.235","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008830","5.758","0.001","5.758","0.001","24.498","0.001","90","","90","","120","","703.4","0.18","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","Dicalcium aluminium hydroxide bromide dihydrate","","- Al Br Ca2 H10 O8 -","- Al Br Ca2 H9.9996 O8 -","- Al3 Br3 Ca6 H29.9988 O24 -","3","0.166667","QA0141","Rapin, Jean-Philippe; Mohamed Noor, Norlidah; François, Michel","The double layered hydroxide 3CaO^.^Al~2~O~3~^.^CaBr~2~^.^10H~2~O","Acta Crystallographica Section C","1999","55","8","IUC9900092","","10.1107/S0108270199099126","","","0.56087","AgKα","","0.024","0.021","","","","0.075","","","","","","0.966","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008831","15.8643","0.0001","6.0887","0.0001","20.3014","0.0001","90","","104.227","0.001","90","","1900.83","0.04","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3,3'-bis-indolyl (4-methylphenyl) methane","","- C24 H20 N2 -","- C24 H20 N2 -","- C96 H80 N8 -","4","1","QA0142","R. Krishna; D. Velmurugan; S. Shanmuga Sundara Raj; Hoong-Kun Fun; G. Babu; P. T. Perumal","Bis(indol-3-yl)(4-methylphenyl)methane","Acta Crystallographica Section C","1999","55","8","IUC9900084","","10.1107/S0108270199099047","","","0.71073","MoKα","","0.105","0.066","","","","0.2","","","","","","1.081","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008832","9.0236","0.0001","14.373","0.0001","19.7887","0.0001","90","","92.899","0.001","90","","2563.23","0.04","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H22 I2 P2 Pt -","- C25 H22 I2 P2 Pt -","- C100 H88 I8 P8 Pt4 -","4","1","QA0143","Arendse, Malcolm J.; Anderson, Gordon K.; Rath, Nigam P.","Diiodo[methylenebis(diphenylphosphine)-<i>P</i>,<i>P</i>']platinum(II), [PtI~2~(dppm)]","Acta Crystallographica Section C","1999","55","8","IUC9900083","","10.1107/S0108270199099084","","","0.71073","MoKα","","0.044","0.028","","","","0.061","","","","","","1.039","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008833","13.77","0.003","9.491","0.002","8.205","0.002","90","","98.28","0.03","90","","1061.1","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","1,4-bis(4H-1,2,4-triazol-4-yl)benzene monohydrate","1,4-Phenylene-bis(1,3,4-triazole) monohydrate","","- C10 H10 N6 O -","- C10 H10 N6 O -","- C40 H40 N24 O4 -","4","0.5","QA0144","Cai, Hu; Hu, Huai-Ming; Chen, Wan-Zhi; Xu, Yan; You, Xiao-Zeng","1,4-Bis(4<i>H</i>-1,2,4-triazol-4-yl)benzene monohydrate","Acta Crystallographica Section C","1999","55","8","IUC9900082","","10.1107/S0108270199099035","","","0.71073","MoKα","","0.086","0.052","","0.135","","0.122","","","0.992","","","1.094","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008834","10.619","0.005","30.105","0.014","10.582","0.003","90","","90","","90","","3383","2","158","2","158","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C9 H9 N O3 -","- C9 H9 N O3 -","- C144 H144 N16 O48 -","16","1","QA0145","Kovalevsky, A. Yu.","Redetermination of <i>N</i>-acetylanthranilic acid at 158K","Acta Crystallographica Section C","1999","55","8","IUC9900093","","10.1107/S0108270199099023","","","0.71073","MoKα","","0.047","0.034","","0.198","","0.105","","","1.142","","","1.15","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008835","8.665","0.002","9.365","0.005","16.429","0.003","90","","99.84","0.01","90","","1313.6","0.8","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C15 H16 O3 -","- C15 H16 O3 -","- C60 H64 O12 -","4","1","QA0148","Thuéry, Pierre; Nierlich, Martine; Roux, Marie-Claude; Wartski, Lya","(3<i>S</i>,4<i>R</i>)-4-Benzoyl-3-(2-methyl-2-propenyl)tetrahydrofuran-2-one","Acta Crystallographica Section C","1999","55","8","IUC9900096","","10.1107/S0108270199099011","","","0.71073","MoKα","","0.084","0.047","","0.155","","0.123","","","1.072","","","1.175","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008836","10.5481","0.0005","8.9867","0.0004","18.5961","0.0009","90","","94.426","0.001","90","","1757.52","0.14","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1-methylhydroxy-(cyclopentadienyl (cyclopentadienyl)iron)-1,2-dicarba-closo-dodecaborane","","- C13 H22 B10 Fe O -","- C13.005 H22 B10 Fe O -","- C52.02 H88 B40 Fe4 O4 -","4","1","QB0085","Crundwell, Guy; Arellanes, Chuauthemoc; Gomez, Frank; Kantardjieff, Katherine","1-[Ferrocenyl(hydroxy)methyl]-1,2-dicarba-<i>closo</i>-dodecaborane","Acta Crystallographica Section C","1999","55","8","IUC9900087","","10.1107/S0108270199099072","","","0.71073","MoKα","","0.057","0.041","","","","0.093","","","","","","1.02","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008837","19.1266","0.0019","8.2451","0.0008","10.0462","0.001","90","","90","","90","","1584.3","0.3","173","2","173","2","","","","","","","","4","I b a 2","I 2 -2c","45","","d,l-2,4-bis(phenylthio)-3-pentanone","","- C17 H18 O S2 -","- C17 H18 O S2 -","- C68 H72 O4 S8 -","4","0.5","QB0086","Crundwell, Guy; Kessler, Jacqueline; Kaller, Matt; McCoy, Mike; Bayne, Christopher; Hardinger, Steven A.; Kantardjieff, Katherine","<i>dl</i>-2,4-Bis(phenylthio)pentan-3-one and <i>dl</i>-2,4-bis(2,6-dimethylphenylthio)pentan-3-one at 173K","Acta Crystallographica Section C","1999","55","8","IUC9900088","","10.1107/S010827019909900X","","","0.71073","MoKα","","0.097","0.058","","","","0.136","","","","","","0.948","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008838","8.351","0.0013","14.027","0.002","16.201","0.003","90","","90","0.003","90","","1897.8","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","d,l-2,4-bis(2',6'dimethylphenylthio)-3-pentanone","","- C21 H26 O S2 -","- C21 H26 O S2 -","- C84 H104 O4 S8 -","4","1","QB0086","Crundwell, Guy; Kessler, Jacqueline; Kaller, Matt; McCoy, Mike; Bayne, Christopher; Hardinger, Steven A.; Kantardjieff, Katherine","<i>dl</i>-2,4-Bis(phenylthio)pentan-3-one and <i>dl</i>-2,4-bis(2,6-dimethylphenylthio)pentan-3-one at 173K","Acta Crystallographica Section C","1999","55","8","IUC9900088","","10.1107/S010827019909900X","","","0.71073","MoKα","","0.078","0.048","","","","0.101","","","","","","1","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008839","13.6707","0.001","10.4841","0.001","13.9479","0.0012","90","","115.943","0.006","90","","1797.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(4-carboethoxy-2,6-dichlorophenylimino)-1-isobutyrylimidazolidine","","- C16 H19 Cl2 N3 O3 -","- C16 H19 Cl2 N3 O3 -","- C64 H76 Cl8 N12 O12 -","4","1","QB0092","E. M. Elssfah; K. Chinnakali; H.-K. Fun; I. W. Mathison; E. K. Gan; M. Zubaid; T. W. Sam; K. S. Khoo","Substituted clonidine derivatives. II. Ethyl 3,5-dichloro-4-(1-isobutyrylimidazolidin-2-ylideneamino)benzoate and ethyl 3,5-dichloro-4-(1,3-diisobutyrylimidazolidin-2-ylideneamino)benzoate","Acta Crystallographica Section C","1999","55","8","IUC9900085","","10.1107/S0108270199098996","","","0.71073","MoKα","","0.059","0.039","","","","0.11","","","","","","0.95","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008840","42.7786","0.0003","9.2896","0.0002","22.7485","0.0003","90","","104.407","0.001","90","","8755.9","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-(4-carboethoxy-2,6-dichlorophenylimino)-1,3-diisobutyrylimidazolidine","","- C20 H25 Cl2 N3 O4 -","- C20 H25 Cl2 N3 O4 -","- C320 H400 Cl32 N48 O64 -","16","2","QB0092","E. M. Elssfah; K. Chinnakali; H.-K. Fun; I. W. Mathison; E. K. Gan; M. Zubaid; T. W. Sam; K. S. Khoo","Substituted clonidine derivatives. II. Ethyl 3,5-dichloro-4-(1-isobutyrylimidazolidin-2-ylideneamino)benzoate and ethyl 3,5-dichloro-4-(1,3-diisobutyrylimidazolidin-2-ylideneamino)benzoate","Acta Crystallographica Section C","1999","55","8","IUC9900085","","10.1107/S0108270199098996","","","0.71073","MoKα","","0.199","0.083","","","","0.213","","","","","","1.04","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008841","13.73","0.0001","8.54","0.0001","19.741","0.0001","90","","96.363","0.001","90","","2300.46","0.03","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2-(4-hydroxymethyl-2,6-dichlorophenylimino)imidazolidine","","- C10 H11 Cl2 N3 O -","- C10 H11 Cl2 N3 O -","- C80 H88 Cl16 N24 O8 -","8","2","QB0093","E. M. Elssfah; K. Chinnakali; H.-K. Fun; I. W. Mathison; E. K. Gan; M. Zubaid; T. W. Sam; K. S. Khoo","Substituted clonidine derivatives. III. 3,5-Dichloro-4-(imidazolidin-2-ylideneamino)benzyl alcohol and 3,5-dichloro-4-(1,3-diisobutyrylimidazolidin-2-ylideneamino)benzyl isobutyrate","Acta Crystallographica Section C","1999","55","8","IUC9900086","","10.1107/S0108270199098984","","","0.71073","MoKα","","0.049","0.036","","0.094","0.085","","","","1.05","1.06","1.06","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008842","12.0244","0.0001","21.8128","0.0001","9.5663","0.0001","90","","101.403","0.001","90","","2459.58","0.04","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(4-isobutyryloxymethyl-2,6-dichlorophenylimino)-1,3-diisobutyrylimidazolidine","","- C22 H29 Cl2 N3 O4 -","- C22 H29 Cl2 N3 O4 -","- C88 H116 Cl8 N12 O16 -","4","1","QB0093","E. M. Elssfah; K. Chinnakali; H.-K. Fun; I. W. Mathison; E. K. Gan; M. Zubaid; T. W. Sam; K. S. Khoo","Substituted clonidine derivatives. III. 3,5-Dichloro-4-(imidazolidin-2-ylideneamino)benzyl alcohol and 3,5-dichloro-4-(1,3-diisobutyrylimidazolidin-2-ylideneamino)benzyl isobutyrate","Acta Crystallographica Section C","1999","55","8","IUC9900086","","10.1107/S0108270199098984","","","0.71073","MoKα","","0.126","0.075","","","","0.233","","","","","","0.97","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008843","8.301","0.002","9.287","0.002","6.791","0.002","98.67","0.02","100.73","0.02","70.49","0.02","482.6","0.2","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H34 O4 -","- C22 H34 O4 -","- C22 H34 O4 -","1","0.5","QB0097","Anthony R. J. Genge; Raymond J. Boffey; Jeremy D. Kilburn","(3<i>S</i>,3a<i>R</i>,6<i>S</i>,7a<i>R</i>)-3-{2-[(3<i>R</i>,3a<i>S</i>,6<i>R</i>,7a<i>S</i>)-6-Hydroxy-6-methyl-5-methyleneperhydrobenzo[<i>b</i>]furan-3-yl]ethyl}-6-methyl-5-methyleneperhydrobenzo[<i>b</i>]furan-6-ol","Acta Crystallographica Section C","1999","55","8","IUC9900089","","10.1107/S0108270199098972","","","0.71073","MoKα","","0.047","0.036","","","","0.105","","","","","","1.063","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008844","6.781","0.001","6.781","0.001","18.835","0.004","90","","90","","90","","866.1","0.3","293","2","293","2","","","","","","","","3","I -4 2 d","I -4 2bw","122","nickel arsenate","nickel arsenate","","- As3 Ni4.35 O12 -","- As3 Ni4.356 O12 -","- As12 Ni17.424 O48 -","4","0.25","QB0098","Jacques Barbier","Tetragonal Ni~4.35~As~3~O~11.7~(OH)~0.3~","Acta Crystallographica Section C","1999","55","8","IUC9900080","","10.1107/S0108270199099114","","","0.56086","AgKα","","0.041","0.029","","0.055","0.051","","","","0.896","0.954","0.954","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008845","7.844","0.003","7.035","0.003","17.696","0.007","90","","100.6","0.03","90","","959.8","0.7","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H24 N2 O4 S -","- C18 H24 N2 O4 S -","- C36 H48 N4 O8 S2 -","2","1","QB0102","Wei Zhu; Guishu Yang; Kaibai Yu","(<i>R</i>~S~)-(1<i>R</i>,2<i>S</i>,3<i>R</i>)-2-Methoxy-1,7,7-trimethyl-<i>N</i>-(4-nitrobenzylidene)bicyclo[2.2.1]heptane-3-sulfinamide","Acta Crystallographica Section C","1999","55","8","IUC9900090","","10.1107/S0108270199098960","","","0.71073","MoKα","","0.105","0.041","","","","0.088","","","","","","0.782","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008846","8.3947","0.0004","12.015","0.0005","12.8347","0.0006","90","","101.527","0.001","90","","1268.43","0.1","120","","120","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Kemp's acid","cis,cis-1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid","","- C12 H18 O6 -","- C12 H18 O6 -","- C48 H72 O24 -","4","1","QB0103","Alan Hazell; Hans Toftlund","Kemp's acid at 120K","Acta Crystallographica Section C","1999","55","8","IUC9900079","","10.1107/S0108270199098959","","","0.71073","MoKα","","","0.031","","","","0.04","","","","","","1.505","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008847","15.6977","0.0001","8.7328","0.0001","21.2064","0.0005","90","","90","","90","","2907.08","0.08","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C17 H15 N3 O2 -","- C17 H15 N3 O2 -","- C136 H120 N24 O16 -","8","1","QB0104","Xiao-Feng Chen; Xu-Hui Zhu; Jagadese J. Vittal; Xiao-Zeng You","5-[(2-Ethoxyphenyl)diazenyl]quinolin-8-ol","Acta Crystallographica Section C","1999","55","8","IUC9900095","","10.1107/S0108270199098947","","","0.71073","MoKα","","0.092","0.068","","","","0.136","","","","","","1.225","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008848","6.794","0.0005","6.794","0.0005","11.9557","0.0011","90","","90","","90","","551.86","0.08","293","2","293","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","Copper(II)-cyclopropane-1,1-carboxylate","Copper(II)-cyclopropane-1,1-carboxylate","","- C5 H4 Cu O4 -","- C5 H4 Cu O4 -","- C20 H16 Cu4 O16 -","4","0.5","SK1210","Petri, Alke; Schwarz, Thomas; Schilling, Joachim; Lentz, Axel","Polymeric (cyclopropane-1,1-dicarboxylato)copper(II)","Acta Crystallographica Section C","1999","55","8","1247","1248","10.1107/S0108270199005867","","","0.71073","MoKα","","0.0195","0.0184","","","","0.0477","","","","","","1.095","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2008849","10.293","0.002","11.909","0.002","10.252","0.002","90","","90","","90","","1256.7","0.4","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","tricαesium niobium tetraselenide","","- Cs3 Nb Se4 -","- Cs3 Nb Se4 -","- Cs12 Nb4 Se16 -","4","0.5","SK1211","Krause, Oliver; Näther, Christian; Bensch, Wolfgang","Cs~3~NbSe~4~","Acta Crystallographica Section C","1999","55","8","1197","1199","10.1107/S0108270199004941","","","0.71073","MoKα","","0.057","0.036","","","","0.095","","","","","","1.056","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008850","19.784","0.009","11.101","0.009","12.384","0.004","90","","106.59","0.02","90","","2607","3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","bis(N,N'-diphenylguanidinium) oxalate","","- C28 H28 N6 O4 -","- C28 H28 N6 O4 -","- C112 H112 N24 O16 -","4","0.5","SK1285","Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; Alte da Veiga, L.","Bis(<i>N</i>,<i>N</i>'-diphenylguanidinium) oxalate","Acta Crystallographica Section C","1999","55","8","1290","1292","10.1107/S010827019900493X","","","0.71073","MoKα","","0.087","0.035","","","","0.095","","","","","","1.017","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008851","29.277","0.002","8.9805","0.0008","9.8486","0.0006","90","","106.248","0.0001","90","","2486","0.3","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","6α,7β-dihydroxy-N-cyclohexyl-vouacapan-17β-amide","","- C26 H39 N O4 -","- C26 H39 N O4 -","- C104 H156 N4 O16 -","4","1","SX1054","Branco, Marcelo Cardoso; Gambardella, Maria Teresa do P.; Ruggiero, Silvana Guilardi; Maltha, Celia Regina A.; Stefani, Guglielmo Marconi; Pilo-Veloso, Dorila","<i>N</i>-Cyclohexyl-6α,7β-dihydroxyvouacapan-17β-carboxamide","Acta Crystallographica Section C","1999","55","8","1297","1299","10.1107/S0108270198017466","","","0.71073","MoKα","","0.074","0.047","","0.133","0.107","","","","1.145","1.059","1.059","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008852","7.935","0.007","8.656","0.003","9.389","0.003","90","","97.87","0.04","90","","638.8","0.6","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(1S,2S,5S,6S)-6-methyl-5,6-dihydroxycyclohexe-3-en-1,2-diyl diacetate","","- C11 H16 O6 -","- C11 H16 O6 -","- C22 H32 O12 -","2","1","SX1084","Silvia Russi; Leopoldo Suescun; Alvaro W. Mombrú; Helena Pardo; Raúl A. Mariezcurrena; Margarita Brovetto; Gustavo Seoane","(1<i>S</i>,2<i>S</i>,5<i>S</i>,6<i>S</i>)-5,6-Dihydroxy-6-methylcyclohex-3-en-1,2-diyl diacetate","Acta Crystallographica Section C","1999","55","8","1347","1349","10.1107/S0108270199004953","","","0.71069","MoKα","","0.06","0.047","","","","0.145","","","","","","1.041","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008853","9.556","0.003","11.007","0.003","12.713","0.004","111.67","0.02","107.02","0.02","99.25","0.02","1132.6","0.7","158","2","158","2","","","","","","","","4","P 1","P 1","1","","(1-D-1,2:5,6-di-O-isopropylidene-3-O-(diphenylphosphinoyl)-chiro-inositol","","- C24 H29 O7 P -","- C24 H29 O7 P -","- C48 H58 O14 P2 -","2","2","TA1226","Falshaw, Andrew; Gainsford, Graeme J.; Lensink, Cornelis","1-<small>D</small>-1,2:5,6-Di-<i>O</i>-isopropylidene-3-<i>O</i>-(diphenylphosphinoyl)-<i>chiro</i>-inositol, a hydrogen-bonded dimeric structure","Acta Crystallographica Section C","1999","55","8","1353","1355","10.1107/S0108270199006769","","","0.71073","MoKα","","0.097","0.068","","0.181","0.161","","","","0.998","1.044","1.044","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008854","7.927","0.003","6.159","0.002","22.47","0.01","90","","97.76","0.04","90","","1087","0.7","300","2","300","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis(1-methylimidazole-N^3^)bis(salicylato-O,O')copper(II)","","- C22 H22 Cu N4 O6 -","- C22 H22 Cu N4 O6 -","- C44 H44 Cu2 N8 O12 -","2","0.5","TA1230","Jian, Fangfang; Wang, Zuoxiang; Wei, Chen; Bai, Zhiping; You, Xiaozeng","Bis(1-methylimidazole-<i>N</i>^3^)bis(salicylato-<i>O</i>,<i>O</i>')copper(II)","Acta Crystallographica Section C","1999","55","8","1228","1230","10.1107/S0108270199002590","","","0.71073","MoKα","","0.055","0.041","","0.107","0.101","","","","1.054","1.143","1.143","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008855","13.731","0.0006","9.1357","0.0005","10.8227","0.0005","90","","98.852","0.004","90","","1341.45","0.11","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","N,N-bis(N-methylene-2-pyrrolidone)glycine","","- C12 H19 N3 O4 -","- C12 H19 N3 O4 -","- C48 H76 N12 O16 -","4","1","TA1237","Xiang-Jun Zheng; Zhe-Ming Wang; Yan-Qia Wang; Lin-Pei Jin; Jian-Quan Guo; Chun-Hua Yan","<i>N</i>,<i>N</i>-Bis(2-oxopyrrolidin-1-ylmethyl)glycine","Acta Crystallographica Section C","1999","55","8","1333","1335","10.1107/S0108270199005259","","","0.71073","MoKα","","0.0784","0.0445","","","","0.1193","","","","","","1.044","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008856","9.06","0.005","11.4157","0.0012","14.058","0.004","90","0.02","92.29","0.03","90","0.02","1452.8","0.9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Bis(hexamethylphosphoramide)tetrachlorodigallium(II)","","- C12 H36 Cl4 Ga2 N6 O2 P2 -","- C12 H36 Cl4 Ga2 N6 O2 P2 -","- C24 H72 Cl8 Ga4 N12 O4 P4 -","2","0.5","TA1238","Rickard, Clifton E. F.; Taylor, Michael J.; Kilner, Melvin","Tetrachlorobis(hexamethylphosphoramide-<i>O</i>)digallium(II)(<i>Ga</i>—<i>Ga</i>)","Acta Crystallographica Section C","1999","55","8","1215","1216","10.1107/S0108270199005843","","","0.71069","MoKα","","0.142","0.05","","","","0.117","","","","","","0.961","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008857","11.0912","0.0004","11.0912","0.0004","4.4414","0.0004","90","","90","","90","","546.36","0.06","293","2","293","2","","","","","","","","5","I -4","I -4","82","","Zinc Mercury Thiocyanate","","- C4 Hg N4 S4 Zn -","- C4 Hg N4 S4 Zn -","- C8 Hg2 N8 S8 Zn2 -","2","0.25","TA1243","Xu, Dong; Yu, Wen-Tao; Wang, Xin-Qiang; Yuan, Duo-Rong; Lu, Meng-Kai; Yang, Ping; Guo, Shi-Yi; Meng, Fan-Qing; Jiang, Min-Hua","Zinc mercury thiocyanate (ZMTC)","Acta Crystallographica Section C","1999","55","8","1203","1205","10.1107/S0108270199005983","","","0.71073","MoKα","","0.034","0.033","","","","0.095","","","","","","1.115","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008858","7.8637","0.0003","16.0133","0.0005","17.9513","0.0006","90","","101.358","0.001","90","","2216.23","0.13","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Aqua(urea)hydroxo[9-(1,8-diaza-fluoren-9-ylidene)amino-1,8- diazafluorenato]zinc(II) Urea Solvate.","","- C24 H23 N9 O4 Zn -","- C24 H23 N9 O4 Zn -","- C96 H92 N36 O16 Zn4 -","4","1","TA1244","Komen, Raymond P.; Miskelly, Gordon M.; Oliver, Allen; Rickard, Clifton E. F.","Aqua[9-(1,8-diazafluoren-9-ylidene)amino-1,8-diazafluorenato]hydroxo(urea)zinc(II) urea solvate","Acta Crystallographica Section C","1999","55","8","1213","1215","10.1107/S0108270199005995","","","0.71073","MoKα","","0.073","0.058","","","","0.168","","","","","","1.054","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008859","20.999","0.001","14.397","0.0005","12.648","0.004","90","","90","","90","","3823.8","1.2","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","","1-acetyltetrahydro-4-methyl-2,4-diphenyl-5H-1,5-benzodiazepine","","- C24 H24 N2 O -","- C24 H24 N2 O -","- C192 H192 N16 O8 -","8","2","VJ1098","Laavanya, P.; Panchanatheswaran, K.; Venkatraj, M.; Jeyaraman, R.; Marshall, W.","1-Acetyl-1,2,3,4-tetrahydro-4-methyl-2,4-diphenyl-5<i>H</i>-1,5-benzodiazepine","Acta Crystallographica Section C","1999","55","8","1355","1357","10.1107/S0108270199004722","","","0.71069","MoKα","","0.0565","0.0504","","","","0.1251","","","","","","1.222","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008860","9.45","0.002","11.581","0.001","17.544","0.001","90","","90","","90","","1920","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(2S,SR)-2-[1-(tert-Butoxycarbonyl)-pyrrolidinyl]-p-tolylsulfinylmethyl ketone","","- C18 H25 N O4 S -","- C18 H25 N O4 S -","- C72 H100 N4 O16 S4 -","4","1","BK1464","Rubén A.Toscano; Alejandra Carrasco; Benjamín Ortiz; Rubén Sánchez-Obregón; Fernando Walle; Francisco Yuste","(2<i>S</i>,S<i>R</i>)-<i>tert</i>-Butyl 2-(<i>p</i>-tolylsulfinylacetyl)pyrrolidine-1-carboxylate","Acta Crystallographica Section C","1999","55","9","1605","1607","10.1107/S0108270199006253","","","0.71073","MoKα","","0.0897","0.0517","","","","0.1353","","","","","","1.013","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008861","6.507","0.005","9.64","0.003","26.376","0.003","90","","91.51","0.03","90","","1653.9","1.4","170","1","170","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","(N-Maleoylmethioninate) trimethyl tin","(N-Maleoylmethioninate) trimethyl tin","","- C12 H19 N O4 S Sn -","- C12 H19 N O4 S Sn -","- C48 H76 N4 O16 S4 Sn4 -","4","1","BK1466","Parvez, Masood; Ali, Saqib; Mazhar, Muhammad; Bhatti, M. Hussain; Choudhary, M. Aziz","(<i>N</i>-Maleoylmethioninato)trimethyltin(IV)","Acta Crystallographica Section C","1999","55","9","1429","1431","10.1107/S0108270199007180","","","0.71069","MoKα","","0.091","0.059","","","","0.159","","","","","","1.224","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008862","7.726","0.002","9.818","0.002","13.169","0.002","99","0.01","106.57","0.02","91.54","0.02","942.9","0.4","296","","296","","","","","","","","","4","P -1","-P 1","2","di[1-dimethylamino-8-dimethylammonionaphthalene][naphthalene-1,5-dicarboxylic acid-4,8-dicarboxylate] dihydrate","","","- C21 H24 N2 O5 -","- C42 H48 N4 O10 -","- C42 H48 N4 O10 -","1","0.5","BK1470","Fitzgerald, Lawrence J.; Gerkin, Roger E.","Hydrogen bonding and C—H···O interactions in bis(8-dimethylamino-1-dimethylammonionaphthalene) [(DMANH^+^)~2~] 4,8-dicarboxynaphthalene-1,5-dicarboxylate dihydrate","Acta Crystallographica Section C","1999","55","9","1556","1559","10.1107/S0108270199006289","","","0.71073","MoKα","","","0.038","","","","0.067","","","","","","1.86","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008863","9.3101","0.0008","12.484","0.0011","14.7622","0.0014","89.988","0.002","89.819","0.002","73.151","0.002","1642.1","0.3","143","2","143","2","","","","","","","","4","P -1","-P 1","2","4-(Triphenylmethyl)phenol-Triphenylphosphine Oxide(1/1)","1:1 Complex of 4-(Triphenylmethyl)phenol and Triphenylphosphine Oxide","","- C43 H35 O2 P -","- C43 H35 O2 P -","- C86 H70 O4 P2 -","2","1","BK1472","Ram K. R. Jetti; Weiss, Hans-Christoph; Venkat R. Thalladi; Boese, Roland; Ashwini Nangia; Gautam R. Desiraju","4-(Triphenylmethyl)phenol–triphenylphosphine oxide (1/1)","Acta Crystallographica Section C","1999","55","9","1530","1533","10.1107/S0108270199006290","","","0.71073","MoKα","","0.091","0.064","","","","0.167","","","","","","1.086","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008864","9.435","0.006","12.605","0.004","9.481","0.005","90","","99.82","0.05","90","","1111","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","[Tetra(mu-cyano)-tris(ammonium)-dicuprate(I)-cupper(II)]~\ιnfty~","","- C4 H9 Cu3 N7 -","- C4 H9 Cu3 N7 -","- C16 H36 Cu12 N28 -","4","1","BM1284","Viktor Vrábel; Ján Garaj; Július Sivý; Drahomír Oktavec","Polymeric triamminetetrakis(μ-cyano)dicuprate(I)copper(II)","Acta Crystallographica Section C","1999","55","9","1381","1383","10.1107/S0108270199007477","","","0.71069","MoKα","","0.111","0.048","","0.096","0.085","","","","0.905","1.144","1.144","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008865","10.182","0.004","9.707","0.005","23.455","0.008","90","","101.48","0.03","90","","2271.8","1.7","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","di-μ-methacrylato-O:O'-bis[(1,10-phenanthroline-N,N')bis(methacrylato-O,O') ytterbium(III)]","","- C48 H46 N4 O12 Yb2 -","- C48 H46 N4 O12 Yb2 -","- C96 H92 N8 O24 Yb4 -","2","0.5","BM1303","Lu, Weimin; Luo, Xiaoyang; Wu, Bin; Jianxin Mao; Jiang, Xiaoyuan","A dihomonuclear complex: di-μ-methacrylato-<i>O</i>:<i>O</i>'-bis[(1,10-phenanthroline-<i>N</i>,<i>N</i>')bis(methacrylato-<i>O</i>,<i>O</i>')ytterbium(III)]","Acta Crystallographica Section C","1999","55","9","1472","1475","10.1107/S0108270199006915","","","0.71069","MoKα","","","0.034","","","","0.043","","","","","","1.54","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008866","23.727","0.003","5.837","0.0005","14.377","0.002","90","","98.337","0.01","90","","1970.1","0.4","293","1","293","1","","","","","","","","5","A 1 2/a 1","-A 2ya","15","","Bis[μ-{bis(ethanethiolato)-S,N,μ-S'-(ethanethiol)}amine]dinickel(II)","","- C12 H26 N2 Ni2 S6 -","- C12 H26 N2 Ni2 S6 -","- C48 H104 N8 Ni8 S24 -","4","0.5","BM1327","Davies, Sian C.; Evans, David J.; Hughes, David L.; Longhurst, Steven","Bis[μ-2,2',2''-nitrilotriethanethiolato(2 ‒)-<i>N</i>,<i>S</i>,<i>S</i>':<i>S</i>']dinickel(II)","Acta Crystallographica Section C","1999","55","9","1436","1438","10.1107/S010827019900760X","","","0.71069","MoKα","","0.104","0.044","","","","0.097","","","","","","0.963","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008867","7.847","0.003","8.594","0.003","9.867","0.003","115.612","0.014","98.079","0.015","104.033","0.016","558.8","0.4","143","2","143","2","","","","","","","","5","P -1","-P 1","2","","1,4,7,10-Tetraoxacyclododecane–acetone thiosemicarbazone (1/2)","","- C16 H34 N6 O4 S2 -","- C16 H34 N6 O4 S2 -","- C16 H34 N6 O4 S2 -","1","0.5","BM1332","Moers, Oliver; Wijaya, Karna; Jones, Peter G.; Blaschette, Armand","1,4,7,10-Tetraoxacyclododecane–acetone thiosemicarbazone (1/2)","Acta Crystallographica Section C","1999","55","9","1542","1545","10.1107/S0108270199006381","","","0.71073","MoKα","","0.041","0.036","","","","0.093","","","","","","1.059","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008868","8.9427","0.0012","9.419","0.0013","11.9415","0.0012","95.977","0.002","106.464","0.003","107.763","0.002","898.4","0.2","295","","","","","","","","","","","7","P -1","-P 1","2","","","","- C17 H16 Cl2 Cu Hg N2 O2 -","- C17 H16 Cl2 Cu Hg N2 O2 -","- C34 H32 Cl4 Cu2 Hg2 N4 O4 -","2","1","BM1333","Atakol, Orhan; Arıcı, Cengiz; Tahir, M. Nawaz; Kenar, Adnan; Ülkü, Dinçer","{[μ-<i>N</i>,<i>N</i>'-Bis(salicylidene)-1,3-propanediaminato]-copper(II)}dichloromercury(II)","Acta Crystallographica Section C","1999","55","9","1416","1418","10.1107/S0108270199007076","","","0.71073","MoKα","","","0.019","","","","0.025","","","","","","0.94","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008869","5.152","0.0005","10.472","0.0011","6.3709","0.0007","90","","105.659","0.002","90","","330.96","0.06","163","2","163","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","2,2'-Bi-2-imidazoline","","- C6 H10 N4 -","- C6 H10 N4 -","- C12 H20 N8 -","2","0.5","BM1338","Brennan, Conor J.; McKee, Vickie","2,2'-Bi-2-imidazoline","Acta Crystallographica Section C","1999","55","9","1492","1494","10.1107/S010827019900654X","","","0.71073","MoKα","","0.0399","0.037","","","","0.0979","","","","","","1.082","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008870","22.3117","0.0014","8.2925","0.0006","16.1711","0.0018","90","","122.532","0.006","90","","2522.5","0.4","153","2","153","2","","","","","","","","4","C 1 c 1","C -2yc","9","","1,4,7,10,13,16,21,24-Octaazabicyclo[8.8.8]hexacosa-4,6,13,15,21,23-hexaene pentahydrate","","- C18 H40 N8 O5 -","- C18 H40 N8 O5 -","- C72 H160 N32 O20 -","4","1","BM1339","McKee, Vickie; Nelson, Jane","1,4,7,10,13,16,21,24-Octaazabicyclo[8.8.8]hexacosa-4,6,13,15,21,23-hexaene pentahydrate","Acta Crystallographica Section C","1999","55","9","1494","1496","10.1107/S010827019900671X","","","0.71073","MoKα","","0.036","0.029","","","","0.068","","","","","","1.052","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008871","15.8043","0.0016","12.8885","0.0012","11.4501","0.0011","90","","132.195","0.002","90","","1727.9","0.3","180","2","180","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","N^1^,N^2^ - Di(phenyl)benzamidine nitrate","","","- C19 H17 N3 O3 -","- C19 H17 N3 O3 -","- C76 H68 N12 O12 -","4","0.5","BM1345","Barker, James; Errington, William; Wallbridge, Malcolm G. H.","<i>N</i>,<i>N</i>'-Diphenylbenzamidinium nitrate","Acta Crystallographica Section C","1999","55","9","1583","1585","10.1107/S0108270199007672","","","0.71073","MoKα","","0.0723","0.0457","","","","0.1188","","","","","","1.002","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008872","14.045","0.003","12.932","0.003","17.099","0.003","90","","101.08","0.03","90","","3047.8","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","ammonium magnesium paradodecatungstate dodehydrate","","- H66 Mg4 N2 O70 W12 -","- Mg4 N2 O70 W12 -","- Mg8 N4 O140 W24 -","2","0.5","BR1227","Li, Jing; Wang, Ru-Ji; Torardi, Charlie C.","(NH~4~)~2~[Mg~4~(H~2~O)~18~(H~2~W~12~O~42~)]^.^10H~2~O, a new compound containing chains formed by magnesium and paradodecahedral tungstate ions","Acta Crystallographica Section C","1999","55","9","1388","1391","10.1107/S0108270199006265","","","0.71073","MoKα","","0.1255","0.0716","","","","0.1125","","","","","","1.165","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008873","5.6665","0.0002","5.6665","0.0002","34.2196","0.0017","90","","90","","120","","951.56","0.07","293","","293","","","","","","","","","5","R -3 m :H","-R 3 2""","166","K^+^ /b""-aluminogallate","","","- Al8.58 Ga1.75 K1.67 Mg0.67 O17 -","- Al8.58105 Ga1.75235 K1.68 Mg0.2222 O17 -","- Al25.7432 Ga5.25705 K5.04 Mg0.6666 O51 -","3","0.0833333","BR1232","Edström, Kristina","Potassium β''-aluminogallate","Acta Crystallographica Section C","1999","55","9","1384","1388","10.1107/S0108270199007799","","","0.71073","MoKα","","0.036","0.018","","0.062","","0.062","","","1.81","","","1.81","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008874","10.221","0.003","9.275","0.003","7.024","0.002","90","","106.87","0.02","90","","637.2","0.3","299","2","299","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Co0.7 Fe0.3 Mo O4 -","- Co0.695 Fe0.305 Mo O4 -","- Co5.56 Fe2.44 Mo8 O32 -","8","1","BR1241","Ehrenberg, Helmut; Svoboda, Ingrid; Wiesmann, Marc; Weitzel, Hans","A mixed transition metal molybdate, β-(Co~0.7~Fe~0.3~)MoO~4~","Acta Crystallographica Section C","1999","55","9","1383","1384","10.1107/S0108270199007805","","","0.71093","MoKα","","0.062","0.037","","0.095","0.087","","","","1.135","1.205","1.205","","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2008875","10.422","0.006","10.422","0.006","101.433","0.007","90","","90","","120","","9541","8","298.2","","298.2","","","","","","","","","7","P 65 2 2","P 65 2 (0 0 1)","179","","[Co{α-Me‒sal~2~‒(S,S)‒bn}(py)~2~}]BF~4~, 1.5-water","","- C30 H35 B Co F4 N4 O3.5 -","- C30 H34.49 B Co F4 N4 O3.245 -","- C360 H413.88 B12 Co12 F48 N48 O38.94 -","12","1","CF1272","Shoichi Sato; Takashi Fukuda; Kazuaki Ishii; Yoshiharu Nakano; Yuki Fujii","Polymorphs of [(2<i>S</i>,3<i>S</i>)-α-Me-<i>N</i>,<i>N</i>'-bis(salicylidene)butane-2,3-diaminato]bis(pyridine)cobalt(III) tetrafluoroborate hydrate","Acta Crystallographica Section C","1999","55","9","1466","1470","10.1107/S0108270199006812","","","1.5418","CuKα","","","0.0541","","","","0.0585","","","","","","1.892","","","","has coordinates","189124","2020-10-21","18:00:00",""
"2008876","10.305","0.002","18.047","0.003","50.764","0.002","90","","92.463","0.009","90","","9432","2","298.2","","","","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C30 H35.4 B Co F4 N4 O3.7 -","- C30 H32 B Co F3.91667 N4 O3.48333 -","- C360 H384 B12 Co12 F47 N48 O41.8 -","12","3","CF1272","Shoichi Sato; Takashi Fukuda; Kazuaki Ishii; Yoshiharu Nakano; Yuki Fujii","Polymorphs of [(2<i>S</i>,3<i>S</i>)-α-Me-<i>N</i>,<i>N</i>'-bis(salicylidene)butane-2,3-diaminato]bis(pyridine)cobalt(III) tetrafluoroborate hydrate","Acta Crystallographica Section C","1999","55","9","1466","1470","10.1107/S0108270199006812","","","0.7107","MoKα","","","0.0561","","","","0.0686","","","","","","2.99","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008877","11.135","0.002","11.135","0.002","4.376","0.001","90","","90","","90","","542.57","0.19","293","2","293","2","","","","","","","","5","I -4","I -4","82","","","","- C4 Cd N4 S4 Zn -","- C4 Cd N4 S4 Zn -","- C8 Cd2 N8 S8 Zn2 -","2","0.25","CF1297","Tian, Yu-Peng; Yu, Wen-Tao; Fang, Qi; Wang, Xin-Qiang; Yuan, Duo-Rong; Xu, Dong; Jiang, Min-Hua","Zinc cadmium thiocyanate (ZCTC)","Acta Crystallographica Section C","1999","55","9","1393","1395","10.1107/S0108270199007623","","","0.71073","MoKα","","0.029","0.028","","0.094","0.093","","","","1.264","1.275","1.275","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008878","6.231","0.003","7.935","0.004","11.667","0.006","90","","92.09","0.03","90","","576.5","0.5","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","N-hydroxypyridine-2-thione","1-Hydroxypyridine-2(1H)-thione","","- C5 H5 N O S -","- C5 H5 N O S -","- C20 H20 N4 O4 S4 -","4","1","CF1307","Bond, Andrew; Jones, William","1-Hydroxy-2(1<i>H</i>)-pyridinethione","Acta Crystallographica Section C","1999","55","9","1536","1538","10.1107/S0108270199006824","","","0.71073","MoKα","","0.0594","0.0311","","","","0.0856","","","","","","1.016","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008879","29.7207","0.0013","7.7934","0.0003","17.2154","0.0007","90","","102.392","0.001","90","","3894.6","0.3","188","2","188","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C14 H34 Cl2 N4 O2 Pd -","- C14 H34 Cl2 N4 O2 Pd -","- C112 H272 Cl16 N32 O16 Pd8 -","8","1","CF1310","Hubin, Timothy J.; Alcock, Nathaniel W.; Busch, Daryle H.","The square-pyramidal Pd^II^ complex of a cross-bridged tetraazamacrocycle","Acta Crystallographica Section C","1999","55","9","1404","1406","10.1107/S0108270199007817","","","0.71073","MoKα","","0.066","0.0382","","0.0888","","0.0819","","","0.945","","","1.058","","","","has coordinates,has Fobs","199607","2020-10-21","18:00:00",""
"2008880","25.3","0.005","7.366","0.002","14.609","0.003","90","","113.62","0.03","90","","2494.4","1.1","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-Hydroxy-1-oxo-2H-phthalazine-6,7-dicarboxylate bis-hydrazinium","","- C10 H14 N6 O6 -","- C10 H14 N6 O6 -","- C80 H112 N48 O48 -","8","1","CF1312","Benniston, Andrew C.; Yufit, D. S.; Howard, Judith A. K.","Bis(hydrazinium) 4-hydroxy-1-oxo-2<i>H</i>-phthalazine-6,7-dicarboxylate","Acta Crystallographica Section C","1999","55","9","1535","1536","10.1107/S0108270199007635","","","0.71073","MoKα","","0.077","0.044","","","","0.107","","","","","","1.035","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008881","13.332","0.001","6.0756","0.0005","8.3258","0.0006","90","","90","","90","","674.39","0.09","298","","298","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- H Na O7 Se2 Zn2 -","- H Na O7 Se2 Zn2 -","- H4 Na4 O28 Se8 Zn8 -","4","0.5","CF1315","Harrison, William T. A.; Phillips, Mark L. F.","Sodium zinc hydroxide selenite, NaZn~2~(OH)(SeO~3~)~2~","Acta Crystallographica Section C","1999","55","9","1398","1399","10.1107/S010827019900637X","","","0.71073","MoKα","","","0.029","","","","0.032","","","","","","1.09","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008882","12.1621","0.0009","14.7472","0.0009","20.8082","0.0009","90","","103.451","0.002","90","","3629.7","0.4","180","2","180","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","iodo(6-chloropyridin-2-yl)bis(triphenylphosphine)palladium(II)","","","- C41 H33 Cl I N P2 Pd -","- C41 H33 Cl I N P2 Pd -","- C164 H132 Cl4 I4 N4 P8 Pd4 -","4","1","CF1319","Cave, Gareth W. V.; Errington, William; Rourke, Jonathan P.","(6-Chloropyridin-2-yl)iodobis(triphenylphosphine)palladium(II)","Acta Crystallographica Section C","1999","55","9","1461","1463","10.1107/S0108270199007866","","","0.71073","MoKα","","0.098","0.053","","","","0.139","","","","","","1.001","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008883","8.9031","0.0004","15.7897","0.0006","20.0697","0.0007","90","","99.569","0.004","90","","2782.09","0.19","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Di(1-hydro-1,10-Phenanthrolinium) iodinium-dichlorido diiodine-chloride","","- C24 H18 Cl3 I3 N4 -","- C24 H18 Cl3 I3 N4 -","- C96 H72 Cl12 I12 N16 -","4","1","DA1070","Wang, Yan-Qia; Wang, Zhe-Ming; Liao, Chun-Sheng; Yan, Chun-Hua","Bis(1,10-phenanthrolin-1-ium) chlorodiiodide(1 –) dichloroiodide(1 –)","Acta Crystallographica Section C","1999","55","9","1503","1506","10.1107/S0108270199007684","","","0.71073","MoKα","","0.0509","0.0332","","","","0.0745","","","","","","1.084","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008884","22.8378","0.0014","12.0426","0.0005","9.5835","0.0004","90","","107.358","0.004","90","","2515.7","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","catena-tris(m-cyanobenzoxylate erbium) dihydrate","","- C24 H15 Er N3 O8 -","- C24 H15 Er N3 O8 -","- C96 H60 Er4 N12 O32 -","4","0.5","DA1072","Ma, Bao-Qing; Gao, Song; Wang, Zhe-Ming; Yi, Tao; Yan, Chun-Hua; Xu, Guang-Xian","<i>catena</i>-Poly[[diaqua(3-cyanobenzoato-<i>O</i>,<i>O</i>')erbium]-bis-μ-(3-cyanobenzoato-<i>O</i>:<i>O</i>')]","Acta Crystallographica Section C","1999","55","9","1420","1422","10.1107/S0108270199007696","","","0.71073","MoKα","","0.027","0.02","","","","0.047","","","","","","1.078","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008885","10.82","0.02","9.98","0.02","43.13","0.07","90","","90","","90","","4657","15","100","","","","","","","","","","","6","P 21 c a","P -2ac 21","","D-BCCD","Deuterated Betaine Calcium Chloride Dihydrate","","- C5 Ca Cl2 D15 N O4 -","- C5 Ca Cl2 D15 N O4 -","- C80 Ca16 Cl32 D240 N16 O64 -","16","4","FG1472","Hernandez, Olivier; Kiat, Jean-Michel; Cousson, Alain; Paulus, Werner; Ezpeleta, Jose Maria; Zuniga, Francisco Javier","Commensurately modulated 1/4 and 1/5 phases of deuterated betaine calcium chloride dihydrate: a neutron structural study","Acta Crystallographica Section C","1999","55","9","1463","1466","10.1107/S0108270198017508","","neutron","1.528","Neutron","","","0.084","","","0.088","","","","","1.16","1.16","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008886","10.82","0.03","9.98","0.02","53.93","0.02","90","","90","","90","","5824","2","68","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","D-BCCD","Deuterated Betaine Calcium Chloride Dihydrate","","- C5 Ca Cl2 D15 N O4 -","- C5 Ca Cl2 D15 N O4 -","- C100 Ca20 Cl40 D300 N20 O80 -","20","5","FG1472","Hernandez, Olivier; Kiat, Jean-Michel; Cousson, Alain; Paulus, Werner; Ezpeleta, Jose Maria; Zuniga, Francisco Javier","Commensurately modulated 1/4 and 1/5 phases of deuterated betaine calcium chloride dihydrate: a neutron structural study","Acta Crystallographica Section C","1999","55","9","1463","1466","10.1107/S0108270198017508","","neutron","1.528","Neutron","","","0.123","","","0.154","","","","","1.03","1.03","","","","","has coordinates","189897","2020-10-21","18:00:00",""
"2008887","14.485","0.002","10.804","0.002","19.567","0.003","90","","103.28","0.01","90","","2980.3","0.8","290","2","17","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Bis–(2,2'–bipyridine)–bis–μ-maleato–diaqua–dizinc Dihydrate","","- C28 H28 N4 O12 Zn2 -","- C28 H28 N4 O12 Zn2 -","- C112 H112 N16 O48 Zn8 -","4","0.5","FG1534","Zhang, Cungen; Yu, Kaibei; Wu, Dan; Zhao, Chengxue","A maleate-bridged dinuclear bipyridine-containing zinc(II) complex","Acta Crystallographica Section C","1999","55","9","1470","1472","10.1107/S0108270199006848","","","0.71073","MoKα","","0.0343","0.0245","","0.0613","","0.0586","","","0.972","","","1.057","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008888","10.2264","0.0002","10.3606","0.0001","18.0965","0.0003","87.36","0.001","81.604","0.001","74.839","0.001","1830.72","0.05","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","cis-Bis(cyanomethyl)bis(triphenylphosphine)platinum(II) 0.6 dichloromethane solvate","","- C40.5 H35 Cl N2 P2 Pt -","- C40 H34 N2 P2 Pt -","- C80 H68 N4 P4 Pt2 -","2","1","FG1536","Henderson, William; Oliver, Allen G.","<i>cis</i>-Bis(cyanomethyl)bis(triphenylphosphine)platinum(II)‒dichloromethane (1/0.6)","Acta Crystallographica Section C","1999","55","9","1406","1408","10.1107/S0108270199007490","","","0.71073","MoKα","","0.062","0.047","","","","0.113","","","","","","0.968","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008889","8.866","","12.9431","0.0002","13.9107","0.0002","103.112","0.001","102.296","0.001","93.03","","1510.41","0.03","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","N,N'–bis–(2–tosylaminobenzylidene)–1,3–propanediamine","","- C31 H32 N4 O4 S2 -","- C31 H32 N4 O4 S2 -","- C62 H64 N8 O8 S4 -","2","1","FG1538","Mahía, José; Maestro, Miguel A.; Vázquez, Miguel; Bermejo, Manuel R.; Sanmartín, Jesús; Maneiro, Marcelino","<i>N</i>,<i>N</i>'-Bis(2-tosylaminobenzylidene)-1,3-propanediamine","Acta Crystallographica Section C","1999","55","9","1545","1547","10.1107/S010827019900685X","","","0.71073","MoKα","","0.0756","0.0493","","0.1535","0.1341","","","","1.017","1.088","1.088","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008890","7.363","0.001","11.299","0.001","23.502","0.003","90","","90","","90","","1955.2","0.4","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(+)-ketopinic acid","(+)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxylic acid","","- C10 H14 O3 -","- C10 H14 O3 -","- C80 H112 O24 -","8","2","FG1548","Lalancette, Roger A.; Coté, Marie L.; Smith III, William J.; Thompson, Hugh W.; Vanderhoff, Peggy A.; Brunskill, Andrew P. J.; Campana, Charles; Burshtein, Izya; Rose, John P.; (+)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxylic acid","(+)- and (±)-ketopinic acid: hydrogen-bonding patterns in a β-keto acid in its enantiomeric and racemic forms and enantiomeric disordering in the racemate","Acta Crystallographica Section C","1999","55","9","1600","1605","10.1107/S0108270199007428","","","0.71073","MoKα","","0.116","0.06","","","","0.13","","","","","","1.04","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008891","7.0947","0.0003","11.8316","0.0006","12.1662","0.0006","72.013","0.001","77.019","0.001","86.546","0.001","946.47","0.08","123","2","123","2","","","","","","","","3","P -1","-P 1","2","(+/-)-ketopinic acid","(+/-)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-carboxylic acid","","- C10 H14 O3 -","- C10 H14 O3 -","- C40 H56 O12 -","4","2","FG1548","Lalancette, Roger A.; Coté, Marie L.; Smith III, William J.; Thompson, Hugh W.; Vanderhoff, Peggy A.; Brunskill, Andrew P. J.; Campana, Charles; Burshtein, Izya; Rose, John P.","(+)- and (±)-ketopinic acid: hydrogen-bonding patterns in a β-keto acid in its enantiomeric and racemic forms and enantiomeric disordering in the racemate","Acta Crystallographica Section C","1999","55","9","1600","1605","10.1107/S0108270199007428","","","0.71073","MoKα","","0.056","0.05","","","","0.137","","","","","","1.07","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008892","9.443","0.002","20.758","0.004","23.478","0.005","90","","90","","90","","4602.1","1.6","162","2","162","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Bis(dicyclohexylammonium) (nitrilotriacetato)tributylstannate","","- C42 H81 N3 O6 Sn -","- C42 H81 N3 O6 Sn -","- C168 H324 N12 O24 Sn4 -","4","1","FG1549","Ng, Seik Weng","Bis(dicyclohexylammonium) tributyl(nitrilotriacetato)stannate","Acta Crystallographica Section C","1999","55","9","1447","1449","10.1107/S0108270199007295","","","0.71073","MoKα","","0.063","0.044","","","","0.1","","","","","","0.942","","","","has coordinates,has disorder","189898","2020-10-21","18:00:00",""
"2008893","10.574","0.003","16.812","0.002","12.882","0.002","90","","102.15","0.02","90","","2238.7","0.8","170","1","170","1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","Tri-n-Butyltin N-maleoyl-β-alaninate","Tri-n-butyltin N-maleoyl-β-alaninate","","- C19 H33 N O4 Sn -","- C19 H33 N O4 Sn -","- C76 H132 N4 O16 Sn4 -","4","1","FG1551","Parvez, Masood; Ali, Saqib; Bhatti, Moazzam Hussain; Khokhar, Muhammad Nawaz; Mazhar, Muhammad; Qureshi, Sajid Iqbal","Tri-<i>n</i>-butyl(<i>N</i>-maleoyl-β-alaninato)tin","Acta Crystallographica Section C","1999","55","9","1427","1429","10.1107/S010827019900743X","","","0.71069","MoKα","","0.107","0.039","","","","0.141","","","","","","1.02","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008894","7.1458","0.0008","9.769","0.0012","11.886","0.002","110.784","0.01","96.074","0.011","101.302","0.01","746.65","0.19","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","1,2,3,4,5,6,7,8-octahydro-3,3,6,6-tetramethylxanthen-1,8-dione","","- C17 H22 O3 -","- C17 H22 O3 -","- C34 H44 O6 -","2","1","FR1174","Jeyakanthan, J.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Hoong-Kun Fun; Murugan, P.","Two tetramethylxanthenediones","Acta Crystallographica Section C","1999","55","9","1515","1517","10.1107/S0108270199006393","","","0.71073","MoKα","","0.066","0.044","","0.139","0.123","","","","0.994","1.131","1.131","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008895","26.581","0.002","10.094","0.001","19.624","0.002","90","","128.75","0.01","90","","4106.3","0.9","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2,3,4,5,6,7,8-octahydro-3,3,6,6-tetramethyl-9-(2-nitrophenyl)xanthen-1,8- dione","","- C23 H25 N O5 -","- C23 H25 N O5 -","- C184 H200 N8 O40 -","8","1","FR1174","Jeyakanthan, J.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Hoong-Kun Fun; Murugan, P.","Two tetramethylxanthenediones","Acta Crystallographica Section C","1999","55","9","1515","1517","10.1107/S0108270199006393","","","0.71073","MoKα","","0.156","0.043","","0.107","0.081","","","","0.74","0.986","0.986","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008896","11.396","0.001","6.742","0.002","14.142","0.001","90","","94.58","0.01","90","","1083.1","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3-dimethylisoguanine","","- C7 H15 N5 O4 -","- C7 H15 N5 O4 -","- C28 H60 N20 O16 -","4","1","FR1180","Gambardella, Maria Teresa do Prado; Dias, Ricardo Luis Araujo; Chehade, Claire Camargos; Berlinck, Roberto Gomes de Sousa","1,3-Dimethylisoguanine trihydrate","Acta Crystallographica Section C","1999","55","9","1585","1587","10.1107/S010827019900640X","","","1.5418","CuKα","","0.071","0.048","","","","0.161","","","","","","1.041","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008897","6.9887","0.0002","10.7123","0.0002","20.4198","0.0004","90","","90","","90","","1528.73","0.06","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1,2,3,4,5,6,7,8-Octahydro-3,3,6,6-tetramethylacridine-1,8-dione","","- C17 H21 N O2 -","- C17 H21 N O2 -","- C68 H84 N4 O8 -","4","1","FR1186","R. Sankaranarayanan; S. Shanmuga Sundara Raj; D. Velmurugan; Hoong-Kun Fun","1,2,3,4,5,6,7,8-Octahydro-3,3,6,6-tetramethylacridine-1,8-dione","Acta Crystallographica Section C","1999","55","9","1513","1514","10.1107/S0108270199006149","","","0.71073","MoKα","","0.078","0.051","","","","0.118","","","","","","1.094","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008898","8.843","0.003","14.085","0.005","15.638","0.005","90","","90","","90","","1947.8","1.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(+)-(2S,7R,9R,10S)-2-Ethenyl-4,4,7- trimethyl-3-(toluene-4-sulfonyl)perhydro-1,3-benzoxazine","","- C20 H29 N O3 S -","- C20 H29 N O3 S -","- C80 H116 N4 O12 S4 -","4","1","FR1189","Rochon, Fernande D.; Breau, Livain","(+)-(2<i>S</i>,7<i>R</i>,9<i>R</i>,10<i>S</i>)-2-Ethenyl-4,4,7-trimethyl-3-(toluene-4-sulfonyl)-3,4,4a,5,6,7,8,8a-octahydro-2<i>H</i>-1,3-benzoxazine","Acta Crystallographica Section C","1999","55","9","1587","1589","10.1107/S0108270199006873","","","0.71073","MoKα","","0.138","0.053","","0.099","0.081","","","","1.046","1.286","1.286","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008899","9.6467","0.0004","12.7276","0.0006","20.804","0.001","90","","90.129","0.001","90","","2554.3","0.2","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","chlorobis(η5-pentamethylcyclopentadienyl)-p- chloroanilideuranium(IV)","","- C26 H35 Cl2 N U -","- C26 H20 Cl2 N U -","- C104 H80 Cl8 N4 U4 -","4","1","FR1192","Peters, R. Gregory; Scott, Brian L.; Burns, Carol J.","Chloro(<i>p</i>-chloroanilido-<i>N</i>)bis(η^5^-pentamethylcyclopentadienyl)uranium(IV)","Acta Crystallographica Section C","1999","55","9","1482","1483","10.1107/S0108270199007143","","","0.71073","MoKα","","0.03","0.024","","","","0.064","","","","","","1.272","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008900","13.979","0.003","4.689","0.001","16.239","0.003","90","","107.279","0.004","90","","1016.4","0.4","153","2","153","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,4-di-{[m-(1,3-dioxane)benzene]}propane","","- C24 H30 O4 -","- C24 H30 O4 -","- C48 H60 O8 -","2","0.5","FR1202","Jene, Paul G.; Ibers, James A.","Bis(1,3-dioxan-2-yl)arenes: precursors to linked porphyrins","Acta Crystallographica Section C","1999","55","9","1593","1595","10.1107/S010827019900788X","","","0.71073","MoKα","","0.1","0.04","","","","0.09","","","","","","0.81","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008901","26.064","0.005","8.696","0.002","11.943","0.002","90","","103.604","0.004","90","","2631","0.9","153","2","153","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,2-di-(1,3 dioxane)benzene","","- C14 H18 O4 -","- C14 H18 O4 -","- C112 H144 O32 -","8","1","FR1202","Jene, Paul G.; Ibers, James A.","Bis(1,3-dioxan-2-yl)arenes: precursors to linked porphyrins","Acta Crystallographica Section C","1999","55","9","1593","1595","10.1107/S010827019900788X","","","0.71073","MoKα","","0.137","0.041","","","","0.077","","","","","","0.723","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008902","14.898","0.001","9.19","0.002","15.525","0.002","90","","90","","90","","2125.6","0.6","296","","296","","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C22 H26 O6 -","- C22 H25.998 O6 -","- C88 H103.992 O24 -","4","0.5","FR1207","Dobson, Allison J.; Gerkin, Roger E.","C—H···O interactions in dimethyl 6,6'-dimethoxy-3,3',5,5'-tetramethylbiphenyl-2,2'-dicarboxylate","Acta Crystallographica Section C","1999","55","9","1496","1499","10.1107/S0108270199007891","","","0.71073","MoKα","","","0.055","","","","0.074","","","","","","1.35","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008903","7.74","0.001","7.948","0.002","9.984","0.001","84.25","0.01","77.38","0.01","61.02","0.01","524.3","0.17","296","","296","","","","","","","","","5","P -1","-P 1","2","quinolinium-4-carboxylic acid chloride monohydrate","","","- C10 H10 Cl N O3 -","- C10 H10 Cl N O3 -","- C20 H20 Cl2 N2 O6 -","2","1","FR1208","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding and C—H···<i>X</i> interactions in two triclinic phases of 4-carboxyquinolinium chloride monohydrate","Acta Crystallographica Section C","1999","55","9","1499","1503","10.1107/S0108270199006885","","","0.71073","MoKα","","","0.039","","","","0.096","","","","","","1.93","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008904","4.2969","0.0006","10.785","0.002","11.36","0.001","85","0.01","82.99","0.01","89.48","0.01","520.52","0.13","296","","296","","","","","","","","","5","P -1","-P 1","2","quinolinium-4-carboxylic acid chloride monohydrate","","","- C10 H10 Cl N O3 -","- C10 H10 Cl N O3 -","- C20 H20 Cl2 N2 O6 -","2","1","FR1208","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding and C—H···<i>X</i> interactions in two triclinic phases of 4-carboxyquinolinium chloride monohydrate","Acta Crystallographica Section C","1999","55","9","1499","1503","10.1107/S0108270199006885","","","0.71073","MoKα","","","0.04","","","","0.09","","","","","","1.95","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008905","15.689","0.006","11.025","0.006","17.641","0.009","90","","113.69","0.07","90","","2794","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","hexachlorotetra(tetrahydrofuran)(μ-oxo)dizirconium","","- C16 H32 Cl6 O5 Zr2 -","- C16 H32 Cl6 O5 Zr2 -","- C64 H128 Cl24 O20 Zr8 -","4","0.5","GD1009","Guan, Jingwen; Siebel, Eric; Fischer, R. Dieter","μ-Oxo-bis[<i>mer</i>-trichlorobis(tetrahydrofuran-<i>O</i>)zirconium(IV)]","Acta Crystallographica Section C","1999","55","9","1449","1451","10.1107/S0108270199007532","","","0.71073","MoKα","","0.0504","0.0436","","0.1159","0.1104","","","","1.241","1.273","1.273","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008906","12.6512","0.001","8.708","0.0006","17.0124","0.0012","90","","106.314","0.006","90","","1798.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ammonium di-aquo ethylenediaminetetraacetate scandiumate trihydrate.","","- C10 H26 N3 O13 Sc -","- C10 H26 N3 O13 Sc -","- C40 H104 N12 O52 Sc4 -","4","1","GD1032","Zhang, Ya-Wen; Wang, Zhe-Ming; Jia, Jiang-Tao; Liao, Chun-Sheng; Yan, Chun-Hua","Ammonium diaqua(ethylenediaminetetraacetato)scandium(III) trihydrate","Acta Crystallographica Section C","1999","55","9","1418","1420","10.1107/S0108270199008057","","","0.71073","MoKα","","0.055","0.045","","","","0.152","","","","","","1.085","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008907","6.293","0.003","10.255","0.002","22.172","0.005","90","","96.17","0.03","90","","1422.6","0.8","123","","123","","","","","","","","","3","P 1 21 1","P 2yb","4","Cholest-5-enyl-3β,4β-diacetate","Cholest-5-ene-3β,4β-diyl diacetate","","- C31 H50 O4 -","- C31 H50 O4 -","- C62 H100 O8 -","2","1","GD1035","Kennedy, Alan R.; Pitt, Andrew R.; Suckling, Colin J.; Suckling, Keith E.; Thomas, Michael","Cholest-5-ene-3β,4β-diyl diacetate","Acta Crystallographica Section C","1999","55","9","1570","1572","10.1107/S0108270199006770","","","0.71069","MoKα","","0.092","0.057","","","","0.147","","","","","","1.052","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008908","5.9096","0.0011","9.9845","0.0017","14.394","0.003","95.053","0.017","93.762","0.019","99.544","0.017","831.5","0.3","150","2","150","2","","","","","","","","8","P -1","-P 1","2","[(Cu2Cl3)](H2bpds)(BF4)","Hexachlorodicuprate(II) Bis[bis(4-pyridinium)disulfide] Bis(tetrafluoroborate)","","- C20 H20 B2 Cl6 Cu2 F8 N4 S4 -","- C20 H20 B2 Cl6 Cu2 F8 N4 S4 -","- C20 H20 B2 Cl6 Cu2 F8 N4 S4 -","1","0.5","GD1036","Blake, Alexander J.; Champness, Neil R.; Cooke, Paul A.; Nicolson, James E.B.","Bis(4,4'-disulfanediyldipyridinium) di-μ-chloro-bis[dichlorocuprate(II)] bis(tetrafluoroborate)","Acta Crystallographica Section C","1999","55","9","1422","1425","10.1107/S0108270199006836","","","0.71073","MoKα","","0.0681","0.0454","","","","0.0816","","","","","","1.18","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008909","9.6855","0.0011","12.775","0.003","16.053","0.006","67.29","0.03","87.64","0.017","85.75","0.017","1827.1","0.9","290","1","290","1","","","","","","","","4","P -1","-P 1","2","Dicyclohexyl-N-(3-pyridinylcarbonyl)urea","N,N`-dicyclohexyl-N-(3-pyridinylcarbonyl)urea","","- C19 H27 N3 O2 -","- C19 H27 N3 O2 -","- C76 H108 N12 O8 -","4","2","GD1039","Gallagher, John F.; Kenny, Peter T.M.; Sheehy, Michael J.","Intermolecular N—H···N and C—H···O interactions from one-dimensional chains comprising the two independent molecues of <i>N</i>,<i>N</i>'-dicyclohexyl-<i>N</i>-nicotinoylurea","Acta Crystallographica Section C","1999","55","9","1607","1610","10.1107/S0108270199007544","","","0.7107","MolybdenumKα","","0.1529","0.0467","","","","0.1107","","","","","","0.871","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008910","7.873","0.002","8.985","0.002","10.412","0.002","101.55","0.03","104.51","0.03","103.52","0.03","666.6","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","1,1,3,3‒Tetramethylguanidinum tetrachloroantimonate(III)","","- C5 H14 Cl4 N3 Sb -","- C5 H14 Cl4 N3 Sb -","- C10 H28 Cl8 N6 Sb2 -","2","1","GD1040","Bujak, Maciej; Osadczuk, Przemysław; Zaleski, Jacek","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylguanidinium tetrachloroantimonate(III) at 295 and 92K","Acta Crystallographica Section C","1999","55","9","1443","1447","10.1107/S0108270199008264","","","0.71073","MoKα","","0.043","0.035","","","","0.096","","","","","","1.244","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008911","7.818","0.002","8.849","0.002","10.333","0.002","101.18","0.03","104.81","0.03","103.72","0.03","646.3","0.3","92","2","295","2","","","","","","","","5","P -1","-P 1","2","","1,1,3,3‒Tetramethylguanidinum tetrachloroantimonate(III)","","- C5 H14 Cl4 N3 Sb -","- C5 H14 Cl4 N3 Sb -","- C10 H28 Cl8 N6 Sb2 -","2","1","GD1040","Bujak, Maciej; Osadczuk, Przemysław; Zaleski, Jacek","<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylguanidinium tetrachloroantimonate(III) at 295 and 92K","Acta Crystallographica Section C","1999","55","9","1443","1447","10.1107/S0108270199008264","","","0.71073","MoKα","","0.023","0.02","","","","0.052","","","","","","1.11","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008912","7.209","0.001","7.9527","0.0007","17.414","0.003","90","","90.64","0.01","90","","998.3","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Polyphosphate de strontium Sr(PO~3~)~2~ forme β","","- O6 P2 Sr -","- O6 P2 Sr -","- O48 P16 Sr8 -","8","2","GS1011","Graia, Mohsen; Driss, Ahmed; Jouini, Tahar","Polyphosphates de strontium Sr(PO~3~)~2~ formes β et γ","Acta Crystallographica Section C","1999","55","9","1395","1398","10.1107/S0108270199003637","","","0.71069","MoKα","","0.0553","0.0336","","0.0861","0.0696","","","","1.137","1.057","1.057","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008913","4.498","0.001","10.911","0.003","10.375","0.003","90","","91.56","0.02","90","","509","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Polyphosphate de strontium Sr(PO~3~)~2~ forme γ","","- O6 P2 Sr -","- O6 P2 Sr -","- O24 P8 Sr4 -","4","1","GS1011","Graia, Mohsen; Driss, Ahmed; Jouini, Tahar","Polyphosphates de strontium Sr(PO~3~)~2~ formes β et γ","Acta Crystallographica Section C","1999","55","9","1395","1398","10.1107/S0108270199003637","","","0.71069","MoKα","","0.0459","0.0332","","0.0982","0.0898","","","","1.13","1.148","1.148","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008914","10.713","0.003","13.569","0.004","28.27","0.009","90","","90","","90","","4109","2","293","","293","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H31 N O5 S -","- C19 H31 N O5 S -","- C152 H248 N8 O40 S8 -","8","2","GS1037","Marchand, Patrice; Masson, Serge; Rachinel, Denis; Saint-Clair, Jean-François; Averbuch-Pouchot, Marie-Thérèse","2-(2,3:5,6-Di-<i>O</i>-isopropylidene-β-<small>D</small>-mannofuranosyl)-<i>N</i>,<i>N</i>-(pentamethylene)ethanethioamide","Acta Crystallographica Section C","1999","55","9","1533","1534","10.1107/S0108270199006459","","","0.7107","MoKα","","0.043","0.043","","0.0416","","0.0416","","","1.829","","","1.829","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008915","8.8118","0.0004","11.606","0.0006","12.1748","0.0007","115.234","0.002","107.66","0.003","95.643","0.003","1035.11","0.1","298","","","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H24 N4 O -","- C26 H24 N4 O -","- C52 H48 N8 O2 -","2","1","GS1040","Aatif, A.; Baouid, A.; Hasnaoui, H.; Benharref, A.; Pierrot, M.","8-Méthyl-1,3-diphényl-4,5,6,6a,7,8-hexahydrocyclopenta[<i>b</i>][1,2,4]triazolo[4,3-<i>a</i>]benzodiazépin-7-one","Acta Crystallographica Section C","1999","55","9","1528","1530","10.1107/S0108270199006897","","","0.71073","MoKα","","","0.05","","","","0.078","","","","","","1.268","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008916","10.17","0.001","12.897","0.001","9.801","0.001","90","","105.358","0.001","90","","1239.6","0.2","298","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H10 O4 -","- C16 H10 O4 -","- C64 H40 O16 -","4","1","GS1041","Kakou-Yao, R.; Saba, A.; Ebby, N.; Pierrot, M.; Aycard, J. P.","Tautomérie de la 4-(hydroxyphénylméthylène) isochroman-1,3 dione à l'état solide","Acta Crystallographica Section C","1999","55","9","1591","1593","10.1107/S0108270199006782","","","0.71073","MoKα","","","0.042","","","","0.074","","","","","","0.994","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008917","21.031","0.003","8.201","0.0008","9.215","0.001","90","","90","","90","","1589.4","0.3","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","Trichloro[(Z)-2-chloro-1,2-diphenylvinyl]tellurium(IV)","","- C14 H10 Cl4 Te -","- C14 H10 Cl4 Te -","- C56 H40 Cl16 Te4 -","4","1","GS1044","Zukerman-Schpector, J.; Camillo, Robinson L.; Comasseto, João V.; Santos, Rute A.; Caracelli, I.","Trichloro[(<i>Z</i>)-2-chloro-1,2-diphenylvinyl]tellurium(IV)","Acta Crystallographica Section C","1999","55","9","1577","1579","10.1107/S0108270199006964","","","0.71073","MoKα","","0.066","0.03","","","","0.069","","","","","","1.09","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008918","11.2868","0.0006","30.877","0.002","11.9177","0.0006","90","","92.746","0.003","90","","4148.6","0.4","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H60 La N7 O15 -","- C30 H60 La N7 O15 -","- C120 H240 La4 N28 O60 -","4","1","GS1046","Thuéry, Pierre; Nierlich, Martine; Charbonnel, Marie-Christine; Dognon, Jean-Pierre","Bis[2-(2-ethoxyethyl)-<i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-tetraethylmalondiamide-<i>O</i>^1^,<i>O</i>^3^]tris(nitrato-<i>O</i>,<i>O</i>')lanthanum(III)","Acta Crystallographica Section C","1999","55","9","1434","1436","10.1107/S0108270199008215","","","0.71073","MoKα","","0.052","0.035","","0.12","","0.076","","","1.131","","","1.06","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008919","9.6477","0.0001","14.9004","0.0002","18.0803","0.0003","75.92","0.001","84.206","0.001","75.546","0.001","2439.01","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Intramolecular N-H...π(Phenyl) and Intermolecular C-H...π(Phenyl) Interaction in 5-Amino-8-cyano-2-phenyl-4(4-methoxy-phenyl-7- (piperidine-1-yl)-1,6-Naphthyridine","","- C30 H28 N5 O -","- C30 H28 N5 O -","- C120 H112 N20 O4 -","4","2","HA1253","R. Thirumurugan; S.Shanmuga Sundara Raj; G.Shanmugam; Hoong-Kun Fun; V. Raghukumar; V.T. Ramakrishnan","Intramolecular N—H···π(phenyl) and intermolecular C—H···π(phenyl) interactions in 5-amino-4-(4-methoxyphenyl)-2-phenyl-7-piperidino-1,6-naphthyridine-8-carbonitrile–benzene(2/1)","Acta Crystallographica Section C","1999","55","9","1522","1524","10.1107/S0108270199005879","","","0.71073","MoKα","","0.1044","0.0658","","","","0.1833","","","","","","1.073","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008920","8.0589","0.0006","9.2783","0.0007","10.0365","0.0008","81.755","0.005","87.512","0.005","67.632","0.005","686.77","0.09","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H44 Cu F6 N8 P -","- C24 H44 Cu F6 N8 P -","- C24 H44 Cu F6 N8 P -","1","0.5","HA1257","Hubin, Timothy J.; Alcock, Nathaniel W.; Clase, Howard J.; Busch, Daryle H.","A complex containing Cu^I^ linearly coordinated by two tetracyclic tetraamines","Acta Crystallographica Section C","1999","55","9","1402","1403","10.1107/S0108270199006423","","","0.71073","MoKα","","0.052","0.04","","","0.089","0.092","","","","1","1","0.916","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008921","10.262","0.002","12.073","0.002","12.357","0.003","90","","92.47","0.03","90","","1529.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetraaqua-(2,2'-bipyridyl-N,N'))-cadmium(ii) sulfate","","- C10 H16 Cd N2 O8 S -","- C10 H16 Cd N2 O8 S -","- C40 H64 Cd4 N8 O32 S4 -","4","1","HA1260","Miguel Harvey; Sergio Baggio; Ricardo Baggio; Alvaro Mombrú","Tetraaqua(2,2'-bipyridyl-<i>N</i>,<i>N</i>')cadmium(II) sulfate and <i>catena</i>-poly[[[diaqua(2,2'-bipyridyl-<i>N</i>,<i>N</i>')cadmium(II)]-μ-(sulfato-<i>O</i>:<i>O</i>')] hydrate]","Acta Crystallographica Section C","1999","55","9","1457","1460","10.1107/S0108270199007982","","","0.71073","MoKα","","0.045","0.035","","0.102","","0.095","","","1.016","","","1.046","","","","has coordinates,has disorder","301791","2025-08-18","23:15:33",""
"2008922","20.998","0.004","6.823","0.001","20.001","0.004","90","","94.88","0.03","90","","2855.1","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Catena-((mu!2$-Sulfato-O,O')-diaqua-(2,2'-bipyridyl-N,N'))-cadmium(ii) monohydrate","","- C10 H14 Cd N2 O7 S -","- C10 H11.5 Cd N2 O7 S -","- C80 H92 Cd8 N16 O56 S8 -","8","2","HA1260","Miguel Harvey; Sergio Baggio; Ricardo Baggio; Alvaro Mombrú","Tetraaqua(2,2'-bipyridyl-<i>N</i>,<i>N</i>')cadmium(II) sulfate and <i>catena</i>-poly[[[diaqua(2,2'-bipyridyl-<i>N</i>,<i>N</i>')cadmium(II)]-μ-(sulfato-<i>O</i>:<i>O</i>')] hydrate]","Acta Crystallographica Section C","1999","55","9","1457","1460","10.1107/S0108270199007982","","","0.71073","MoKα","","0.094","0.047","","0.144","","0.119","","","0.974","","","1.016","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008923","10.3098","0.0013","8.4972","0.0008","11.4264","0.0013","90","","90","","90","","1001","0.19","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","3-chloro-1-(4,5-dinitroimidazolyl)propan-2-ol","","- C6 H7 Cl N4 O5 -","- C6 H7 Cl N4 O5 -","- C24 H28 Cl4 N16 O20 -","4","1","JZ1330","Gzella, Andrzej; Wrzeciono, Urszula; Pöppel, Wolfram","Azole. 42. Über Nitropiperidinoimidazolderivate","Acta Crystallographica Section C","1999","55","9","1562","1565","10.1107/S0108270199005880","","","1.54178","CuKα","","0.038","0.037","","","","0.108","","","1.089","","","1.094","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008924","10.763","0.001","16.052","0.002","16.634","0.002","75.87","0.01","82.88","0.01","89.91","0.01","2764.1","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","3-Chloro-1-(4-nitro-5-piperidinylimidazolyl)propan-2-ol","","- C11 H17 Cl N4 O3 -","- C11 H17 Cl N4 O3 -","- C88 H136 Cl8 N32 O24 -","8","4","JZ1330","Gzella, Andrzej; Wrzeciono, Urszula; Pöppel, Wolfram","Azole. 42. Über Nitropiperidinoimidazolderivate","Acta Crystallographica Section C","1999","55","9","1562","1565","10.1107/S0108270199005880","","","1.54178","CuKα","","0.06","0.045","","","","0.147","","","1.082","","","1.173","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008925","13.327","0.003","8.672","0.002","14.382","0.003","90","","98.23","0.01","90","","1645","0.6","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 I Se -","- C18 H15 I Se -","- C72 H60 I4 Se4 -","4","1","JZ1353","Fleischer, Holger; Schollmeyer, Dieter","Triphenylselenonium iodide","Acta Crystallographica Section C","1999","55","9","1572","1573","10.1107/S0108270199008033","","","0.71073","MoKα","","0.074","0.041","","","0.093","0.105","","","","","","0.999","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008926","9.201","0.001","10.027","0.001","18.217","0.002","90","","90","","90","","1680.7","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","1-N,2-O-Carbonyl-3,5-O-isopropylidene-1-N(2'[R]-2'-methyl-3'-oxo-pentanoyl)- α-D-xylofuranosylamine'","","- C15 H21 N O7 -","- C15 H21 N O7 -","- C60 H84 N4 O28 -","4","1","JZ1359","Kopf, Jürgen; Lützen, Arne; Köll, Peter","1-<i>N</i>,2-<i>O</i>-Carbonyl-3,5-<i>O</i>-isopropylidene-1-<i>N</i>-[(2<i>R</i>)-2-methyl-3-oxopentanoyl]-α-<small>D</small>-xylofuranosylamine","Acta Crystallographica Section C","1999","55","9","1541","1542","10.1107/S0108270199007210","","","1.54178","CuKα","","0.039","0.036","","","","0.103","","","","","","1.075","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008927","19.305","0.002","5.958","0.001","23.847","0.002","90","","91.989","0.008","90","","2741.2","0.6","293.2","","293.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H11 Cl2 N O -","- C15 H11 Cl2 N O -","- C120 H88 Cl16 N8 O8 -","8","1","KA1319","Kabak, Mehmet; Elerman, Yalc̨in; Güner, Vildan; Yildirir, Süleyman; Durlu, Tahsin Nuri","3,3-Dichloro-1,4-diphenylazetidin-2-one","Acta Crystallographica Section C","1999","55","9","1511","1512","10.1107/S0108270199006095","","","0.7107","MoKα","","0.057","0.057","","0.057","","0.057","","","0.949","","","0.95","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008928","12.157","0.003","12.157","0.003","8.05","0.002","90","","90","","120","","1030.3","0.4","294","2","294","2","","","","","","","","3","P 32","P 32","145","isocurcumenol","3S-(3α,3aα,6α,8aβ)-Octahydro-3-methyl-8-methylene-5-(1-methylethylidene)- 6H-3a,6-epoxyazulen-6-ol","","- C15 H22 O2 -","- C15 H22 O2 -","- C45 H66 O6 -","3","1","KA1324","Jan W. Bats; Öhlinger, Stefan H.","Absolute configuration of isocurcumenol","Acta Crystallographica Section C","1999","55","9","1595","1598","10.1107/S0108270199006101","","","1.5418","CuKα","","0.028","0.027","","","","0.088","","","","","","1.546","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008929","12.0864","0.0015","12.0864","0.0015","7.9291","0.0011","90","","90","","120","","1003.1","0.2","135","2","135","2","","","","","","","","3","P 32","P 32","145","isocurcumenol","3S-(3α,3aα,6α,8aβ)-Octahydro-3-methyl-8-methylene-5-(1-methylethylidene)- 6H-3a,6-epoxyazulen-6-ol","","- C15 H22 O2 -","- C15 H22 O2 -","- C45 H66 O6 -","3","1","KA1324","Jan W. Bats; Öhlinger, Stefan H.","Absolute configuration of isocurcumenol","Acta Crystallographica Section C","1999","55","9","1595","1598","10.1107/S0108270199006101","","","0.71073","MoKα","","0.038","0.034","","","","0.095","","","","","","1.193","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008930","8.5158","0.0008","7.0115","0.0006","10.9335","0.0013","90","","97.375","0.012","90","","647.42","0.11","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","9-(2'-Deoxy-α-D-ribofuranosyl)-7-iodo-7-deazaadenine","","","- C11 H13 I N4 O3 -","- C11 H13 I N4 O3 -","- C22 H26 I2 N8 O6 -","2","1","KA1326","Seela, Frank; Zulauf, Matthias; Reuter, Hans; Kastner, Guido","9-(2-Deoxy-α-<small>D</small>-ribofuranosyl)-7-iodo-7-deazaadenine","Acta Crystallographica Section C","1999","55","9","1560","1562","10.1107/S0108270199006538","","","0.71073","MoKα","","0.0232","0.0226","","","","0.0569","","","","","","1.051","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008931","24.83","0.002","9.642","0.002","9.176","0.006","90","","90","","90","","2196.8","1.5","293.2","","293.2","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C23 H30 N2 O4 -","- C23 H30 N2 O4 -","- C92 H120 N8 O16 -","4","0.5","KA1327","Elerman, Yalçin; Kabak, Mehmet; Kara, Hülya; Güven, Kutalmıs̨; Naki̇poǧlu, Canan","3,9-Dimethyl-1,11-diphenyl-4,8-diazaundecane-1,11-dione dihydrate","Acta Crystallographica Section C","1999","55","9","1508","1511","10.1107/S0108270199007192","","","0.7107","MoKα","","0.088","0.05","","","","0.16","","","","","","0.96","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008932","9.07","0.003","10.974","0.005","12.102","0.004","64.85","0.03","71.36","0.03","76.37","0.03","1026.2","0.7","208","2","208","2","","","","","","","","6","P -1","-P 1","2","","Acetylpyridinium thiosemicarbazone)hexanitratothorate(IV)","","- C20 H38 N14 O22 S2 Th -","- C20 H38 N14 O22 S2 Th -","- C20 H38 N14 O22 S2 Th -","1","0.5","KA1328","Abram, Ulrich; Bonfada, Elida; Schulz Lang, Ernesto; Acetylpyridinium thiosemicarbazone)hexanitratothorate(IV)","Bis{2-[1-(thiosemicarbazono)ethyl]pyridinium} hexakis(nitrato-<i>O</i>,<i>O</i>')thorate(IV) tetramethanol solvate","Acta Crystallographica Section C","1999","55","9","1479","1482","10.1107/S0108270199007556","","","0.71073","MoKα","","0.0262","0.0256","","","","0.061","","","","","","1.057","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008933","7.214","0.001","18.34","0.001","10.418","0.001","90","","109.32","0.01","90","","1300.7","0.2","298","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H26 Co N4 O10 -","- C26 H26 Co N4 O10 -","- C52 H52 Co2 N8 O20 -","2","0.5","KA1329","Hökelek, Tuncer; Necefoğlu, Hacali","<i>trans</i>-Diaquabis(3-hydroxybenzoato-<i>O</i>)bis(nicotinamide-<i>N</i>^1^)cobalt(II)","Acta Crystallographica Section C","1999","55","9","1438","1440","10.1107/S0108270199006733","","","0.71073","MoKα","","","0.0511","","","","0.075","","","","","","1.29","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008934","7.3785","0.0002","47.9241","0.001","5.9069","0.0002","90","","90","","90","","2088.73","0.1","293","2","293","2","","","","","","","","4","A b a 2","A 2 -2ab","41","","Bis{4,4'-[di-(2-carbomethoxy-5-thienyl)]} phenyl ether","","- C24 H18 O5 S2 -","- C24 H18 O5 S2 -","- C96 H72 O20 S8 -","4","","LN1085","S.Shanmuga Sundara Raj; Hoong-Kun Fun; Susmita Gupta; Jayanta Kumar Ray","Bis[4-(2-methoxycarbonyl-5-thienyl)]phenyl ether","Acta Crystallographica Section C","1999","55","9","1517","1519","10.1107/S0108270199008021","","","0.71073","MoKα","","0.0369","0.0304","","","","0.0952","","","","","","1.083","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008935","28.308","0.003","11.306","0.003","20.622","0.003","90","","123.5","0.02","90","","5504","2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","[Ni(3,5-Cl4salMetrien)]","(1,4-dioxan-O) [3,3'-methyliminobis(1,3-propanediylnitrilomethylidyne)di-3'',5''-dichloroph enolate-N,N',N'',O] nickel(II)","","- C25 H29 Cl4 N3 Ni O4 -","- C25 H26 Cl4 N3 Ni O4 -","- C200 H208 Cl32 N24 Ni8 O32 -","8","1","NA1403","Gomes, Ligia; Pinho, Dora; Freire, Cristina; de Castro, Baltazar","(1,4-Dioxane-<i>O</i>){3,3',5,5'-tetrachloro-2,2'-[4-methyl-4-azaheptane-1,7-diylbis(nitrilomethylidyne-<i>N</i>)]diphenolato-<i>O</i>,<i>O</i>'}nickel(II), [Ni(3,5-Cl~4~salMetrien)]","Acta Crystallographica Section C","1999","55","9","1425","1427","10.1107/S0108270199004588","","","0.71069","MoKα","","0.076","0.046","","0.108","","0.091","","","1.31","","","1.346","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008936","8.739","0.001","11.68","0.002","11.858","0.002","69.46","0.01","71.69","0.01","68.87","0.01","1032.5","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Benzoylacetone-(S-n-propylisothiosemicarbazonato)iron(III) dichloride ethanol solvate","","","- C16 H24 Cl2 Fe N3 O2 S -","- C16 H24 Cl2 Fe N3 O2 S -","- C32 H48 Cl4 Fe2 N6 O4 S2 -","2","1","NA1418","Argay, Gyula; Kálmán, Alajos; Leovac, Vukadin M.","[Fe(H<i>L</i>)Cl~2~]^.^EtOH, where H<i>L</i> is the monoanion of benzoylacetone <i>S</i>-<i>n</i>-propylisothiosemicarbazone","Acta Crystallographica Section C","1999","55","9","1440","1443","10.1107/S0108270199007647","","","0.71073","MoKα","","0.101","0.039","","","","0.097","","","","","","0.875","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008937","18.304","0.001","10.488","0.001","14.267","0.001","90","","123.79","0.001","90","","2276.2","0.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","9-(4H-1,2,4-triazol-4-ylimino)-4,5-diazafluorene","","- C13 H8 N6 -","- C13 H8 N6 -","- C104 H64 N48 -","8","1","NA1425","S. Shanmuga Sundara Raj; Hoong-Kun Fun; Dun-ru Zhu; Fang-Fang Jian; Koulin Zhang; Xiao-Zeng You","9-(4<i>H</i>-1,2,4-Triazol-4-ylimino)-4,5-diazafluorene","Acta Crystallographica Section C","1999","55","9","1526","1528","10.1107/S0108270199007908","","","0.71073","MoKα","","0.121","0.063","","","","0.197","","","","","","1.018","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008938","16.761","0.0002","14.2287","0.0002","21.1305","0.0002","90","","97.691","0.001","90","","4994.02","0.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","3,5-Bis(2-pyridyl)-4-p-methylphenyl-4H-1,2,4-triazole bis(triphenyl phosphine) silver(I) perchlorate","","- C55 H45 Ag Cl N5 O4 P2 -","- C55 H45 Ag Cl N5 O4 P2 -","- C220 H180 Ag4 Cl4 N20 O16 P8 -","4","1","NA1429","Shao, Si-Chang; Zhu, Dun-Ru; Zhu, Xu-Hui; You, Xiao-Zeng; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun","[4-(4-Methylphenyl)-3,5-bis(2-pyridyl)-4<i>H</i>-1,2,4-triazole]bis(triphenylphosphine)silver(I) perchlorate","Acta Crystallographica Section C","1999","55","9","1412","1413","10.1107/S0108270199008197","","","0.71073","MoKα","","0.073","0.04","","","","0.111","","","","","","1.047","","","","has coordinates,has disorder","301791","2025-08-18","23:15:33",""
"2008939","10.545","0.001","9.747","0.001","5.3893","0.0005","90","","92.243","0.007","90","","553.5","0.09","298.2","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C9 H16 N2 O4 S -","- C9 H16 N2 O4 S -","- C18 H32 N4 O8 S2 -","2","1","OA1081","Tokutake, Nobuya; Hiratake, Jun; Irie, Takayuki; Yamano, Akihito; Oda, Jun-ichi","The absolute configuration of an intermediate cyclic sulfoximine in the asymmetric synthesis of transition-state analog inhibitors of γ-glutamylcysteine synthetase","Acta Crystallographica Section C","1999","55","9","1598","1599","10.1107/S0108270198016436","","","0.7107","MoKα","","","0.029","","","","0.084","","","","","","1.033","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008940","13.006","0.001","10.648","0.001","6.619","0.001","90","","90","","90","","916.65","0.18","293","2","296.2","","","","","","","","","5","P n 21 a","P -2ac -2n","33","","potassium niobium alminium arsenate","","- Al As1.6 K2 Nb1.4 O10 -","- Al As1.6 K2 Nb1.4 O10 -","- Al4 As6.4 K8 Nb5.6 O40 -","4","1","OH1112","Takeshi Nakagawa; Takeo Matsumoto; Valery I. Chani; Tsuguo Fukuda","K~2~NbAlO~2~[(As,Nb)O~4~]~2~, isostructural with KTiOPO~4~","Acta Crystallographica Section C","1999","55","9","1391","1393","10.1107/S0108270199005144","","","0.71069","MoKα","","","0.023","","","","0.034","","","1.991","","","1.991","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008941","12.386","0.003","15.837","0.002","14.515","0.003","90","","105","0.02","90","","2750.2","1","294","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","methyltriphenylphosphonium 1-thiolate-2-methyl-1,2-dicarba-closo- dodecaborane(12)","methyltriphenylphosphonium 1-sulfido-2-methyl-1,2-dicarba-closo- dodecaborane(12)","","- C22 H31 B10 P S -","- C22 H31 B10 P S -","- C88 H124 B40 P4 S4 -","4","1","OS1061","Kivekäs, Raikko; Benakki, Rajae; Viñas, Clara; Sillanpää, Reijo","Methyltriphenylphosphonium 2-methyl-1-sulfido-1,2-dicarba-<i>closo</i>-dodecaborane(12)","Acta Crystallographica Section C","1999","55","9","1581","1583","10.1107/S0108270199006307","","","0.71069","MoKα","","0.172","0.059","","","","0.161","","","","","","0.997","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008942","5.1673","0.0001","23.9998","0.0004","5.4029","0.0001","90","","112.026","0.001","90","","621.13","0.02","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-leucine:D-2-aminobutanoic acid","","- C10 H22 N2 O4 -","- C10 H22 N2 O4 -","- C20 H44 N4 O8 -","2","1","OS1063","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. III. The <small>L</small>-leucine and <small>L</small>-valine series","Acta Crystallographica Section C","1999","55","9","1547","1555","10.1107/S0108270199006162","","","0.71073","MoKα","","0.065","0.052","","0.154","","0.136","","","1.151","","","1.099","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008943","5.1639","0.0001","5.4076","0.0001","13.1241","0.0002","91.779","0.001","98.138","0.001","111.823","0.001","335.393","0.011","150","2","150","2","","","","","","","","4","P 1","P 1","1","","L-Leucine:D-2-aminopentanoic acid","","- C11 H24 N2 O4 -","- C11 H24 N2 O4 -","- C11 H24 N2 O4 -","1","1","OS1063","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. III. The <small>L</small>-leucine and <small>L</small>-valine series","Acta Crystallographica Section C","1999","55","9","1547","1555","10.1107/S0108270199006162","","","0.71073","MoKα","","0.048","0.04","","0.123","","0.114","","","1.053","","","1.083","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008944","5.1451","0.0001","28.0517","0.0005","5.4068","0.0001","90","","111.423","0.001","90","","726.44","0.02","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","L-Leucine:D-methionine","","- C11 H24 N2 O4 S -","- C11 H24 N2 O4 S -","- C22 H48 N4 O8 S2 -","2","1","OS1063","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. III. The <small>L</small>-leucine and <small>L</small>-valine series","Acta Crystallographica Section C","1999","55","9","1547","1555","10.1107/S0108270199006162","","","0.71073","MoKα","","0.126","0.081","","","","0.173","","","","","","1.095","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008945","5.2002","0.0001","25.1334","0.0004","5.4157","0.0001","90","","110.796","0.001","90","","661.71","0.02","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-leucine:D-valine","","- C11 H24 N2 O4 -","- C11 H24 N2 O4 -","- C22 H48 N4 O8 -","2","1","OS1063","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. III. The <small>L</small>-leucine and <small>L</small>-valine series","Acta Crystallographica Section C","1999","55","9","1547","1555","10.1107/S0108270199006162","","","0.71073","MoKα","","0.039","0.037","","0.102","","0.095","","","1.108","","","1.108","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008946","9.9562","0.0001","4.7417","0.0001","12.7833","0.0001","90","","106.843","0.001","90","","577.602","0.015","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-valine:D-2-aminobutanoic acid","","- C9 H20 N2 O4 -","- C9 H20 N2 O4 -","- C18 H40 N4 O8 -","2","1","OS1063","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. III. The <small>L</small>-leucine and <small>L</small>-valine series","Acta Crystallographica Section C","1999","55","9","1547","1555","10.1107/S0108270199006162","","","0.71073","MoKα","","0.045","0.04","","0.108","","0.104","","","1.018","","","1.046","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008947","27.2288","0.0002","4.7397","0.0001","9.9535","0.0001","90","","96.091","0.001","90","","1277.31","0.03","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","","L-valine:D-2-aminopentanoic acid","","- C10 H22 N2 O4 -","- C10 H22 N2 O4 -","- C40 H88 N8 O16 -","4","1","OS1063","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. III. The <small>L</small>-leucine and <small>L</small>-valine series","Acta Crystallographica Section C","1999","55","9","1547","1555","10.1107/S0108270199006162","","","0.71073","MoKα","","0.04","0.034","","0.102","","0.097","","","1.095","","","1.11","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008948","28.9379","0.0002","4.7032","0.0001","10.0011","0.0001","90","","90","","90","","1361.16","0.03","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","L-valine:D-methionine","","- C10 H22 N2 O4 S -","- C10 H22 N2 O4 S -","- C40 H88 N8 O16 S4 -","4","1","OS1063","Dalhus, Bjørn; Görbitz, Carl Henrik","Molecular aggregation in selected crystalline 1:1 complexes of hydrophobic <small>D</small>- and <small>L</small>-amino acids. III. The <small>L</small>-leucine and <small>L</small>-valine series","Acta Crystallographica Section C","1999","55","9","1547","1555","10.1107/S0108270199006162","","","0.71073","MoKα","","0.07","0.052","","0.117","","0.109","","","1.133","","","1.168","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008949","18.093","0.003","5.093","0.002","13.358","0.002","90","","105.48","0.02","90","","1186.3","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2:1 N^6^,N^6^-Dimethyladenine:Tetraiodoethene","","- C16 H18 I4 N10 -","- C8 H9 I2 N5 -","- C32 H36 I8 N20 -","4","1","OS1064","Dahl, Tor","<i>N</i>^6^,<i>N</i>^6^-Dimethyladenine‒tetraiodoethene (2/1)","Acta Crystallographica Section C","1999","55","9","1568","1570","10.1107/S0108270199006472","","","0.7107","MoKα","","0.0516","0.0303","","","","0.0832","","","","","","1.041","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008950","6.676","0.005","24.324","0.007","17.66","0.01","90","","95.87","0.06","90","","2853","3","298.2","","298.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H33 Cl N5 O8.5 -","- C26 H32 Cl N5 O8.5 -","- C104 H128 Cl4 N20 O34 -","4","1","QA0146","Vyas, K.; Moses Babu, J.; Om Reddy, G.","Domperidone maleate","Acta Crystallographica Section C","1999","55","9","IUC9900104","","10.1107/S010827019909887X","","","1.5418","CuKα","","0.085","0.062","","0.082","","0.078","","","1.807","","","1.964","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008951","11.607","0.002","20.097","0.005","10.449","0.004","90","","90","","90","","2437.4","1.2","298.2","","298.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H42 N2 O3 -","- C24 H42 N2 O3 -","- C96 H168 N8 O12 -","4","1","QA0147","Moses Babu,J.; Ravindra Kumar, Y.; Vyas, K.; Om Reddy, G.; Rajan, S. T.; Reddy, M. S. N.","<i>N</i>-<i>tert</i>-Butyl-3-oxo-4-aza-5β,17β-androstane-17-carboxamide methanol solvate, a finasteride impurity","Acta Crystallographica Section C","1999","55","9","IUC9900105","","10.1107/S0108270199098868","","","1.5418","CuKα","","0.101","0.081","","0.12","","0.114","","","1.862","","","1.976","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008952","7.2989","0.0001","9.2859","0.0001","12.4017","0.0001","89.4709","0.0003","87.8567","0.0002","70.768","0.0003","793.08","0.015","100","1","100","1","","","","","","","","3","P 1","P 1","1","","","","- C18.5 H26 O2.5 -","- C18.5 H26 O2.5 -","- C37 H52 O5 -","2","2","QA0149","Parrish, Damon A.; Pinkerton, A. Alan","Estradiol methanol hemisolvate","Acta Crystallographica Section C","1999","55","9","IUC9900100","","10.1107/S0108270199098856","","","0.71073","MoKα","","0.082","0.043","","","","0.116","","","","","","0.941","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008953","14.373","0.007","11.078","0.007","16.788","0.008","90","","107.67","0.05","90","","2547","2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","[bis(2,2'-bipyridine)(pyridine-2-carboxylato)ruthenium(II)] hexafluorophosphate","[bis(2,2'-bipyridine)(pyridine-2-carboxylato)ruthenium(II)] hexafluorophosphate","","- C26 H20 F6 N5 O2 P Ru -","- C26 H20 F6 N5 O2 P Ru -","- C104 H80 F24 N20 O8 P4 Ru4 -","4","1","QA0150","Lashgari, Kianosh; Norrestam, Rolf; Åkermark, Björn","Bis(2,2'-bipyridine)(pyridine-2-carboxylate)ruthenium(II) hexafluorophosphate at 173K","Acta Crystallographica Section C","1999","55","9","IUC9900108","","10.1107/S0108270199098881","","","0.71073","MoKα","","0.062","0.036","","","","0.105","","","","","","1.001","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008954","11.078","0.002","12.869","0.002","28.77","0.005","90","","100.17","0.01","90","","4037.1","1.2","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Octacarbonyl-μ-dicyclohexylphosphido-dirhenium-silver-triphenylphosphane","","- C38 H37 Ag O8 P2 Re2 -","- C38 H37 Ag O8 P2 Re2 -","- C152 H148 Ag4 O32 P8 Re8 -","4","1","QA0152","Flörke, Ulrich; Haupt, Hans-Jürgen","Octacarbonyl-1κ^4^<i>C</i>,2κ^4^<i>C</i>-μ-dicyclohexylphosphido-1:2κ^2^<i>P</i>:<i>P</i>-triphenylphosphine-2κ<i>P</i>-silverdirhenium(2 <i>Re</i>—<i>Ag</i>)","Acta Crystallographica Section C","1999","55","9","IUC9900106","","10.1107/S010827019909890X","","","0.71073","MoKα","","0.086","0.048","","","","0.077","","","","","","1.165","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008955","16.283","0.001","10.694","0.001","15.038","0.002","90","","91.443","0.009","90","","2617.7","0.5","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2,2'-Iminodipyridinium(1+) dichlorotriphenylstannate","","- C28 H25 Cl2 N3 Sn -","- C28 H25 Cl2 N3 Sn -","- C112 H100 Cl8 N12 Sn4 -","4","0.5","QA0153","Ng, Seik Weng","2,2'-Iminodipyridinium(1+) dichlorotriphenylstannate and 2,2'-iminodipyridinium(1+) tricyclohexylbis(trifluoroacetato)stannate","Acta Crystallographica Section C","1999","55","9","IUC9900098","","10.1107/S0108270199098923","","","0.71073","MoKα","","0.0513","0.0484","","","","0.1449","","","","","","1.141","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008956","18.8548","0.0008","10.9063","0.0007","17.591","0.002","90","","99.678","0.005","90","","3565.9","0.5","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","2,2'-Iminodipyridinium(1+) bis(trifluoroacetato)tricyclohexylstannate","","- C32 H43 F6 N3 O4 Sn -","- C32 H43 F6 N3 O4 Sn -","- C128 H172 F24 N12 O16 Sn4 -","4","0.5","QA0153","Ng, Seik Weng","2,2'-Iminodipyridinium(1+) dichlorotriphenylstannate and 2,2'-iminodipyridinium(1+) tricyclohexylbis(trifluoroacetato)stannate","Acta Crystallographica Section C","1999","55","9","IUC9900098","","10.1107/S0108270199098923","","","0.71073","MoKα","","0.0678","0.0587","","","","0.1732","","","","","","1.079","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008957","8.409","0.004","9.327","0.004","18.144","0.007","78.555","0.014","76.85","0.02","70.5","0.02","1294.6","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bromo (1,10-Phenanthroline-N,N') (Triphenylphosphine) Copper(I)","","- C30 H23 Br Cu N2 P -","- C30 H23 Br Cu N2 P -","- C60 H46 Br2 Cu2 N4 P2 -","2","1","QA0154","Jin, Qiong-Hua; Xin, Xiu-Lan; Zhu, Fu-Jiang","Bromo(1,10-phenanthroline-<i>N</i>,<i>N</i>')(triphenylphosphine)copper(I)","Acta Crystallographica Section C","1999","55","9","IUC9900107","","10.1107/S0108270199098893","","","0.71073","MoKα","","","0.037","","","","0.086","","","","","","0.948","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008958","7.1535","0.0009","5.5819","0.001","5.3279","0.0004","90","","89.934","0.008","90","","212.74","0.05","150","2","150","2","","","","","","","","4","P 1 n 1","P -2yac","7","Disodium zinc germanate","Disodium zinc germanium tetraoxide","","- Ge Na2 O4 Zn -","- Ge Na2 O4 Zn -","- Ge2 Na4 O8 Zn2 -","2","1","QA0155","Healey, Adam M.; Webster, Michael; Weller, Mark T.","Disodium zinc germanium tetraoxide","Acta Crystallographica Section C","1999","55","9","IUC9900099","","10.1107/S0108270199098935","","","0.71073","MoKα","","0.023","0.022","","","","0.054","","","","","","1.259","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008959","23.7306","0.0014","11.9542","0.0012","17.468","0.003","90","","95.597","0.019","90","","4931.7","1","294","1","294","1","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","trans-Bis(triphenylphosphine)bis(tert-butylisocyanide)rhodium(I) nido-7,8-dicarbaundecaborane.","","- C48 H60 B9 N2 P2 Rh -","- C46 H60 B11.402 N2 P2 Rh -","- C184 H240 B45.608 N8 P8 Rh4 -","4","0.5","QA0156","Ferguson, George; McEneaney, Patricia A.; Spalding, Trevor R.","<i>trans</i>-Bis(<i>tert</i>-butylisocyanido-<i>C</i>)bis(triphenylphosphine-<i>P</i>)rhodium(I) <i>nido</i>-7,8-dicarbaundecarboranide","Acta Crystallographica Section C","1999","55","9","IUC9900103","","10.1107/S0108270199098911","","","0.71073","MoKα","","0.049","0.034","","","","0.09","","","","","","1.194","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2008960","6.1965","0.0012","13.025","0.003","10.419","0.002","90","","103.88","0.03","90","","816.4","0.3","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","ethyl viologen diiodide","N,N'-diethyl-4,4'-bipyridinium diiodide","","- C14 H18 I2 N2 -","- C14 H18 I2 N2 -","- C28 H36 I4 N4 -","2","0.5","QA0157","Eckert, Nathan A.; Krause Bauer, Jeanette A.; Connick, William B.","<i>N</i>,<i>N</i>'-Diethyl-4,4'-bipyridinium diiodide","Acta Crystallographica Section C","1999","55","9","IUC9900101","","10.1107/S0108270199098844","","","0.71073","MoKα","","0.033","0.027","","0.073","","0.068","","","","","","1.112","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008961","12.951","0.003","9.977","0.002","11.131","0.002","90","","113.52","0.03","90","","1318.8","0.6","297","2","297","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,2,6,6-tetramethyl-4-(methylsulfonyl-oxyl)-1-piperidinooxy","","- C10 H20 N O4 S -","- C10 H20 N O4 S -","- C40 H80 N4 O16 S4 -","4","1","QA0158","Homrighausen, Craig L.; Krause Bauer, Jeanette A.","2,2,6,6-Tetramethyl-4-(methylsulfonyloxy)piperidinyl 1-oxide","Acta Crystallographica Section C","1999","55","9","IUC9900102","","10.1107/S0108270199098832","","","0.71073","MoKα","","0.091","0.053","","","","0.129","","","","","","1.073","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2008962","8.043","0.001","13.288","0.002","17.629","0.002","90","","96.34","0.03","90","","1872.6","0.4","291","1","291","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 Cl2 O5 -","- C20 H20 Cl2 O5 -","- C80 H80 Cl8 O20 -","4","1","QA0159","Meinhardt, Sven; Schürmann, Markus; Preut, Hans; Eilbracht, Peter","Dimethyl 2-(5,8-dichloro-10-oxotricyclo[7.3.2.0^2,7^]tetradeca-2(7),3,5,11-tetraen-6-ylmethyl)malonate","Acta Crystallographica Section C","1999","55","9","IUC9900110","","10.1107/S0108270199098820","","","0.71069","MoKα","","0.056","0.04","","","","0.112","","","","","","1.013","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008963","9.8615","0.0001","10.6446","0.0002","13.6513","0.0001","90","","90","","90","","1433","0.03","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","tert-Butylhydrazine hydrochloride","t-Butylhydrazine hydrochloride","","- C4 H13 Cl N2 -","- C4 H13 Cl N2 -","- C32 H104 Cl8 N16 -","8","1","QA0162","Schumann, Herbert; Gottfriedsen, Jochen; Dechert, Sebastian","Redetermination of <i>tert</i>-butylhydrazinium chloride","Acta Crystallographica Section C","1999","55","9","IUC9900109","","10.1107/S0108270199098819","","","0.71073","MoKα","","0.035","0.029","","","","0.081","","","","","","1.074","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008964","5.6779","0.001","6.3017","0.0011","20.48","0.003","88.37","0.011","86.483","0.007","70.162","0.011","688","0.2","134","2","134","2","","","","","","","","3","P -1","-P 1","2","","(±)-(3'aα,3'bα,6'aα,7'aα)-octahydro-5,5-dimethyl-spiro[1,3-dioxane- 2,5'(2'H)pentaleno[2,1-b]furan]-2'-one","","- C15 H22 O4 -","- C15 H22 O4 -","- C30 H44 O8 -","2","1","QA0163","Bats, Jan W.; Öhlinger, Stefan H.; Mulzer, Johann","(±)-(3'aα,3'bα,6'aα,7'aα)- and (±)-(3'aα,3'bβ,6'aβ,7'aα)-2,3,3a,3b,4,5,6,6a,7,7a-decahydro-5,5-dimethylspiro[1,3-dioxane-2,5'-pentaleno[2,1-<i>b</i>]furan]-2'-one","Acta Crystallographica Section C","1999","55","9","IUC9900111","","10.1107/S0108270199098807","","","0.71073","MoKα","","0.045","0.039","","","","0.125","","","","","","1.557","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008965","6.6228","0.0015","21.651","0.003","9.5738","0.0012","90","","100.106","0.014","90","","1351.5","0.4","135","2","135","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(±)-(3'aα,3'bβ,6'aβ,7'aα)-octahydro-5,5-dimethyl-spiro[1,3-dioxane- 2,5'(2'H)pentaleno[2,1-b]furan]-2'-one","","- C15 H22 O4 -","- C15 H22 O4 -","- C60 H88 O16 -","4","1","QA0163","Bats, Jan W.; Öhlinger, Stefan H.; Mulzer, Johann","(±)-(3'aα,3'bα,6'aα,7'aα)- and (±)-(3'aα,3'bβ,6'aβ,7'aα)-2,3,3a,3b,4,5,6,6a,7,7a-decahydro-5,5-dimethylspiro[1,3-dioxane-2,5'-pentaleno[2,1-<i>b</i>]furan]-2'-one","Acta Crystallographica Section C","1999","55","9","IUC9900111","","10.1107/S0108270199098807","","","0.71073","MoKα","","0.081","0.05","","","","0.127","","","","","","1.289","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008966","4.7711","0.0007","12.4592","0.001","14.9907","0.0013","90","","94.37","0.01","90","","888.52","0.17","295","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 Cl6 Cu N2 O2 -","- C12 H10 Cl6 Cu N2 O2 -","- C24 H20 Cl12 Cu2 N4 O4 -","2","0.5","SK1268","Gökağaç, Gülsün; Tatar, Leyla; Kısakürek, Duygu; Ülkü, Dinçer","Diamminebis(2,4,6-trichlorophenolato)copper(II)","Acta Crystallographica Section C","1999","55","9","1413","1416","10.1107/S0108270199006447","","","0.71073","MoKα","","","0.0314","","","","0.0379","","","","","","1","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008967","14.945","0.002","14.945","0.002","39.572","0.002","90","","90","","90","","8838.5","1.7","293","2","293","2","","","","","","","","3","P 43 21 2","P 4nw 2abw","96","","(2S,3S,9S,10S)-2,3,9,10-Tetraphenyl-1,4,8,11-tetraoxacyclotetradecane-6,13-dione","","- C34 H32 O6 -","- C34 H32 O6 -","- C408 H384 O72 -","12","1.5","SK1289","Choong Eui Song; Yang Hee Kim; Kwan Mook Kim; Dae Yoon Chi; Jong Hwa Jeong","Cocrystallization of two conformers of (2<i>S</i>,3<i>S</i>,9<i>S</i>,10<i>S</i>)-2,3,9,10-tetraphenyl-1,4,8,11-tetraoxacyclotetradecane-6,13-dione","Acta Crystallographica Section C","1999","55","9","1574","1575","10.1107/S0108270199006976","","","0.71073","MoKα","","0.1353","0.0468","","","","0.1496","","","","","","0.999","","","","has coordinates","303290","2025-11-13","08:08:21",""
"2008968","8.6086","0.0003","11.5661","0.0004","14.765","0.0005","90","","91.554","0.001","90","","1469.58","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Phenyl(diisopropylamino)-chlorophosphine sulphide","","- C12 H19 Cl N P S -","- C12 H19 Cl N P S -","- C48 H76 Cl4 N4 P4 S4 -","4","1","SK1290","S.Renganayaki; E.Subramanian; S.Shanmuga Sundara Raj; Hoong-Kun Fun","Chloro(diisopropylamino)(phenyl)phosphine sulfide","Acta Crystallographica Section C","1999","55","9","1525","1526","10.1107/S0108270199006435","","","0.71073","MoKα","","0.1601","0.0619","","","","0.125","","","","","","1","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008969","11.4095","0.0009","12.3701","0.0006","13.1335","0.001","90","","92.864","0.009","90","","1851.3","0.2","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Pyrazole-N^2^)(2,2-dimethyl-N-salicylideneglycinato-O,N,O')copper(II) pyrazole solvate","","- C34 H38 Cu2 N10 O6 -","- C34 H38 Cu2 N10 O6 -","- C68 H76 Cu4 N20 O12 -","2","0.5","SK1292","Elizabeth Hill; Warda, Salam A.","Dimeric (pyrazole-<i>N</i>^2^)(<i>N</i>-salicylidene-2,2-dimethylglycinato-<i>O</i>,<i>N</i>,<i>O</i>')copper(II) pyrazole solvate","Acta Crystallographica Section C","1999","55","9","1431","1434","10.1107/S0108270199006988","","","0.71073","MoKα","","","0.0307","","","","0.0743","","","","","","0.946","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008970","9.6826","0.0011","14.378","0.003","14.797","0.003","63.17","0.06","83.25","0.11","80.17","0.1","1809.3","1.2","100","0.1","100","0.1","","","","","","","","4","P -1","-P 1","2","","3,5-Dihydroxybenzoic acid–4,4'-bipyridine (2/3)","","- C44 H36 N6 O8 -","- C44 H36 N6 O8 -","- C88 H72 N12 O16 -","2","1","SK1293","Wheatley, Paul S.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher","Linking of <i>C</i>^4^~4~(32)[<i>R</i>^4^~4~(30)] chains of rings in the hydrogen-bonded adduct 3,5-dihydroxybenzoic acid–4,4'-bipyridine (2/3) by means of π···π stacking interactions","Acta Crystallographica Section C","1999","55","9","1489","1492","10.1107/S0108270199006319","","","0.71073","MoKα","","0.138","0.056","","","","0.134","","","","","","0.932","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008971","7.839","0.002","5.99","0.001","8.244","0.002","90","","116.88","0.01","90","","345.28","0.14","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C9 H7 N -","- C9 H7 N -","- C18 H14 N2 -","2","0.5","SK1296","Hensen, Karl; Mayr-Stein, Ralf; Bolte, Michael","Isoquinoline","Acta Crystallographica Section C","1999","55","9","1565","1567","10.1107/S0108270199006320","","","0.71073","MoKα","","0.0517","0.047","","","","0.1331","","","","","","1.092","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008972","19.249","0.0006","7.3915","0.0004","12.6587","0.0006","90","","92.554","0.003","90","","1799.28","0.14","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-Hydroxyisophthalic acid–4,4'-trimethylenedipyridine (1/1)","","- C21 H20 N2 O5 -","- C21 H20 N2 O5 -","- C84 H80 N8 O20 -","4","1","SK1297","Wheatley, Paul S.; Lough, Alan J.; Ferguson, George; Glidewell, Christopher","Four interpenetrating three-dimensional frameworks in the hydrogen-bonded structure of 5-hydroxyisophthalic acid–4,4'-trimethylenedipyridine (1/1)","Acta Crystallographica Section C","1999","55","9","1486","1489","10.1107/S0108270199006356","","","0.71073","MoKα","","0.081","0.046","","","","0.116","","","","","","1.025","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008973","7.3437","0.0003","24.6375","0.0008","7.4493","0.0003","90","","93.295","0.001","90","","1345.58","0.09","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis[3-methyl-1-hydroxy-2(1H)-pyridinethioato-O,S]nickel(II)","","- C12 H12 N2 Ni O2 S2 -","- C12 H12 N2 Ni O2 S2 -","- C48 H48 N8 Ni4 O8 S8 -","4","1","SK1298","S. Shanmuga Sundara Raj; Hoong-Kun Fun; De-Zhong Niu; Zai-Sheng Lu; Bai-Wang Sun; Bao-Lin Song; Xiao-Zeng You","Bis[1-hydroxy-3-methylpyridine-2(1<i>H</i>)-thionato-<i>O</i>,<i>S</i>]nickel(II)","Acta Crystallographica Section C","1999","55","9","1410","1411","10.1107/S010827019900699X","","","0.71073","MoKα","","0.062","0.055","","","","0.148","","","","","","1.107","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008974","7.623","0.0001","9.978","0.0001","19.1161","0.0001","90","","99.73","0.001","90","","1433.1","0.03","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Methyl 1-(4-chlorobenzyl)-2-oxa-1-cyclohexanecarboxylate (I)","","- C15 H17 Cl O3 -","- C15 H17 Cl O3 -","- C60 H68 Cl4 O12 -","4","1","SK1299","H. Surya Prakash Rao; S. Rajamathe; S. Shanmuga Sundara Raj; Kandasamy Chinnakali; Ibrahim Abdul Razak; Hoong-Kun Fun","Methyl 1-(4-chlorobenzyl)-2-oxocyclohexane-1-carboxylate and methyl (2<i>RS</i>,4a<i>RS</i>,8a<i>RS</i>)-2-(4-chlorobenzyl)-3-oxoperhydronaphthalene-2-carboxylate","Acta Crystallographica Section C","1999","55","9","1519","1522","10.1107/S0108270199007003","","","0.71073","MoKα","","0.067","0.044","","","","0.119","","","","","","1.01","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008975","11.7762","0.0003","11.8495","0.0004","13.0464","0.0004","90","","102.905","0.001","90","","1774.54","0.09","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Methyl (2R,4aR,8aR)-2-(4-chlorobenzyl)-3-oxoperhydro-2-cyclohexanecarboxylate (II)","","- C19 H23 Cl O3 -","- C19 H23 Cl O3 -","- C76 H92 Cl4 O12 -","4","1","SK1299","H. Surya Prakash Rao; S. Rajamathe; S. Shanmuga Sundara Raj; Kandasamy Chinnakali; Ibrahim Abdul Razak; Hoong-Kun Fun","Methyl 1-(4-chlorobenzyl)-2-oxocyclohexane-1-carboxylate and methyl (2<i>RS</i>,4a<i>RS</i>,8a<i>RS</i>)-2-(4-chlorobenzyl)-3-oxoperhydronaphthalene-2-carboxylate","Acta Crystallographica Section C","1999","55","9","1519","1522","10.1107/S0108270199007003","","","0.71073","MoKα","","0.111","0.054","","","","0.139","","","","","","1.008","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008976","9.4742","0.0002","16.6161","0.0004","10.8918","0.0007","90","","90","","90","","1714.63","0.12","100","2","100","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","Glutathione","γ-L-Glutamyl-L-cysteinyl-glycine","","- C20 H40 N6 O20 S2 -","- C20 H40 N6 O20 S2 -","- C40 H80 N12 O40 S4 -","2","0.5","SX1077","Jelsch, Christian; Didierjean, Claude","The oxidized form of glutathione","Acta Crystallographica Section C","1999","55","9","1538","1540","10.1107/S0108270199007039","","","0.56087","AgKα","","0.04","0.038","","","","0.1","","","","","","1.108","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008977","11.081","0.008","16.103","0.01","22.211","0.014","90","","90.38","0.03","90","","3963","5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Di[Aquo Lithium Di(benzo-15-crown-5)] Tetracopper Hexaiodide","Di[Aquo Lithium Di(benzo-15-crown-5)] Tetracopper Hexaiodide","","- C56 H42 Cu4 I6 Li2 O22 -","- C56 H84 Cu4 I6 Li2 O22 -","- C112 H168 Cu8 I12 Li4 O44 -","2","0.5","SX1087","Aliya Nurtaeva; Elizabeth M. Holt","Aqua(benzo-15-crown-5)lithium‒hexa-μ-iodotetracopper‒benzo-15-crown-5 (2/1/2), bis[bis(benzo-15-crown-5)caesium] hexa-μ-iodotetracopper and μ-aqua-bis[aqua(18-crown-6)sodium] hexa-μ-iodotetracopper","Acta Crystallographica Section C","1999","55","9","1453","1457","10.1107/S0108270199007040","","","0.71073","MoKα","","0.212","0.073","","","","0.197","","","","","","0.972","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008978","10.896","0.004","16.277","0.005","22.638","0.007","90","","91.37","0.02","90","","4014","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Di[ Cesium di(benzo-15-crown-5)] Tetracopper Hexaiodide","Di[Cesium di(benzo-15-crown-5)] Tetracopper Hexaiodide","","- C56 H80 Cs2 Cu4 I6 O20 -","- C56 H80 Cs2 Cu4 I6 O20 -","- C112 H160 Cs4 Cu8 I12 O40 -","2","0.5","SX1087","Aliya Nurtaeva; Elizabeth M. Holt","Aqua(benzo-15-crown-5)lithium–hexa-μ-iodotetracopper–benzo-15-crown-5 (2/1/2), bis[bis(benzo-15-crown-5)caesium] hexa-μ-iodotetracopper and μ-aqua-bis[aqua(18-crown-6)sodium] hexa-μ-iodotetracopper","Acta Crystallographica Section C","1999","55","9","1453","1457","10.1107/S0108270199007040","","","0.71073","MoKα","","0.184","0.064","","","","0.181","","","","","","0.96","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008979","11.303","0.002","13.926","0.002","15.268","0.003","90","","96.95","0.01","90","","2385.6","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Sodium(18-crown-6) Dicopper(I) Triiodide 1.5H~2~O","Sodium(18-crown-6) Dicopper(I) Triiodide 1.5H~2~O","","- C24 H54 Cu4 I6 Na2 O15 -","- C24 H52 Cu4 I12 Na2 O15 -","- C48 H104 Cu8 I24 Na4 O30 -","2","0.5","SX1087","Aliya Nurtaeva; Elizabeth M. Holt","Aqua(benzo-15-crown-5)lithium–hexa-μ-iodotetracopper–benzo-15-crown-5 (2/1/2), bis[bis(benzo-15-crown-5)caesium] hexa-μ-iodotetracopper and μ-aqua-bis[aqua(18-crown-6)sodium] hexa-μ-iodotetracopper","Acta Crystallographica Section C","1999","55","9","1453","1457","10.1107/S0108270199007040","","","0.71073","MoKα","","0.155","0.047","","","","0.104","","","","","","0.852","","","","has coordinates","283803","2023-05-16","08:05:52",""
"2008980","10.375","0.002","13.3","0.002","10.314","0.001","106.18","0.01","94.4","0.01","71.86","0.01","1298.8","0.4","297","","297.2","","","","","","","","","5","P -1","-P 1","2","[N,N'-bis(5-methoxysalicylidene)-1,2-diphenyl-1,2-ethenediamine]oxovanadium","","","- C30 H24 N2 O5 V -","- C30 H24 N2 O5 V -","- C60 H48 N4 O10 V2 -","2","1","TA1233","Hoshina, Gakuse; Ohba, Shigeru; Tsuchimoto, Masanobu","[<i>N</i>,<i>N</i>'-Bis(5-methoxysalicylidene)-1,2-diphenyl-1,2-ethenediamine]oxovanadium(IV)","Acta Crystallographica Section C","1999","55","9","1451","1453","10.1107/S0108270199006551","","","0.71073","MoKα","","","0.053","","","","0.071","","","","","","1.1","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008981","7.292","0.002","14.454","0.004","9.643","0.003","90","","96.673","0.003","90","","1009.5","0.5","158","2","158","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H12 Cl2 N2 O8 -","- C3 H12 Cl2 N2 O8 -","- C12 H48 Cl8 N8 O32 -","4","1","TA1239","Brooker, Sally; de Geest, Duncan J.","Propane-1,3-diammonium diperchlorate","Acta Crystallographica Section C","1999","55","9","1589","1591","10.1107/S0108270199007246","","","0.71073","MoKα","","0.037","0.032","","","","0.082","","","","","","1.027","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008982","7.7051","0.0002","14.8671","0.0003","22.2079","0.0005","90","","90","","90","","2543.97","0.1","203","2","203","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Tricarbonyl{(R)-methyl 2,3-di-O-methyl-4,6-O-[(1S,3R)-(η^6^-3-trimethylsilyl phenyl)methylene]-α-D-glucopyranoside}chromium(0).","","- C22 H30 Cr O9 Si -","- C22 H30 Cr O9 Si -","- C88 H120 Cr4 O36 Si4 -","4","1","TA1240","Rickard, Clifton E. F.; Singh, Yogendra; Woodgate, Paul D.; Zhao, Zhongde","Tricarbonylchromium complexes of four methyl 4,6-<i>O</i>-[(η^6^-phenyl)alkylidene]-α-<small>D</small>-glucopyranosides","Acta Crystallographica Section C","1999","55","9","1475","1479","10.1107/S0108270199007313","","","0.71073","MoKα","","0.063","0.044","","","","0.091","","","","","","1.095","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008983","11.7885","0.0002","14.5002","0.0003","15.3639","0.0002","90","","90","","90","","2626.24","0.08","203","2","203","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Tricarbonyl{(R)-methyl 2,3-di-O-methyl-4,6-O-[(1S,2R)-(η^6^-2-trimethylsilyl phenyl)methylene]-α-D-glucopyranoside}chromium(0).","","- C22 H30 Cr O9 Si -","- C22 H30 Cr O9 Si -","- C88 H120 Cr4 O36 Si4 -","4","1","TA1240","Rickard, Clifton E. F.; Singh, Yogendra; Woodgate, Paul D.; Zhao, Zhongde","Tricarbonylchromium complexes of four methyl 4,6-<i>O</i>-[(η^6^-phenyl)alkylidene]-α-<small>D</small>-glucopyranosides","Acta Crystallographica Section C","1999","55","9","1475","1479","10.1107/S0108270199007313","","","0.71073","MoKα","","0.041","0.036","","","","0.093","","","","","","1.026","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008984","7.7593","0.0001","27.9746","0.0003","10.2064","0.0001","90","","101.65","","90","","2169.8","0.04","203","2","203","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Tricarbonyl{(R)-methyl 2,3-O-(1-methylethylidene)-4,6-O-[(η^6^- phenyl)methylene]-α-D-glucopyranoside}chromium(0).","","- C20 H22 Cr O9 -","- C20 H22 Cr O9 -","- C80 H88 Cr4 O36 -","4","2","TA1240","Rickard, Clifton E. F.; Singh, Yogendra; Woodgate, Paul D.; Zhao, Zhongde","Tricarbonylchromium complexes of four methyl 4,6-<i>O</i>-[(η^6^-phenyl)alkylidene]-α-<small>D</small>-glucopyranosides","Acta Crystallographica Section C","1999","55","9","1475","1479","10.1107/S0108270199007313","","","0.71073","MoKα","","0.041","0.035","","","","0.084","","","","","","1.035","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008985","7.6488","0.0001","13.3096","0.0003","11.1206","0.0002","90","","100.08","","90","","1114.63","0.04","203","2","203","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Tricarbonyl{(S)-methyl 2,3-di-O-methyl-4,6-O-[(η^6^- 1-phenyl)ethylene]-α-D-glucopyranoside}chromium(0).","","- C20 H24 Cr O9 -","- C20 H24 Cr O9 -","- C40 H48 Cr2 O18 -","2","1","TA1240","Rickard, Clifton E. F.; Singh, Yogendra; Woodgate, Paul D.; Zhao, Zhongde","Tricarbonylchromium complexes of four methyl 4,6-<i>O</i>-[(η^6^-phenyl)alkylidene]-α-<small>D</small>-glucopyranosides","Acta Crystallographica Section C","1999","55","9","1475","1479","10.1107/S0108270199007313","","","0.71073","MoKα","","0.033","0.031","","","","0.087","","","","","","1.059","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008986","4.783","0.0001","7.5624","0.0002","8.569","0.0002","108.231","0.001","97.384","0.001","105.236","0.001","276.431","0.012","295","","","","","","","","","","","5","P -1","-P 1","2","","barium gallium hydrogen diphosphate (2/1/1/2)","","- Ba2 Ga H O14 P4 -","- Ba2 Ga H O14 P4 -","- Ba2 Ga H O14 P4 -","1","0.5","TA1242","Kuei-Fang Hsu; Sue-Lein Wang","Ba~2~GaH(P~2~O~7~)~2~","Acta Crystallographica Section C","1999","55","9","1400","1401","10.1107/S0108270199007568","","","0.71073","MoKα","","","0.018","","","","0.047","","","","","","1.14","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008987","11.4782","0.0001","17.9393","0.0003","23.3995","0.0002","90","","101.006","0.001","90","","4729.59","0.1","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C53 H46 Cl2 O6 P2 Pt -","- C53 H46 Cl2 O6 P2 Pt -","- C212 H184 Cl8 O24 P8 Pt4 -","4","1","TA1245","Henderson, William; Oliver, Allen G.","<i>cis</i>-Bis(phenoxyacetato-<i>O</i>)bis(triphenylphosphine-<i>P</i>)platinum(II) dichloromethane solvate","Acta Crystallographica Section C","1999","55","9","1408","1410","10.1107/S010827019900757X","","","0.71073","MoKα","","0.074","0.048","","","","0.119","","","","","","1.065","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008988","9.346","0.001","9.516","0.001","15.031","0.001","96.62","0.01","103.76","0.01","102.92","0.01","1245.4","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","tetrakis(μ-6-chloropyridin-2-olato)-1κ^4^O,2κ^4^N- methoxy-1κO-diruthenium(II,III)(Ru—Ru)","","- C21 H15 Cl4 N4 O5 Ru2 -","- C21 H15 Cl4 N4 O5 Ru2 -","- C42 H30 Cl8 N8 O10 Ru4 -","2","1","TA1246","Youm, Kyoung-Tae; Kim, Youngmee; Jun, Moo-Jin","Tetrakis(μ-6-chloropyridin-2-olato)methoxydiruthenium(II, III)","Acta Crystallographica Section C","1999","55","9","1483","1485","10.1107/S0108270199006563","","","0.71073","MoKα","","0.031","0.028","","","","0.08","","","","","","1.132","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008989","25.1766","0.001","6.6867","0.0003","19.3304","0.0007","90","","113.807","0.003","90","","2977.3","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,10-dihydro-1,10-phenanthrolinium iodinium-dichlorido chloride.","","- C12 H10 Cl3 I N2 -","- C12 H10 Cl3 I N2 -","- C96 H80 Cl24 I8 N16 -","8","1","TA1249","Wang, Zhe-Ming; Wang, Yan-Qia; Liao, Chun-Sheng; Yan, Chun-Hua","1,10-Phenanthrolinium(2+) dichloroiodide(1 –) chloride","Acta Crystallographica Section C","1999","55","9","1506","1508","10.1107/S0108270199007775","","","0.71073","MoKα","","0.042","0.031","","","","0.074","","","","","","1.085","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008990","10.961","0.002","11.775","0.002","10.452","0.002","112.6","0.03","108.47","0.03","65.02","0.03","1109.5","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","[1,2,4]oxadiazolo[4,5-a][1,5]benzodiazepine","1,3a,5-triphenyl-3a,4,5,6-tetrahydro-[1,2,4]oxadiazolo[4,5-a] [1,5]benzodiazepine","","- C28 H23 N3 O -","- C28 H23 N3 O -","- C56 H46 N6 O2 -","2","1","TA1252","Xu, Jiaxi; Jin, Sheng","1,3a,5-Triphenyl-3a,4,5,6-tetrahydro-1,2,4-oxadiazolo[4,5-<i>a</i>][1,5]benzodiazepine","Acta Crystallographica Section C","1999","55","9","1579","1581","10.1107/S0108270199006575","","","0.71073","MoKα","","0.088","0.043","","","","0.134","","","","","","0.941","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008991","11.375","0.003","10.438","0.003","12.577","0.004","90","","115.8","0.02","90","","1344.4","0.7","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H33 N3 O6 -","- C24 H33 N3 O6 -","- C48 H66 N6 O12 -","2","1","VJ1099","Banumathi, S.; Velmurugan, D.; Ravikumar, K.; Vijayalakshmi, S.; Balaji Rao, R.; Balaram, P.","Methyl 1-(<i>tert</i>-butoxycarbonyl-<small>L</small>-alanyl-<small>L</small>-leucylamino)cyclooctane-1-carboxylate","Acta Crystallographica Section C","1999","55","9","1575","1577","10.1107/S0108270199005260","","","0.71073","MoKα","","0.0753","0.0684","","0.1937","","0.1861","","","","","","1.091","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008992","12.5262","0.0009","12.8058","0.0007","10.2263","0.0005","100.762","0.004","110.156","0.003","110.603","0.004","1349.99","0.16","200","","200","","","","","","","","","4","P -1","-P 1","2","","","","- C34 H28 N2 O6 -","- C34 H28 N2 O6 -","- C68 H56 N4 O12 -","2","1","BK1438","Bruce Taylor; Patrick J. Carroll; Madeleine M. Joullié","Novel compounds from 1,2-indanedione and 3,5-dimethoxyaniline","Acta Crystallographica Section C","1999","55","10","1733","1736","10.1107/S0108270199004060","","","0.71069","MoKα","","0.073","0.061","","","","0.139","","","","","","1.14","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008993","7.9574","0.0001","19.4192","0.0003","24.2174","0.0004","90","","91.406","0.002","90","","3741.1","0.1","200","","200","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C44 H36 Cl2 N2 O7 -","- C44 H36 Cl2 N2 O7 -","- C176 H144 Cl8 N8 O28 -","4","2","BK1438","Bruce Taylor; Patrick J. Carroll; Madeleine M. Joullié","Novel compounds from 1,2-indanedione and 3,5-dimethoxyaniline","Acta Crystallographica Section C","1999","55","10","1733","1736","10.1107/S0108270199004060","","","0.71069","MoKα","","0.068","0.062","","","","0.161","","","","","","1.07","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008994","4.659","0.001","25.117","0.002","7.758","0.001","90","","105.51","0.01","90","","874.8","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","Methyl β-lactoside","Methyl 4-O-β-D-galactopyranosyl-β-D-glucopyranoside","","- C14 H28 O12 -","- C14 H28 O12 -","- C28 H56 O24 -","2","1","BK1465","Stenutz, Roland; Shang, Maoyu; Serianni, Anthony S.","Methyl β-lactoside (methyl 4-<i>O</i>-β-<small>D</small>-galactopyranosyl-β-<small>D</small>-glucopyranoside) methanol solvate","Acta Crystallographica Section C","1999","55","10","1719","1721","10.1107/S0108270199007994","","","0.71073","MoKα","","0.0309","0.0301","","0.0791","0.0781","","","","1.124","1.129","1.129","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2008995","10.087","0.001","12.454","0.002","14.177","0.003","90","","90","","90","","1781","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","8-Isopropyl-7,10-dimethoxy-3-phenyl-1-oxa-2,6,9-triaza-spiro[4.5]deca- 2,6,9-triene","","- C17 H21 N3 O3 -","- C17 H21 N3 O3 -","- C68 H84 N12 O12 -","4","1","BM1299","Nieger, Martin; Bolte, Michael","8-Isopropyl-7,10-dimethoxy-3-phenyl-1-oxa-2,6,9-triazaspiro[4.5]deca-2,6,9-triene","Acta Crystallographica Section C","1999","55","10","1666","1667","10.1107/S0108270198015923","","","0.71069","MoKα","","0.1","0.056","","","","0.117","","","","","","1.005","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2008996","14.8435","0.0003","14.8573","0.0002","18.9784","0.0004","107.983","0.001","96.779","0.001","103.117","0.001","3796.28","0.13","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C154 H128 La2 N8 Ni O22 P8 S4 -","- C154 H128 La2 N8 Ni O22 P8 S4 -","- C154 H128 La2 N8 Ni O22 P8 S4 -","1","0.5","BM1312","De-Liang Long; Huai-Min Hu; Jiu-Tong Chen; Jin-Shun Huang","[La(NO~3~)~2~(Ph~3~PO)~4~]~2~[Ni(C~4~N~2~S~2~)~2~]^.^2CH~3~OH","Acta Crystallographica Section C","1999","55","10","1662","1664","10.1107/S0108270199006629","","","0.71073","MoKα","","0.052","0.035","","","","0.085","","","","","","0.971","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2008997","13.336","0.003","13.837","0.003","16.059","0.004","90","","98.51","0.02","90","","2930.7","1.2","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(4-(N-pyridiniummethyl)-1,3-dioxolane)-2-spiro-1',2',4',6' -trinitrocyclohexadienide","","- C14 H12 N4 O8 -","- C14 H12 N4 O8 -","- C112 H96 N32 O64 -","8","1","BM1329","Borbulevych, Oleg Ya.; Shishkin, Oleg V.; Knyazev, Victor N.","A zwitterionic Meisenheimer complex of 2,4,6-trinitrobenzene","Acta Crystallographica Section C","1999","55","10","1704","1706","10.1107/S0108270199006083","","","0.71073","MoKα","","0.0715","0.0442","","0.1408","","0.118","","","0.991","","","1.103","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2008998","6.5401","0.0012","14.0889","0.0018","8.1843","0.0012","90","","99.753","0.012","90","","743.2","0.2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis(imidazolidine-2-thione)gold(I) diiodoaurate(I)","","- C6 H12 Au2 I2 N4 S2 -","- C6 H12 Au2 I2 N4 S2 -","- C12 H24 Au4 I4 N8 S4 -","2","0.5","BM1346","Friedrichs, Steffi; Jones, Peter G.","Bis(imidazolidine-2-thione)gold(I) diiodoaurate(I)","Acta Crystallographica Section C","1999","55","10","1625","1627","10.1107/S0108270199008148","","","0.71073","MoKα","","0.04","0.024","","","","0.05","","","","","","0.914","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2008999","7.3471","0.001","7.933","0.0012","13.663","0.0016","90","","104.662","0.008","90","","770.41","0.18","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Chloro-6-hydroxypyridinium Chloride Hydrate","","- C5 H7 Cl2 N O2 -","- C5 H7 Cl2 N O2 -","- C20 H28 Cl8 N4 O8 -","4","1","BM1350","Freytag, Matthias; Jones, Peter G.","2-Chloro-6-hydroxypyridinium chloride hydrate","Acta Crystallographica Section C","1999","55","10","1682","1685","10.1107/S0108270199008045","","","0.71073","MoKα","","0.046","0.028","","","","0.065","","","","","","0.885","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009000","12.321","0.009","12.321","0.009","12.321","0.009","90","","90","","90","","1870","2","300","2","300","2","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","Garnet","","","- Ca3 Fe2 Ge3 O12 -","- Ca3 Fe2 Ge3 O12 -","- Ca24 Fe16 Ge24 O96 -","8","0.0833333","BR1247","Lévy, David; Barbier, Jacques","Normal and inverse garnets: Ca~3~Fe~2~Ge~3~O~12~, Ca~3~Y~2~Ge~3~O~12~ and Mg~3~Y~2~Ge~3~O~12~","Acta Crystallographica Section C","1999","55","10","1611","1614","10.1107/S0108270199007854","","","0.71073","MoKα","","0.044","0.03","","","","0.068","","","","","","1.253","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009001","12.8059","0.0008","12.8059","0.0008","12.8059","0.0008","90","","90","","90","","2100.1","0.2","299","2","299","2","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","Garnet","","","- Ca3 Ge3 O12 Y2 -","- Ca3 Ge3 O12 Y2 -","- Ca24 Ge24 O96 Y16 -","8","0.0833333","BR1247","Lévy, David; Barbier, Jacques","Normal and inverse garnets: Ca~3~Fe~2~Ge~3~O~12~, Ca~3~Y~2~Ge~3~O~12~ and Mg~3~Y~2~Ge~3~O~12~","Acta Crystallographica Section C","1999","55","10","1611","1614","10.1107/S0108270199007854","","","0.71073","MoKα","","0.05","0.031","","","","0.087","","","","","","1.179","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009002","12.2489","0.0012","12.2489","0.0012","12.2489","0.0012","90","","90","","90","","1837.8","0.3","299","2","299","2","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","Garnet","","","- Ge3 Mg3 O12 Y2 -","- Ge3 Mg2.99 O12 Y2.01 -","- Ge24 Mg23.92 O96 Y16.08 -","8","0.0833333","BR1247","Lévy, David; Barbier, Jacques","Normal and inverse garnets: Ca~3~Fe~2~Ge~3~O~12~, Ca~3~Y~2~Ge~3~O~12~ and Mg~3~Y~2~Ge~3~O~12~","Acta Crystallographica Section C","1999","55","10","1611","1614","10.1107/S0108270199007854","","","0.71073","MoKα","","0.058","0.032","","","","0.075","","","","","","1.187","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009003","9.7378","0.0005","14.9883","0.0007","15.4828","0.001","90","","100.244","0.005","90","","2223.7","0.2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Dichloro[(cyclopentadienyl)tris(dimethylphosphito-P) cobalt-O,O',O'']oxomolybdenum(V)","","- C11 H23 Cl2 Co Mo O10 P3 -","- C11 H23 Cl2 Co Mo O10 P3 -","- C44 H92 Cl8 Co4 Mo4 O40 P12 -","4","1","CF1313","Roh, Soo-Gyun; Jeong, Jong Hwa","Dichloro[(cyclopentadienyl)tris(dimethylphosphito-<i>P</i>)cobalt(III)-<i>O</i>,<i>O</i>',<i>O</i>'']oxomolybdenum(V)","Acta Crystallographica Section C","1999","55","10","1658","1660","10.1107/S0108270199008781","","","0.71073","MoKα","","0.046","0.039","","","","0.108","","","","","","1.08","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2009004","21.148","0.002","5.16","0.002","4.94","0.001","90","","96.69","0.01","90","","535.4","0.2","298.2","","298.2","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","1,10-decanediol","","","- C10 H22 O2 -","- C10 H22 O2 -","- C20 H44 O4 -","2","0.5","CF1316","Nakamura, Naotake; Sato, Taketoshi","1,10-Decanediol","Acta Crystallographica Section C","1999","55","10","1685","1687","10.1107/S0108270199008318","","","1.5418","CuKα","","0.0607","0.0391","","0.0731","","0.0626","","","1.359","","","1.399","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009005","8.6829","0.0013","10.751","0.0016","14.42","0.002","88.617","0.013","80.841","0.011","73.689","0.011","1275.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dibromo[1,3-propanediylbis(diphenylphosphine)-P,P']palladium(II)","","- C27 H26 Br2 P2 Pd -","- C27 H26 Br2 P2 Pd -","- C54 H52 Br4 P4 Pd2 -","2","1","CF1318","José M. Vila; Juan M. Ortigueira; Margarita López; Jesus J. Fernández; Alberto Fernández","Dibromo[propane-1,3-diylbis(diphenylphosphine)-<i>P</i>,<i>P</i>']palladium(II)","Acta Crystallographica Section C","1999","55","10","1646","1647","10.1107/S0108270199008306","","","0.71073","MoKα","","0.137","0.039","","","","0.095","","","","","","0.985","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009006","12.1685","0.0019","13.724","0.002","13.315","0.003","90","","114.792","0.009","90","","2018.7","0.6","220","0.2","220","0.2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","7-Phenyl-1,2,3,4,-tetrahydro-1,4-diazepin-5-one","","- C11 H12 N2 O -","- C11 H12 N2 O -","- C88 H96 N16 O8 -","8","1","CF1321","Clark, Bernard A. J.; Evans, Matthew C.; Lloyd, Douglas; McNab, Hamish; Parsons, Simon","7-Phenyl-2,3,4,5-tetrahydro-1<i>H</i>-1,4-diazepin-5-one","Acta Crystallographica Section C","1999","55","10","1725","1727","10.1107/S010827019900832X","","","0.71073","MoKα","","0.047","0.034","","","","0.089","","","","","","1.048","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009007","10.58","0.01","16.1","0.02","13.954","0.01","90","","100.97","0.01","90","","2333","4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,3-diphenyl- 4-(P-Me-phenyl)- spiro pyrazoline [ 5.2']-1'tetralone.","","- C31 H26 N2 O -","- C31 H26 N2 O -","- C124 H104 N8 O4 -","4","1","FG1522","R. Krishna; D. Velmurugan; R. Murugesan; M. Shanmuga Sundaram; R. Raghunathan","1',2',3',4'-Tetrahydro-1,3-diphenyl-4-<i>p</i>-tolylspiro[2-pyrazoline-5,2'-naphthalen]-1'-one","Acta Crystallographica Section C","1999","55","10","1676","1677","10.1107/S0108270199007283","","","1.54178","CuKα","","0.0851","0.0632","","","","0.1648","","","","","","1.099","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009008","8.626","0.002","6.5402","0.0012","14.524","0.004","90","","100.21","0.03","90","","806.4","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","4-O-benzyl-2,3-O-isopropylidene-α-L-rhamnopyranose","","- C16 H22 O5 -","- C16 H22 O5 -","- C32 H44 O10 -","2","1","FG1535","Eriksson, Lars; Söderman, Peter; Widmalm, Göran","4-<i>O</i>-Benzyl-2,3-<i>O</i>-isopropylidene-α-<small>L</small>-rhamnopyranose","Acta Crystallographica Section C","1999","55","10","1736","1738","10.1107/S0108270199008203","","","0.71073","MoKα","","0.201","0.065","","0.112","","0.081","","","0.715","","","0.715","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009009","9.7491","0.0006","10.0291","0.0006","11.1681","0.0005","85.297","0.004","71.869","0.004","61.3013","0.0018","907.28","0.09","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","bis((μ^2^-Isopropoxo)-di-isopropoxy-4-Methylphenylimido-vanadium(v))","","- C32 H56 N2 O6 V2 -","- C32 H56 N2 O6 V2 -","- C32 H56 N2 O6 V2 -","1","0.5","FG1541","Lutz, Martin; Hagen, Henk; Schreurs, Antoine M.M.; Spek, Anthony L.; van Koten, Gerard","The twinned structure of the μ-isopropoxidodiisopropoxido(<i>p</i>-tolylimido)vanadium(V) dimer, twin refinement against CCD area-detector data","Acta Crystallographica Section C","1999","55","10","1636","1639","10.1107/S0108270199003728","","","0.71073","MoKα","","0.085","0.07","","","","0.174","","","","","","1.186","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009010","8.1819","0.0006","8.3833","0.0006","8.4079","0.0006","106.244","0.001","94.879","0.001","109.663","0.001","511.06","0.06","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","Trans-dioxobis(N,N-diethylethylenediamine-N,N')rhenium(V)chloride hydrate (1/3)","","- C12 H38 Cl N4 O5 Re -","- C12 H32 Cl N4 O5 Re -","- C12 H32 Cl N4 O5 Re -","1","0.5","FG1544","Engelbrecht, Hendrik P.; Otto, Stefanus; Roodt, Andreas","<i>trans</i>-Bis(<i>N</i>,<i>N</i>-diethylethylenediamine-<i>N</i>,<i>N</i>')dioxorhenium(V) chloride trihydrate","Acta Crystallographica Section C","1999","55","10","1648","1650","10.1107/S0108270199007507","","","0.71073","MoKα","","0.0188","0.0188","","","","0.0489","","","","","","1.058","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009011","7.105","0.003","8.69","0.003","5.777","0.002","90.65","0.03","106.53","0.03","105.69","0.03","327.7","0.2","173","1","173","1","","","","","","","","5","P -1","-P 1","2","","(E)-N-methyl-1-(methylthio)-2-nitroethenylamine","","- C4 H8 N2 O2 S -","- C4 H8 N2 O2 S -","- C8 H16 N4 O4 S2 -","2","1","FG1546","Linden, Anthony; Moya Argilagos, Dally; Heimgartner, Heinz; García Trimiño, María I.; Macías Cabrera, Arturo","`Push–pull' effects in nitroethenamines","Acta Crystallographica Section C","1999","55","10","1692","1698","10.1107/S0108270199006861","","","0.71069","MoKα","","0.043","0.036","","","","0.108","","","","","","1.208","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009012","11.7761","0.0016","17.172","0.002","6.825","0.004","90","","90","","90","","1380.1","0.8","173","1","173","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-benzoyl-3,3-bis(methylamino)-2-nitrothioacrylamide","","- C12 H14 N4 O3 S -","- C12 H14 N4 O3 S -","- C48 H56 N16 O12 S4 -","4","1","FG1546","Linden, Anthony; Moya Argilagos, Dally; Heimgartner, Heinz; García Trimiño, María I.; Macías Cabrera, Arturo","`Push‒pull' effects in nitroethenamines","Acta Crystallographica Section C","1999","55","10","1692","1698","10.1107/S0108270199006861","","","0.71069","MoKα","","0.05","0.033","","","","0.09","","","","","","1.089","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2009013","11.9391","0.0008","14.4523","0.0013","10.7398","0.0009","90","","108.93","0.005","90","","1752.9","0.3","173","1","173","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-cinnamoyl-3,3-bis(dimethylamino)-2-nitrothioacrylamide","","- C16 H20 N4 O3 S -","- C16 H20 N4 O3 S -","- C64 H80 N16 O12 S4 -","4","1","FG1546","Linden, Anthony; Moya Argilagos, Dally; Heimgartner, Heinz; García Trimiño, María I.; Macías Cabrera, Arturo","`Push‒pull' effects in nitroethenamines","Acta Crystallographica Section C","1999","55","10","1692","1698","10.1107/S0108270199006861","","","0.71069","MoKα","","0.12","0.051","","","","0.14","","","","","","1.01","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2009014","11.922","0.003","17.628","0.003","10.442","0.003","90","","90","","90","","2194.5","0.9","173","1","173","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","S-methyl N-benzoyl-3-(N-methyl-N-phenylamino)-2-nitro-3- (phenylamino)thioacrylimidate","","- C24 H22 N4 O3 S -","- C24 H22 N4 O3 S -","- C96 H88 N16 O12 S4 -","4","1","FG1546","Linden, Anthony; Moya Argilagos, Dally; Heimgartner, Heinz; García Trimiño, María I.; Macías Cabrera, Arturo","`Push‒pull' effects in nitroethenamines","Acta Crystallographica Section C","1999","55","10","1692","1698","10.1107/S0108270199006861","","","0.71069","MoKα","","0.05","0.035","","","","0.085","","","","","","1.023","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2009015","12.82","0.001","5.787","0.001","14.817","0.002","90","","107.93","0.02","90","","1045.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 F N O -","- C13 H10 F N O -","- C52 H40 F4 N4 O4 -","4","1","FG1547","Burgess, John; Fawcett, John; Russell, David R.; Gilani, Syeda R.; Palma, Vitor","Four <i>N</i>-(2-hydroxybenzylidene)aniline derivatives","Acta Crystallographica Section C","1999","55","10","1707","1710","10.1107/S0108270199008239","","","0.71073","MoKα","","0.0551","0.0374","","0.1099","","0.0961","","","1.003","","","1.033","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009016","5.647","0.001","7.977","0.002","29.197","0.004","90","","90.63","0.02","90","","1315.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 F3 N O2 -","- C14 H10 F3 N O2 -","- C56 H40 F12 N4 O8 -","4","1","FG1547","Burgess, John; Fawcett, John; Russell, David R.; Gilani, Syeda R.; Palma, Vitor","Four <i>N</i>-(2-hydroxybenzylidene)aniline derivatives","Acta Crystallographica Section C","1999","55","10","1707","1710","10.1107/S0108270199008239","","","0.71073","MoKα","","0.1241","0.069","","0.2369","","0.189","","","1.036","","","1.154","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009017","27.419","0.007","6.901","0.002","6.137","0.001","90","","95.57","0.02","90","","1155.8","0.5","190","2","190","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H9 Cl2 N O -","- C13 H9 Cl2 N O -","- C52 H36 Cl8 N4 O4 -","4","1","FG1547","Burgess, John; Fawcett, John; Russell, David R.; Gilani, Syeda R.; Palma, Vitor","Four <i>N</i>-(2-hydroxybenzylidene)aniline derivatives","Acta Crystallographica Section C","1999","55","10","1707","1710","10.1107/S0108270199008239","","","0.71073","MoKα","","0.0394","0.034","","0.095","","0.0905","","","1.117","","","1.129","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009018","12.413","0.002","5.744","0.002","15.597","0.003","90","","97.69","0.02","90","","1102.1","0.5","190","2","190","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H10 N2 O3 -","- C13 H10 N2 O3 -","- C52 H40 N8 O12 -","4","1","FG1547","Burgess, John; Fawcett, John; Russell, David R.; Gilani, Syeda R.; Palma, Vitor","Four <i>N</i>-(2-hydroxybenzylidene)aniline derivatives","Acta Crystallographica Section C","1999","55","10","1707","1710","10.1107/S0108270199008239","","","0.71073","MoKα","","0.0693","0.0481","","0.1493","","0.1244","","","0.866","","","0.849","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009019","6.597","0.001","11.468","0.001","11.103","0.001","90","","91.9","0.01","90","","839.53","0.17","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","(+)-3-Oxoandrosta-1,4-diene-17β-carboxylic Acid","","- C20 H26 O3 -","- C20 H26 O3 -","- C40 H52 O6 -","2","1","FG1554","Thompson, Hugh W.; Lalancette, Roger A.; Brunskill, Andrew P. J.","(+)-3-Oxoandrosta-1,4-diene-17β-carboxylic acid: catemeric hydrogen bonding in a steroidal keto acid","Acta Crystallographica Section C","1999","55","10","1680","1682","10.1107/S0108270199007519","","","0.71073","MoKα","","0.09","0.05","","","","0.099","","","","","","1.02","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009020","8.885","0.003","10.2996","0.0019","8.5543","0.0015","111.952","0.011","98.61","0.03","103.04","0.03","683.2","0.3","296","","296","","","","","","","","","5","P -1","-P 1","2","","1,2-Dihydro-1,6-dihydroxy-2-(2-methoxy-6-pyridyl)-2,3,1-benzodiazaborine","","- C13 H14 B N3 O4 -","- C13 H14 B N3 O4 -","- C26 H28 B2 N6 O8 -","2","1","FG1557","Robinson, Paul D.; Groziak, Michael P.","A boron-containing estrogen mimic","Acta Crystallographica Section C","1999","55","10","1701","1704","10.1107/S0108270199007520","","","0.71069","MoKα","","0.067","0.036","","","","0.118","","","","","","1.029","","","","has coordinates,has disorder","301791","2025-08-18","23:15:33",""
"2009021","7.6535","0.0009","10.8255","0.001","7.4067","0.0009","92.436","0.01","117.023","0.008","81.61","0.009","540.62","0.11","296","","296","","","","","","","","","4","P -1","-P 1","2","","6,7,8,9-Tetrahydro-3-methyl-1H-pyrano[4,3-b]quinoline-1-one","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C26 H26 N2 O4 -","2","1","FG1560","Hua, Duy H.; Chen, Yi; Sin, Hong-Sig; Robinson, Paul D.; Meyers, Cal Y.; Perchellet, Elisabeth M.; Perchellet, Jean-Pierre; Chiang, Peter K.; Biellmann, Jean-Francois","6,7,8,9-Tetrahydro-3-methyl-1<i>H</i>-pyrano[4,3-<i>b</i>]quinolin-1-one","Acta Crystallographica Section C","1999","55","10","1698","1701","10.1107/S0108270199007301","","","0.71069","MoKα","","0.125","0.038","","","","0.127","","","","","","1.02","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009022","15.4891","0.0014","12.2319","0.0009","18.2654","0.0018","90","","97.694","0.007","90","","3429.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H44 Cd N6 O6 S4 -","- C24 H44 Cd N6 O6 S4 -","- C96 H176 Cd4 N24 O24 S16 -","4","1","FR1179","Bernès, Sylvain; Aguilar, Julio César; Rodríguez de San Miguel Guerrero, Eduardo; Nuñez Gaytán, María Elena; De Gyves, Josefina","Complexation of ω-thiocaprolactam with heavy metals: terminal and bridging coordination modes in cadmium and silver compounds","Acta Crystallographica Section C","1999","55","10","1627","1631","10.1107/S0108270199005569","","","0.71073","MoKα","","0.166","0.0672","","","0.1447","0.1903","","","","","","1.016","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2009023","14.3913","0.0014","11.0072","0.0011","22.163","0.002","90","","100.898","0.007","90","","3447.5","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H88 Ag4 N12 O12 S8 -","- C48 H88 Ag4 N12 O12 S8 -","- C96 H176 Ag8 N24 O24 S16 -","2","0.5","FR1179","Bernès, Sylvain; Aguilar, Julio César; Rodríguez de San Miguel Guerrero, Eduardo; Nuñez Gaytán, María Elena; De Gyves, Josefina","Complexation of ω-thiocaprolactam with heavy metals: terminal and bridging coordination modes in cadmium and silver compounds","Acta Crystallographica Section C","1999","55","10","1627","1631","10.1107/S0108270199005569","","","0.71073","MoKα","","0.1097","0.0556","","","0.1084","0.1295","","","","","","1.01","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009024","7.4127","0.0008","10.1982","0.0017","10.8971","0.0011","85.969","0.011","74.899","0.008","78.473","0.012","779.15","0.18","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H18 N2 O -","- C19 H18 N2 O -","- C38 H36 N4 O2 -","2","1","FR1194","Aygün, Muhittin; Işık, Şamil; Turgut, Zuhal; Özbey, Süheyla; Kendi, Engin","4-Ethoxy-<i>N</i>-(6-methylquinolin-2-ylmethylene)aniline","Acta Crystallographica Section C","1999","55","10","1689","1690","10.1107/S0108270199007878","","","0.7107","MoKα","","0.0717","0.0455","","","","0.1158","","","","","","0.933","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009025","10.588","0.001","12.547","0.001","28.989","0.002","90","","90","","90","","3851.1","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(+)-23,24-Dinor-3α,9α-epoxy-11-oxo-5β-cholan-22-oic Acid","","- C22 H32 O4 -","- C22 H32 O4 -","- C176 H256 O32 -","8","2","FR1199","Thompson, Hugh W.; Brunskill, Andrew P. J.; Lalancette, Roger A.","(+)-23,24-Dinor-3α,9α-epoxy-11-oxo-5β-cholan-22-oic acid: mutual carboxyl-to-ether dimeric hydrogen bonding in a steroidal carboxy–keto ether","Acta Crystallographica Section C","1999","55","10","1677","1680","10.1107/S0108270199006411","","","1.5418","CuKα","","0.062","0.051","","","","0.133","","","","","","1.03","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009026","11.138","0.002","18.801","0.004","19.121","0.004","90","","90","","90","","4004","1.4","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","Bis(μ-acetato)-2,6-bis[(2-hydroxybenzyl)(2-pyridylmethyl)aminomethyl)- 4-methylphenolato)-di-indium(III) Nitrate DihydratE","","- C39 H43 In2 N5 O12 -","- C39 H43 In2 N5 O12 -","- C156 H172 In8 N20 O48 -","4","0.5","GD1031","Bortoluzzi, Adailton J.; Neves, Ademir; Vencato, Ivo; Zucco, Cesar; Hörner, Manfredo","Bis(μ-acetato){μ-2,6-bis[(2-hydroxybenzyl)-(2-pyridylmethyl)aminomethyl]-4-methylphenolato}diindium(III) nitrate dihydrate","Acta Crystallographica Section C","1999","55","10","1634","1636","10.1107/S0108270199008252","","","0.71073","MoKα","","0.073","0.036","","","","0.107","","","","","","1.03","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009027","6.8848","0.0008","13.7645","0.001","29.628","0.002","90","0.006","90","0.008","90","0.008","2807.7","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-Formyl-3-hydroxy-18Hβ-olean-2,12-dien-28-oic acid methyl ester","","- C32 H48 O4 -","- C32 H48 O4 -","- C128 H192 O16 -","4","1","JZ1350","Gzella, Andrzej","Triterpenoide. XVI. 2-Formylderivate des Oleanonsäure-methylesters und <i>Allo</i>-betulons","Acta Crystallographica Section C","1999","55","10","1730","1733","10.1107/S0108270199007714","","","1.54178","CuKα","","0.0444","0.0336","","","","0.097","","","","","","1.05","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009028","6.6351","0.0008","12.7178","0.001","15.6807","0.0014","90","0.007","95","0.009","90","0.009","1318.2","0.2","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","2-Formyl-19β,28-epoxy-3-hydroxy-18Hα-olean-2-ene","","- C31 H48 O3 -","- C31 H48 O3 -","- C62 H96 O6 -","2","1","JZ1350","Gzella, Andrzej","Triterpenoide. XVI. 2-Formylderivate des Oleanonsäure-methylesters und <i>Allo</i>-betulons","Acta Crystallographica Section C","1999","55","10","1730","1733","10.1107/S0108270199007714","","","1.54178","CuKα","","0.053","0.0368","","","","0.1097","","","","","","1.049","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009029","8.3779","0.0005","10.7496","0.0008","8.3805","0.0005","90","","101.099","0.006","90","","740.62","0.08","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","(7S)-(7α,7aα,14α,14aβ)-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]diazocin-5-ium bromide","","- C15 H27 Br N2 -","- C15 H27 Br N2 -","- C30 H54 Br2 N4 -","2","1","KA1317","Alessandra Farina; Stefano Valdo Meille; Maria Teresa Messina; Pierangelo Metrangolo; Giuseppe Resnati","(–)-Sparteinium bromide","Acta Crystallographica Section C","1999","55","10","1710","1711","10.1107/S0108270199008185","","","1.54178","CuKα","","0.091","0.079","","","","0.228","","","","","","1.099","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009030","21.432","0.004","8.158","0.001","9.515","0.002","90","","92.95","0.02","90","","1661.4","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H14 Br2 Cu N2 O2 -","- C17 H14 Br2 Cu N2 O2 -","- C68 H56 Br8 Cu4 N8 O8 -","4","0.5","LN1075","Kabak, Mehmet; Elmali, Ayhan; Kavlakoǧlu, Ebru; Elerman, Yalc̨ın; Durlu, T. Nuri","[<i>N</i>,<i>N</i>'-Bis(5-bromosalicylidene)-1,3-diaminopropane]copper(II)","Acta Crystallographica Section C","1999","55","10","1650","1652","10.1107/S0108270199008331","","","0.71069","MoKα","","0.128","0.052","","","","0.154","","","","","","1.16","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009031","11.848","0.002","7.9903","0.0015","18.29","0.007","90","","95.59","0.03","90","","1723.3","0.8","293","3","293","3","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","[Benzoylacetone S-methylisothiosemicarbazonato(2-)]pyridinenickel(II)","","- C17 H18 N4 Ni O S -","- C17 H18 N4 Ni O S -","- C68 H72 N16 Ni4 O4 S4 -","4","1","NA1411","Bogdanović, Goran A.; Spasojević-de Biré, Anne; Leovac, Vukadin M.; Češljević, Valerija I.","Transition metal complexes with thiosemicarbazide-based ligands. XXXIX. [Benzoylacetone 3-methylisothiosemicarbazonato(2 –)-<i>O</i>,<i>N</i>^1^,<i>N</i>^4^](pyridine-<i>N</i>)nickel(II)","Acta Crystallographica Section C","1999","55","10","1656","1658","10.1107/S0108270199004746","","","0.71073","MoKα","","0.077","0.033","","0.101","","0.09","","","1.021","","","1.194","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009032","9.6808","0.0001","11.4468","0.0002","19.8557","0.0001","100.047","0.001","95.804","0.001","90.318","0.001","2154.84","0.05","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","5-amino-4-(4-methoxyphenyl)-2-phenyl-7-(pyrrolidin-1-yl)-1,6-naphthyridine-8-carbonitrile","","- C26 H23 N5 O -","- C26 H23 N5 O -","- C104 H92 N20 O4 -","4","2","NA1423","R.Sankaranarayanan; S.Shanmuga Sundara Raj; D.Velmurugan; Hoong-Kun Fun; V.Raghukumar; V.T.Ramakrishnan","5-Amino-4-(4-methoxyphenyl)-2-phenyl-7-(pyrrolidin-1-yl)-1,6-naphthyridine-8-carbonitrile","Acta Crystallographica Section C","1999","55","10","1670","1672","10.1107/S0108270199007829","","","0.71073","MoKα","","0.1071","0.0622","","","","0.1603","","","","","","1.084","","","","has coordinates","303291","2025-11-13","08:09:37",""
"2009033","7.5352","0.0011","9.2242","0.0012","23.1197","0.0013","90","","90","","90","","1607","0.3","293","2","","","","","","","","","","5","P b n m","-P 2c 2ab","62","","","","- C17 H18 Cu N2 O3 -","- C17 H18 Cu N2 O3 -","- C68 H72 Cu4 N8 O12 -","4","0.5","NA1424","Arıcı, Cengiz; Ercan, Filiz; Atakol, Orhan; Cakırer, Orhan","Aqua[<i>N</i>,<i>N</i>'-bis(salicylidene)-1,3-propanediaminato]copper(II)","Acta Crystallographica Section C","1999","55","10","1654","1655","10.1107/S010827019900894X","","","0.71073","MoKα","","","0.046","","","","0.063","","","","","","1.07","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009034","9.0587","0.0002","10.2616","0.0002","10.3295","0.0002","79.104","0.001","64.898","0.001","65.456","0.001","790.85","0.03","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","N-methyl-[o-iodo-p-chloro phenyl]cinnamamide","","- C16 H13 Cl I N O -","- C16 H13 Cl I N O -","- C32 H26 Cl2 I2 N2 O2 -","2","1","NA1426","S. Renganayaki; E. Subramanian; S. Shanmuga Sundara Raj; Hoong-Kun Fun","<i>N</i>-(4-Chloro-2-iodophenyl)-<i>N</i>-methylcinnamamide","Acta Crystallographica Section C","1999","55","10","1672","1673","10.1107/S010827019900791X","","","0.71073","MoKα","","0.048","0.041","","","","0.114","","","","","","1.042","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009035","9.608","0.001","10.742","0.001","14.468","0.001","107.121","0.001","102.757","0.001","104.349","0.001","1311.1","0.2","298","","","","","","","","","","","5","P 1","P 1","1","","","","- C62 H66 N8 O2 Si -","- C62 H66 N8 O2 Si -","- C62 H66 N8 O2 Si -","1","1","NA1427","Decréau, Richard; Julliard, Michel; Giorgi, Michel","Bis(<i>epi</i>-globulyloxy)(phthalocyaninato)silicon, a new photosensitizer for the photodynamic therapy of cancer","Acta Crystallographica Section C","1999","55","10","1717","1719","10.1107/S0108270199008677","","","0.71073","MoKα","","","0.062","","","","0.114","","","","","","1.0181","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009036","8.8298","0.0003","9.6918","0.0003","10.5786","0.0003","97.81","0.001","111.192","0.001","105.25","0.001","787.04","0.04","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Dichlorobis(dimethylformamide-O)bis(4-nitrobenzaldehyde thiosemicarbazone-S) cadmium(II)","","- C22 H30 Cd Cl2 N10 O6 S2 -","- C22 H30 Cd Cl2 N10 O6 S2 -","- C22 H30 Cd Cl2 N10 O6 S2 -","1","0.5","NA1428","Yu-Peng Tian; Jie-Ying Wu; Fu-Xin Xie; S. Shanmuga Sundara Raj; Ping Yang; Hoong-Kun Fun","Dichlorobis(dimethylformamide-<i>O</i>)bis(4-nitrobenzaldehyde thiosemicarbazone-<i>S</i>)cadmium(II)","Acta Crystallographica Section C","1999","55","10","1641","1644","10.1107/S010827019900815X","","","0.71073","MoKα","","0.025","0.024","","","","0.064","","","","","","1.037","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009037","14.577","0.003","10.875","0.002","23.985","0.005","90","","90.4","0.05","90","","3802.1","1.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Tetraphenylarsonium diazotriphenylstannate.","","- C42 H35 As N6 Sn -","- C42 H35 As N6 Sn -","- C168 H140 As4 N24 Sn4 -","4","1","NA1430","Franco Benetollo; Gabriella Bombieri; Giuseppe Alonzo; Nuccio Bertazzi","Tetraphenylarsonium diazidotriphenylstannate","Acta Crystallographica Section C","1999","55","10","1664","1665","10.1107/S0108270199008951","","","0.71073","MoKα","","0.0647","0.0503","","","","0.1279","","","","","","1.29","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009038","6.629","0.001","16.35","0.001","5.328","0.001","95.78","0.02","109.9","0.02","80.3","0.02","534.64","0.15","297","","","","","","","","","","","3","P -1","-P 1","2","","4-Methylbicyclo[6.3.0]undecane-2,6-dione","","- C12 H18 O2 -","- C12 H18 O2 -","- C24 H36 O4 -","2","1","OA1088","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","4-Methylbicyclo[6.3.0]undecane-2,6-dione, (I), 7-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 7-acetonyl-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 8-methyltricyclo[9.3.0.0^2,6^]tetradec-5-ene-4,10-dione, (IV)","Acta Crystallographica Section C","1999","55","10","1721","1725","10.1107/S0108270199007088","","","0.71073","MoKα","","","0.058","","","","0.069","","","","","","1.05","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009039","7.442","0.001","14.747","0.003","5.586","0.002","92.84","0.02","101.39","0.02","87.87","0.02","600","0.3","298","","","","","","","","","","","4","P -1","-P 1","2","","7-Bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione","","- C12 H17 Br O2 -","- C12 H17 Br O2 -","- C24 H34 Br2 O4 -","2","1","OA1088","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","4-Methylbicyclo[6.3.0]undecane-2,6-dione, (I), 7-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 7-acetonyl-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 8-methyltricyclo[9.3.0.0^2,6^]tetradec-5-ene-4,10-dione, (IV)","Acta Crystallographica Section C","1999","55","10","1721","1725","10.1107/S0108270199007088","","","0.71073","MoKα","","","0.042","","","","0.049","","","","","","1.07","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009040","11.331","0.004","13.315","0.002","9.298","0.002","101.44","0.01","105.67","0.02","77.15","0.02","1302.5","0.6","297","","","","","","","","","","","3","P -1","-P 1","2","","8-Methyltricyclo[9.3.0.0^2,6^]tetradec-5-ene-4,10-dione","","- C15 H20 O2 -","- C15 H20 O2 -","- C60 H80 O8 -","4","2","OA1088","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","4-Methylbicyclo[6.3.0]undecane-2,6-dione, (I), 7-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 7-acetonyl-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 8-methyltricyclo[9.3.0.0^2,6^]tetradec-5-ene-4,10-dione, (IV)","Acta Crystallographica Section C","1999","55","10","1721","1725","10.1107/S0108270199007088","","","0.71073","MoKα","","","0.052","","","","0.058","","","","","","1","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009041","7.874","0.002","21.134","0.003","9.22","0.003","90","","114","0.02","90","","1401.6","0.6","297","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","7-Acetonyl-4-methylbicyclo[6.3.0]undecane-2,6-dione","","","- C15 H22 O3 -","- C15 H22 O3 -","- C60 H88 O12 -","4","1","OA1088","Umehara, Misao; Hosomi, Hiroyuki; Ohba, Shigeru","4-Methylbicyclo[6.3.0]undecane-2,6-dione, (I), 7-bromo-4-methylbicyclo[6.3.0]undecane-2,6-dione, (II), 7-acetonyl-4-methylbicyclo[6.3.0]undecane-2,6-dione, (III), and 8-methyltricyclo[9.3.0.0^2,6^]tetradec-5-ene-4,10-dione, (IV)","Acta Crystallographica Section C","1999","55","10","1721","1725","10.1107/S0108270199007088","","","0.71073","MoKα","","","0.053","","","","0.063","","","","","","1.07","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009042","8.668","0.004","18.944","0.002","18.196","0.001","90","","90","","90","","2987.9","1.4","296.2","","296.2","","","","","","","","","6","P b c m","-P 2c 2b","57","","tetrakis(isopropylthio)-p-benzoquinonesilver(I) perchlorate","","- C21 H34 Ag Cl O7 S4 -","- C21 H34 Ag Cl O7 S4 -","- C84 H136 Ag4 Cl4 O28 S16 -","4","0.5","OB1009","Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Munakata, Megumu","A linear-chain silver(I) coordination polymer with tetrakis(isopropylthio)-<i>p</i>-benzoquinone","Acta Crystallographica Section C","1999","55","10","1623","1625","10.1107/S0108270199005624","","","0.7107","MoKα","","0.193","0.0698","","","","0.1899","","","","","","1.02","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009043","4.976","0.001","5.1968","0.0008","27.955","0.003","90","","93.82","0.01","90","","721.3","0.2","298.2","","298.2","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","tetradecane-1,14-diol","","","- C14 H30 O2 -","- C14 H30 O2 -","- C28 H60 O4 -","2","0.5","OB1010","Naotake Nakamura; Taketoshi Sato","1,14-Tetradecanediol","Acta Crystallographica Section C","1999","55","10","1687","1689","10.1107/S0108270199008112","","","1.5418","CuKα","","0.056","0.05","","0.109","","0.097","","","1.8","","","1.77","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009044","3.952","0.001","19.95","0.01","9.551","0.004","90","","96.6","0.03","90","","748","0.5","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 Cl2 N4 O4 -","- C14 H10 Cl2 N4 O4 -","- C28 H20 Cl4 N8 O8 -","2","0.5","OB1011","Ishida, Hiroyuki; Kashino, Setsuo","1:2 Complexes of chloranilic acid with pyrimidine and pyrazine","Acta Crystallographica Section C","1999","55","10","1714","1717","10.1107/S010827019900709X","","","0.71073","MoKα","","0.048","0.045","","0.091","","0.083","","","1.65","","","1.65","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009045","3.8283","0.0007","18.514","0.005","10.795","0.003","90","","94.48","0.02","90","","762.8","0.3","296","","296","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 Cl2 N4 O4 -","- C14 H10 Cl2 N4 O4 -","- C28 H20 Cl4 N8 O8 -","2","0.5","OB1011","Ishida, Hiroyuki; Kashino, Setsuo","1:2 Complexes of chloranilic acid with pyrimidine and pyrazine","Acta Crystallographica Section C","1999","55","10","1714","1717","10.1107/S010827019900709X","","","0.71073","MoKα","","0.117","0.065","","0.092","","0.061","","","1.37","","","1.37","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009046","5.29","0.004","18.214","0.006","6.781","0.003","90","","111.66","0.04","90","","607.2","0.6","295","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Sodium hydrogen trans-1-propene-1,3-dicarboxylate","","- C5 H5 Na O4 -","- C5 H5 Na O4 -","- C20 H20 Na4 O16 -","4","1","OB1012","Taka, Jun-ichiro; Kashino, Setsuo","Sodium hydrogen <i>trans</i>-glutaconate and ammonium hydrogen <i>trans</i>-glutaconate","Acta Crystallographica Section C","1999","55","10","1620","1623","10.1107/S0108270199008458","","","0.71073","MoKα","","","0.069","","","","0.06","","","","","","1.14","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009047","10.669","0.005","18.479","0.006","7.28","0.006","90","","90","","90","","1435.3","1.4","295","","","","","","","","","","","4","I b a m","-I 2 2c","72","","Ammonium hydrogen trans-1-propene-1,3-dicarboxylate","","- C5 H9 N O4 -","- C5 H9 N O4 -","- C40 H72 N8 O32 -","8","0.5","OB1012","Taka, Jun-ichiro; Kashino, Setsuo","Sodium hydrogen <i>trans</i>-glutaconate and ammonium hydrogen <i>trans</i>-glutaconate","Acta Crystallographica Section C","1999","55","10","1620","1623","10.1107/S0108270199008458","","","0.71073","MoKα","","","0.077","","","","0.067","","","","","","1.51","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009048","9.152","0.001","20.886","0.001","9.555","0.001","90","","97.57","0.01","90","","1810.5","0.3","296","2","296","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H28 N2 O7 Pt -","- C14 H28 N2 O7 Pt -","- C56 H112 N8 O28 Pt4 -","4","1","OB1013","Yuge, Hidetaka; Miyamoto, Takeshi Ken","Bis(cyclohexane-1,3-dionato)-<i>C</i>^2^,<i>O</i>^1^-(ethylenediamine-<i>N</i>,<i>N</i>')platinum(II) trihydrate and bis(cyclohexane-1,3-dionato)-<i>C</i>^2^,<i>O</i>^1^-(<i>N</i>,<i>N</i>-dimethylethylenediamine-<i>N</i>,<i>N</i>')platinum(II)","Acta Crystallographica Section C","1999","55","10","1617","1620","10.1107/S0108270199008069","","","0.71069","MoKα","","0.041","0.025","","","","0.058","","","","","","1.037","","","","has coordinates,has disorder","301791","2025-08-18","23:15:33",""
"2009049","12.63","0.003","14.938","0.003","9.276","0.001","90","","90","","90","","1750.1","0.6","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H26 N2 O4 Pt -","- C16 H26 N2 O4 Pt -","- C64 H104 N8 O16 Pt4 -","4","1","OB1013","Yuge, Hidetaka; Miyamoto, Takeshi Ken","Bis(cyclohexane-1,3-dionato)-<i>C</i>^2^,<i>O</i>^1^-(ethylenediamine-<i>N</i>,<i>N</i>')platinum(II) trihydrate and bis(cyclohexane-1,3-dionato)-<i>C</i>^2^,<i>O</i>^1^-(<i>N</i>,<i>N</i>-dimethylethylenediamine-<i>N</i>,<i>N</i>')platinum(II)","Acta Crystallographica Section C","1999","55","10","1617","1620","10.1107/S0108270199008069","","","0.71069","MoKα","","0.036","0.029","","","","0.068","","","","","","1.021","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009050","8.9499","0.0012","9.2513","0.0009","8.6473","0.0011","115.764","0.008","99.704","0.011","98.247","0.011","616.35","0.15","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H34 Al2 N6 O16 P4 -","- C8 H34 Al2 N6 O16 P4 -","- C8 H34 Al2 N6 O16 P4 -","1","0.5","OH1114","Sugiyama, Kazumasa; Hiraga, Kenji; Yu, Jihong; Zheng, Shan; Qiu, Shilun; Xu, Ruren; Terasaki, Osamu","A one-dimensionally extended chain aluminophosphate","Acta Crystallographica Section C","1999","55","10","1615","1617","10.1107/S0108270199000360","","","0.71069","MoKα","","0.0674","0.0428","","","","0.1033","","","","","","1.04","","","","has coordinates","249787","2020-10-21","18:00:00",""
"2009051","8.0257","0.0001","25.8793","0.0003","12.1196","0.0001","90","","94.7901","0.0002","90","","2508.44","0.05","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(2-Chloroethyl)diisopropylammonium Tetrachlorocobaltate(II)","","- C16 H38 Cl6 Co N2 -","- C16 H38 Cl6 Co N2 -","- C64 H152 Cl24 Co4 N8 -","4","1","OS1065","Mahmoudkhani, Amir H.; Langer, Vratislav","Bis[(2-chloroethyl)diisopropylammonium] tetrachlorocobaltate(II)","Acta Crystallographica Section C","1999","55","10","1631","1634","10.1107/S0108270199007362","","","0.71073","MoKα","","0.07","0.045","","","","0.111","","","","","","1.021","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2009052","7.4986","0.0015","11.574","0.002","20.032","0.004","90","","90","","90","","1738.6","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Hedychenone","4-[2-(3-furanyl)ethenyl]-4a,5,6,7,8,8a-hexahydro-3,4a,8,8-tetramethyl- 1(4H)-naphthalenone (Chem. Abs. name)","","- C20 H26 O2 -","- C20 H26 O2 -","- C80 H104 O8 -","4","1","QA0128","Liu, Xiu-Hua; Wang, Wenling; He, Zhen-Dan; Wang, Han-Qing; Yang, Chong-Ren; Chen, Bosen","Hedychenone from <i>Hedychium Yunnanense</i> Gagnep","Acta Crystallographica Section C","1999","55","10","IUC9900129","","10.1107/S0108270199098649","","","0.71073","MoKα","","0.066","0.059","","","","0.155","","","","","","1.106","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009053","7.255","0.001","10.741","0.002","11.115","0.002","90","","100.142","0.014","90","","852.6","0.3","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- H16 Na2 O20 P4 Zn -","- H16 Na2 O20 P4 Zn -","- H32 Na4 O40 P8 Zn2 -","2","0.5","QA0160","Harrison, William T. A.","A sodium zinc phosphate hydrate, Na~2~Zn(H~2~PO~4~)~4~^.^4H~2~O","Acta Crystallographica Section C","1999","55","10","IUC9900113","","10.1107/S0108270199098789","","","0.71073","MoKα","","","0.038","","","","0.035","","","","","","1.05","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009054","7.6438","0.0013","7.848","0.0009","7.9642","0.0015","64.561","0.014","84.822","0.014","72.443","0.013","410.91","0.13","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- H5 K O9 P2 Zn -","- H5 K O9 P2 Zn -","- H10 K2 O18 P4 Zn2 -","2","1","QA0161","Harrison, William T. A.","A potassium zinc phosphate hydrate, KZn(HPO~4~)(H~2~PO~4~)^.^H~2~O","Acta Crystallographica Section C","1999","55","10","IUC9900112","","10.1107/S0108270199098790","","","0.71073","MoKα","","","0.024","","","","0.032","","","","","","0.881","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009055","6.847","0.005","8.708","0.005","18.055","0.005","78.87","0.05","86.27","0.05","76.58","0.05","1027.2","1","294","1","294","1","","","","","","","","4","P -1","-P 1","2","","3-(Triphenylstannyl)propyl ethanoate","","- C23 H24 O2 Sn -","- C23 H24 O2 Sn -","- C46 H48 O4 Sn2 -","2","1","QA0165","Low, John Nicolson; Ferguson, George; Wardell, James L.","3-(Triphenylstannyl)propyl ethanoate","Acta Crystallographica Section C","1999","55","10","IUC9900117","","10.1107/S010827019909873X","","","0.7107","MoKα","","0.023","0.018","","","","0.058","","","","","","0.905","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009056","9.929","0.003","8.895","0.002","14.482","0.004","90","","90","","90","","1279","0.6","150","2","150","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C12 H12 O8 -","- C12 H12 O8 -","- C48 H48 O32 -","4","0.5","QA0166","Foxon, Simon P.; Semlyen, J. Anthony; Wood, Barry R.","A cyclic dimer of ethyleneglycol maleate","Acta Crystallographica Section C","1999","55","10","IUC9900115","","10.1107/S0108270199098704","","","0.7107","MoKα","","0.0571","0.0361","","","","0.1085","","","","","","1.005","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009057","7.5729","0.0002","9.0936","0.0002","11.3877","0.0003","90","","96.193","0.001","90","","779.64","0.03","175","2","175","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,5-dichloro-2-nitroaniline","","- C6 H4 Cl2 N2 O2 -","- C6 H4 Cl2 N2 O2 -","- C24 H16 Cl8 N8 O8 -","4","1","QA0168","Britton, Doyle","4,5-Dichloro-2-nitroaniline","Acta Crystallographica Section C","1999","55","10","IUC9900116","","10.1107/S0108270199098698","","","0.71073","MoKα","","0.056","0.045","","0.112","","0.107","","","1.09","","","1.12","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009058","11.986","0.0017","7.035","0.0011","11.1186","0.0017","90","","97.727","0.003","90","","929","0.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","2-methyl-(3R)-hydroxymethyl-cyclohexene-(4S)-carbolactone-(5S)-carboxylic acid","","- C10 H12 O4 -","- C10 H12 O4 -","- C40 H48 O16 -","4","1","QA0169","Brewster, Matthew A.; Carducci, Michael D.; Rainier, Jon D.","The Diels‒Alder adduct (3a<i>S</i>,7a<i>R</i>,4<i>S</i>)-1,3,3a,-4,5,7a-hexahydro-7-methyl-3-oxoisobenzofuran-4-carboxylic acid","Acta Crystallographica Section C","1999","55","10","IUC9900126","","10.1107/S0108270199098674","","","0.71073","MoKα","","0.108","0.045","","","","0.117","","","","","","0.852","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009059","11.5244","0.0002","19.1647","0.0003","24.8355","0.0001","90","","90","","90","","5485.21","0.13","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Spiro Pyrazolidine [5.3] 4'-Flavanone.","","- C35 H26 N2 O2 -","- C35 H26 N2 O2 -","- C280 H208 N16 O16 -","8","1","QA0170","Krishna, R.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Fun, Hoong-Kun; Manikandan, S.; Raghunathan, R.","2,4,5-Triphenylspiro[pyrazolidine-3,3'-(4'-flavanone)]","Acta Crystallographica Section C","1999","55","10","IUC9900120","","10.1107/S0108270199098662","","","0.71073","MoKα","","0.085","0.055","","","","0.128","","","","","","1.131","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009060","10.112","0.002","19.144","0.007","10.511","0.003","90","","118.35","0.02","90","","1790.7","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis[μ-chloro-tricarbonyl(dicyclohexylphosphine)rhenium]","","- C30 H46 Cl2 O6 P2 Re2 -","- C30 H46 Cl2 O6 P2 Re2 -","- C60 H92 Cl4 O12 P4 Re4 -","2","0.5","QA0171","Flörke, Ulrich","Di-μ-chloro-bis[tricarbonyl(dicyclohexylphosphine)rhenium]","Acta Crystallographica Section C","1999","55","10","IUC9900119","","10.1107/S0108270199098777","","","0.71073","MoKα","","0.044","0.025","","","","0.054","","","","","","1.042","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009061","19.75","0.003","19.75","0.003","12.24","0.002","90","","90","","120","","4134.7","1.1","293","2","293","2","","","","","","","","5","P 63/m","-P 6c","176","","Hexa-tetraethylammonium di-υ~3~iodo-triυ~4~-iodohexkis(iodosilver(I)), (Et~4~N)~6~[Ag~6~I~11~]I","","- C48 H120 Ag6 I12 N6 -","- C48 H120 Ag6 I12 N6 -","- C96 H240 Ag12 I24 N12 -","2","0.166667","QA0172","Zhao, Yingjun; Su, Weiping; Cao, Rong; Hong, Maochun","Hexakis(tetraethylammonium) tri-μ~4~-iodo-di-μ~3~-iodo-hexakis[iodosilver(I)] iodide, (Et~4~ N)~6~[Ag~6~I~11~]I","Acta Crystallographica Section C","1999","55","10","IUC9900122","","10.1107/S0108270199098765","","","0.71073","MoKα","","0.046","0.035","","0.094","","0.092","","","1.139","","","1.224","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2009062","11.1271","0.0012","9.2899","0.001","14.565","0.003","90","","100.573","0.005","90","","1480","0.4","133","2","133","2","","","","","","","","5","P 1 21 1","P 2yb","4","","tert-Butyl (-)-(2S,3S,4S,5R,6S,R~S~)-3-hydroxy-5-(1-{N-[(R)-1-hydroxy-3-methylbut-2-yl]- 4-methylphenylsulfonimidoyl}ethyl)-4-methyl-2-phenylpyrrolidine-1-carboxylate","","- C30 H44 N2 O5 S -","- C30 H44 N2 O5 S -","- C60 H88 N4 O10 S2 -","2","1","QA0173","Bats, Jan W.; Heinrich, Timo; Reggelin, Michael","(–)-(2<i>S</i>,3<i>S</i>,4<i>S</i>,5<i>R</i>,<i>R</i>~S~)-1-<i>tert</i>-Butoxycarbonyl-3-hydroxy-5-(1(<i>S</i>)-{<i>N</i>-[(<i>R</i>)-1-hydroxy-3-methylbut-2-yl]-4-methylphenylsulfonimidoyl}ethyl)-4-methyl-2-phenylpyrrolidine at 133K","Acta Crystallographica Section C","1999","55","10","IUC9900114","","10.1107/S0108270199098625","","","0.71073","MoKα","","0.044","0.039","","","","0.107","","","","","","1.45","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009063","9.314","0.001","12.084","0.001","12.583","0.001","112.804","0.001","108.744","0.001","92.976","0.001","1210.76","0.19","291","1","291","1","","","","","","","","4","P -1","-P 1","2","","","","- C26 H29 N O4 -","- C26 H29 N O4 -","- C52 H58 N2 O8 -","2","1","QA0174","Canisius, Johannes; Schürmann, Markus; Preut, Hans; Krause, Norbert","Ethyl (<i>E</i>)-2-[benzyl(benzyloxycarbonyl)amino]-6,6-dimethylhept-2-en-4-ynoate","Acta Crystallographica Section C","1999","55","10","IUC9900118","","10.1107/S0108270199098686","","","0.71069","MoKα","","0.142","0.038","","","","0.075","","","","","","0.837","","","","has coordinates,has disorder","301791","2025-08-18","23:15:33",""
"2009064","8.1911","0.0003","9.0791","0.0003","19.2164","0.0008","90","","97.7742","0.0019","90","","1415.95","0.09","150","0.1","150","0.1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","5-Methyl-3-(1-oxo-nonyl)-1,3,4-thiadiazole-2(3H)-2-thione","","- C12 H20 N2 O S2 -","- C12 H20 N2 O S2 -","- C48 H80 N8 O4 S8 -","4","1","QA0175","Low, John Nicolson; Cook, Andrew; Imrie, Corrie T.; Wardell, James L.","5-Methyl-3-nonanoyl-1,3,4-thiadiazole-2(3<i>H</i>)-thione and 3-decanoyl-5-methyl-1,3,4-thiadiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section C","1999","55","10","IUC9900123","","10.1107/S0108270199098716","","","0.71073","MoKα","","0.0784","0.0434","","","","0.1256","","","","","","1.036","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009065","8.0494","0.0007","9.2472","0.0004","20.1232","0.0016","90","","94.709","0.003","90","","1492.8","0.19","150","0.1","150","0.1","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","5-Methyl-3-(1-oxo-decyl)-1,3,4-thiadiazole-2(3H)-2-thione","","- C13 H22 N2 O S2 -","- C13 H22 N2 O S2 -","- C52 H88 N8 O4 S8 -","4","1","QA0175","Low, John Nicolson; Cook, Andrew; Imrie, Corrie T.; Wardell, James L.","5-Methyl-3-nonanoyl-1,3,4-thiadiazole-2(3<i>H</i>)-thione and 3-decanoyl-5-methyl-1,3,4-thiadiazole-2(3<i>H</i>)-thione","Acta Crystallographica Section C","1999","55","10","IUC9900123","","10.1107/S0108270199098716","","","0.71073","MoKα","","0.1175","0.0572","","","","0.1058","","","","","","1.034","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009066","6.0365","0.0002","17.3779","0.0005","22.679","0.0008","90","","90","","90","","2379.07","0.13","150","2","150","0.1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4,5-Bis[(ferrocenylmethyl)thio]-1,3-dithiole-2-thione","","- C25 H22 Fe2 S5 -","- C25 H22 Fe2 S5 -","- C100 H88 Fe8 S20 -","4","1","QA0176","Low, John Nicolson; Chohan, Zahid H.; Howie, R. Alan; Wardell, James L.","4,5-Bis(ferrocenylmethylthio)-1,3-dithiole-2-thione","Acta Crystallographica Section C","1999","55","10","IUC9900124","","10.1107/S0108270199098728","","","0.71073","MoKα","","0.063","0.044","","","","0.115","","","","","","1.17","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009067","9.0696","0.0015","16.809","0.002","9.2603","0.0011","90","","114.804","0.012","90","","1281.5","0.3","134","2","134","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(+)-(2S,3S,4S,5S)-N-(tert-butoxycarbonyl)-3-[3,5-bis-(trifluoromethyl)- phenylmethoxy]-4,5-dimethyl-2-phenyl-pyrrolidine","","- C26 H29 F6 N O3 -","- C26 H29 F6 N O3 -","- C52 H58 F12 N2 O6 -","2","1","QA0178","Bats, Jan W.; Heinrich, Timo; Reggelin, Michael","(+)-(2<i>S</i>,3<i>S</i>,4<i>S</i>,5<i>S</i>)-3-[3,5-Bis(trifluoromethyl)benzyloxy]-<i>N</i>-(<i>tert</i>-butoxycarbonyl)-4,5-dimethyl-2-phenylpyrrolidine, (I), and (+)-(2<i>S</i>,3<i>S</i>,4<i>S</i>,5<i>S</i>)-3-[3,5-bis(trifluoromethyl)benzyloxy]-4,5-dimethyl-2-phenylpyrrolidinium <i>p</i>-toluenesulfonate, (II), at 134K","Acta Crystallographica Section C","1999","55","10","IUC9900121","","10.1107/S0108270199098613","","","0.71073","MoKα","","0.049","0.047","","","","0.13","","","","","","1.675","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009068","9.8727","0.0018","8.8917","0.0011","16.527","0.002","90","","102.162","0.012","90","","1418.3","0.4","134","2","134","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(+)-(2S,3S,4S,5S)-3-[3,5-bis-(trifluoromethyl)-phenylmethoxy]-4,5-dimethyl-2- phenyl-pyrrolidinyl p-toluenesulfonate","","- C28 H29 F6 N O4 S -","- C28 H29 F6 N O4 S -","- C56 H58 F12 N2 O8 S2 -","2","1","QA0178","Bats, Jan W.; Heinrich, Timo; Reggelin, Michael","(+)-(2<i>S</i>,3<i>S</i>,4<i>S</i>,5<i>S</i>)-3-[3,5-Bis(trifluoromethyl)benzyloxy]-<i>N</i>-(<i>tert</i>-butoxycarbonyl)-4,5-dimethyl-2-phenylpyrrolidine, (I), and (+)-(2<i>S</i>,3<i>S</i>,4<i>S</i>,5<i>S</i>)-3-[3,5-bis(trifluoromethyl)benzyloxy]-4,5-dimethyl-2-phenylpyrrolidinium <i>p</i>-toluenesulfonate, (II), at 134K","Acta Crystallographica Section C","1999","55","10","IUC9900121","","10.1107/S0108270199098613","","","0.71073","MoKα","","0.061","0.047","","","","0.113","","","","","","1.294","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009069","6.349","0.001","6.936","0.001","9.282","0.002","95.62","0.03","104.58","0.03","113.44","0.03","353.8","0.17","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H16 Fe N2 O8 -","- C12 H16 Fe N2 O8 -","- C12 H16 Fe N2 O8 -","1","0.5","QA0179","Liu, Qun; Wei, Yongge; Wang, Wei; Zhang, Shiwei","Tetraaquabis(4-pyridinecarboxylato-<i>N</i>)iron(II)","Acta Crystallographica Section C","1999","55","10","IUC9900127","","10.1107/S0108270199098741","","","0.71073","MoKα","","0.037","0.031","","","","0.08","","","","","","1.071","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009070","9.9921","0.0001","13.2646","0.0002","12.1386","0.0002","90","","90.47","0.001","90","","1608.81","0.04","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl (SR)-8,10-dichloro-1,2,3,4,5,6-hexahydro-6-hydroxy-1-methyl- 1,9-phenanthroline-6-carboxylate","","- C15 H16 Cl2 N2 O3 -","- C15 H16 Cl2 N2 O3 -","- C60 H64 Cl8 N8 O12 -","4","1","QA0180","Sarkar, Tarun Kumar; Basak, Sankar; Ghosh, Sunil Kumar; Nigam, Gur Dayal; Razak, Ibrahim Abdul; Shanmuga Sundara Raj, S.; Fun, Hoong-Kun","Methyl (<i>SR</i>)-8,10-dichloro-1,2,3,4,5,6-hexahydro-6-hydroxy-1-methyl-1,9-phenanthroline-6-carboxylate","Acta Crystallographica Section C","1999","55","10","IUC9900128","","10.1107/S0108270199098650","","","0.71073","MoKα","","0.05","0.041","","","","0.121","","","","","","1.05","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009071","14.7482","0.0008","8.2538","0.0006","26.6697","0.0013","90","","100.42","0.003","90","","3192.9","0.3","106","2","106","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","cis,trans-Bis(acetonitrile)(2,2'-bipyridine-N,N')dichlororuthenium(II) hemihydrate","","- C14 H15 Cl2 N4 O0.5 Ru -","- C14 H15 Cl2 N4 O0.5 Ru -","- C112 H120 Cl16 N32 O4 Ru8 -","8","1","QB0111","Huh, Seong; Park, Seongsoon; Lough, Alan. J.","<i>cis</i>,<i>trans</i>-Bis(acetonitrile-<i>N</i>)(2,2'-bipyridine-<i>N</i>,<i>N</i>')dichlororuthenium(II) hemihydrate","Acta Crystallographica Section C","1999","55","10","IUC9900125","","10.1107/S0108270199098753","","","0.71073","MoKα","","0.082","0.041","","","","0.077","","","","","","0.908","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009072","15.001","0.009","7.385","0.003","15.078","0.013","90","","95.45","0.06","90","","1662.8","1.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-[3-(3-Indenyl)propyl]-benzylammonium bromide","","- C19 H22 Br N -","- C19 H22 Br N -","- C76 H88 Br4 N4 -","4","1","QB0113","Groux, Laurent F.; Bélanger-Gariépy, Francine; Zargarian, Davit","Benzyl[3-(3-indenyl)propyl]ammonium bromide","Acta Crystallographica Section C","1999","55","10","IUC9900130","","10.1107/S0108270199098637","","","1.54056","CuKα","","0.041","0.031","","0.077","","0.074","","","0.94","","","1.023","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009073","9.0165","0.0004","11.3057","0.0003","13.4155","0.0006","90","","90","","90","","1367.55","0.09","150","2","150","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","N-(6-amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl) methionine","","- C10 H15 N5 O4 S -","- C10 H15 N5 O4 S -","- C40 H60 N20 O16 S4 -","4","1","SK1287","Low, John N.; Godino, M. L.; López, Rafael; Pérez, Agustin; Melguizo, Manuel; Cobo, Justo","<i>N</i>-(6-Amino-3,4-dihydro-3-methyl-5-nitroso-4-oxopyrimidin-2-yl)methionine","Acta Crystallographica Section C","1999","55","10","1727","1730","10.1107/S0108270199008495","","","0.71073","MoKα","","0.061","0.047","","","","0.128","","","","","","1.208","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2009074","10.1911","0.0011","11.3039","0.0013","11.0983","0.0011","90","","115.83","0.002","90","","1150.8","0.2","295","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C11 H12 Cl N O2 -","- C11 H12 Cl N O2 -","- C44 H48 Cl4 N4 O8 -","4","1","SK1291","Arici, Cengiz; Tahir, M. Nawaz; Ülkü, Dinçer; Atakol, Orhan","4-Chloro-2-(4-oxopent-2-en-2-ylamino)phenol","Acta Crystallographica Section C","1999","55","10","1691","1692","10.1107/S0108270199008501","","","0.71073","MoKα","","","0.036","","","","0.045","","","","","","0.96","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009075","9.0652","0.001","11.5566","0.0011","16.2857","0.0016","90","","100.558","0.008","90","","1677.3","0.3","295","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H32 Cu2 N6 O10 Zn -","- C34 H32 Cu2 N6 O10 Zn -","- C68 H64 Cu4 N12 O20 Zn2 -","2","0.5","SK1295","Ülkü, Dinçer; Tatar, Leyla; Atakol, Orhan; Durmus̨, Sefa","Bis{(μ-nitrato)[μ-bis(salicylidene)-1,3-propanediaminato]copper(II)}zinc(II)","Acta Crystallographica Section C","1999","55","10","1652","1654","10.1107/S0108270199008513","","","0.71073","MoKα","","","0.036","","","","0.04","","","","","","1.01","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009076","7.5447","0.0005","12.0046","0.0007","13.7852","0.0008","74.077","0.001","75.359","0.001","72.462","0.001","1124.96","0.12","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","bis(2-phenyldiazenyl-1H-imidazole-N)silver(I) nitrate methanol solvate","","- C19 H20 Ag N9 O4 -","- C19 H20 Ag N9 O4 -","- C38 H40 Ag2 N18 O8 -","2","1","SK1302","S. Shanmuga Sundara Raj; Hoong-Kun Fun; Xiao-Feng Chen; Xu-Hui Zhu; Xiao-Zeng You","Bis[2-(phenylazo)imidazole-<i>N</i>]silver(I) nitrate methanol solvate","Acta Crystallographica Section C","1999","55","10","1644","1646","10.1107/S0108270199008525","","","0.71073","MoKα","","0.094","0.057","","","","0.16","","","","","","1.013","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009077","14.0268","0.0001","15.0988","0.0002","13.3565","0.0002","90","","111.16","0.01","90","","2638.02","0.19","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Diiodobis(4-methoxybenzaldehyde thiosemicarbazone)cadmium(II)","","- C18 H22 Cd I2 N6 O2 S2 -","- C18 H22 Cd I2 N6 O2 S2 -","- C72 H88 Cd4 I8 N24 O8 S8 -","4","1","SK1305","Yu-Peng Tian; Wen-Tao Yu; Min-Hua Jiang; S. Shanmuga Sundara Raj; Ping Yang; Hoong-Kun Fun","Diiodobis(4-methoxybenzaldehyde thiosemicarbazone-<i>S</i>)cadmium(II)","Acta Crystallographica Section C","1999","55","10","1639","1641","10.1107/S0108270199008537","","","0.71073","MoKα","","0.042","0.037","","","","0.09","","","","","","1.149","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009078","9.0605","0.0002","17.8725","0.0001","31.4066","0.0006","90","","90","","90","","5085.79","0.15","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Spiro[1-acetyl-2-oxo-(3H)indole-3,2'-oxeto[3,2-b](10'-diphenylmethylene- 3',4',9',10'-(3'α,4'α,9'α,10'α)-tetrahedron-4',9'-methanonaphthalene","","- C34 H25 N O3 -","- C34 H25 N O3 -","- C272 H200 N8 O24 -","8","1","SK1309","S.Shanmuga Sundara Raj; Hoong-Kun Fun; Jie, Xue; Jia-Hai, Ye; Hu, Cai; Jian-Hua, Xu","1-Acetyl-2a',3',8',8a'-tetrahydro-3',8'-(diphenylmethylenemethano)spiro[indoline-3,2'-2'<i>H</i>-oxeto[3,2-<i>b</i>]naphthalen]-2-one","Acta Crystallographica Section C","1999","55","10","1674","1675","10.1107/S0108270199008744","","","0.71073","MoKα","","0.1306","0.067","","","","0.1581","","","","","","1.083","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009079","6.3799","0.0001","14.9302","0.0002","16.108","0.0002","90","","91.636","0.001","90","","1533.71","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(2-hydroxyphenyl)-1-(2,4-dinitrophenyl)-1H-pyrazole-4-carboxaldehyde","","- C16 H10 N4 O6 -","- C16 H10 N4 O6 -","- C64 H40 N16 O24 -","4","1","SK1310","Shanmuga Sundara Raj, S.; Jeyakanthan, J.; Selvi, S.; Velmurugan, D.; Fun, H.-K; Perumal, P. T","1-(2,4-Dinitrophenyl)-3-(2-hydroxyphenyl)-1<i>H</i>-pyrazole-4-carbaldehyde","Acta Crystallographica Section C","1999","55","10","1667","1669","10.1107/S0108270199008690","","","0.71073","MoKα","","0.0796","0.0553","","","","0.155","","","","","","1.027","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009080","7.994","0.006","8.371","0.007","25.14","0.02","90","","90","","90","","1682","2","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H18 Cl3 N -","- C17 H18 Cl3 N -","- C68 H72 Cl12 N4 -","4","1","SX1083","Caruso, Francesco; Besmer, Angela; Rossi, Miriam","The absolute configuration of sertraline (Zoloft) hydrochloride","Acta Crystallographica Section C","1999","55","10","1712","1714","10.1107/S0108270199008343","","","0.71073","MoKα","","","0.058","","","0.049","","","","","","","1.391","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009081","12.67","0.002","7.368","0.001","29.704","0.005","90","","96.92","0.01","90","","2752.7","0.7","130","0.1","130","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","2-trimethylgermylethyl p-nitrobenzoate","","- C12 H17 Ge N O4 -","- C12 H17 Ge N O4 -","- C96 H136 Ge8 N8 O32 -","8","1","TA1258","White, Jonathan M.","Trimethylgermylethyl <i>p</i>-nitrobenzoate","Acta Crystallographica Section C","1999","55","10","1660","1662","10.1107/S0108270199007258","","","1.5418","CuKα","","0.032","0.03","","0.085","0.081","","","","0.977","0.992","0.992","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009082","6.625","0.001","11.476","0.001","7.127","0.001","90","","105.03","0.01","90","","523.32","0.12","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","(+)-cis-Pinonic Acid","(1S,3S)-(+)-cis-3-acetyl-2,2-dimethylcyclobutaneacetic acid","","- C10 H16 O3 -","- C10 H16 O3 -","- C20 H32 O6 -","2","1","BK1455","Lalancette, Roger A.; Thompson, Hugh W.; Brunskill, Andrew P. J.","(+)-<i>cis</i>-Pinonic acid: catemeric hydrogen bonding in a non-racemic ε-keto acid","Acta Crystallographica Section C","1999","55","11","1908","1911","10.1107/S0108270199009555","","","0.71073","MoKα","","0.041","0.035","","","","0.089","","","","","","1.06","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009083","25.869","0.008","12.494","0.004","6.198","0.002","90","","90","","90","","2003.2","1.1","293","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","(6'R)–6'–Methyl–2',5'–dioxo–(17R)spiro[11β–hydroxy-androst–4–en– 3–one–17,3'–[1,4]–dioxane]","","- C23 H30 O6 -","- C23 H30 O6 -","- C92 H120 O24 -","4","1","BK1456","Asiloé J. Mora; Belkis M. Ramírez; Gerzon Delgado; Roy Little","The 17-spiro lactide of cortienic acid: a probe for studying the active sites of steroidal receptors","Acta Crystallographica Section C","1999","55","11","1870","1873","10.1107/S0108270199008008","","","0.71069","MoKα","","0.0674","0.048","","","","0.1542","","","","","","1.151","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009084","9.438","0.002","12.6375","0.0018","9.7641","0.0013","90","","110.953","0.014","90","","1087.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","diacetate-μ-[N,N'-bis[2-(2-aminoethylpyridine]oxamide]dicopper(II)","","- C20 H22 Cu2 N4 O6 -","- C20 H22 Cu2 N4 O6 -","- C40 H44 Cu4 N8 O12 -","2","0.5","BK1463","Francisco, Regina H. P.; Gambardella, M. Teresa do P.; Rodrigues, Ana M. G. D.; de Paula, M.; de Sousa, Gerimário F.","[μ-<i>N</i>,<i>N</i>'-Bis(2-pyridylethyl)oxamide]bis[acetatocopper(II)]","Acta Crystallographica Section C","1999","55","11","1791","1793","10.1107/S0108270199009476","","","0.71073","MoKα","","0.126","0.056","","","","0.184","","","","","","1.23","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009085","11.325","0.002","16.996","0.002","17.193","0.002","90","","99.78","0.01","90","","3261.2","0.8","290","2","290","2","","","","","","","","5","C 1 c 1","C -2yc","9","N-methyl-3',4'-dimethoxy-4-stilbazolium tetraphenylborate","4-[2-(3,4-Dimethoxyphenyl)ethenyl]-1-methylpyridinium tetraphenylborate","","- C40 H38 B N O2 -","- C40 H38 B N O2 -","- C160 H152 B4 N4 O8 -","4","1","BK1469","De-Chun Zhang; Li-Qin Ge; Tian-Zhu Zhang; Yan-Qiu Zhang; Kai-Bei Yu","4-[2-(3,4-Dimethoxyphenyl)ethenyl]-1-methylpyridinium tetraphenylborate","Acta Crystallographica Section C","1999","55","11","1938","1939","10.1107/S0108270199009579","","","0.71073","MoKα","","0.074","0.034","","0.072","","0.063","","","0.82","","","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009086","12.377","0.003","6.974","0.0014","19.822","0.004","90","","102.82","0.03","90","","1668.3","0.7","293","2","293","2","","","","","","","","6","P 1 c 1","P -2yc","7","","Triaqua-(2,2'-bipyridyl-N,N')-(thiosulfato-S)-nickel(II) dihydrate","","- C10 H18 N2 Ni O8 S2 -","- C10 H18 N2 Ni O8 S2 -","- C40 H72 N8 Ni4 O32 S8 -","4","2","BK1471","Eleonora Freire; Sergio Baggio; Ricardo Baggio; Leopoldo Suescun","Triaqua(2,2'-bipyridyl-<i>N</i>,<i>N</i>')(thiosulfato-<i>S</i>)nickel(II) dihydrate and triaqua(1,10-phenanthroline-<i>N</i>,<i>N</i>')(thiosulfato-<i>S</i>)nickel(II) monohydrate","Acta Crystallographica Section C","1999","55","11","1780","1784","10.1107/S010827019900829X","","","0.71073","MoKα","","0.042","0.036","","","","0.099","","","","","","1.08","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009087","8.434","0.002","8.782","0.002","11.344","0.002","90.47","0.03","91.27","0.03","104.23","0.03","814.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Triaqua-(2,10-phenanthroline-N,N')-(thiosulfato-S)-nickel(II) monohydrate.","","- C12 H16 N2 Ni O7 S2 -","- C12 H16 N2 Ni O7 S2 -","- C24 H32 N4 Ni2 O14 S4 -","2","1","BK1471","Eleonora Freire; Sergio Baggio; Ricardo Baggio; Leopoldo Suescun","Triaqua(2,2'-bipyridyl-<i>N</i>,<i>N</i>')(thiosulfato-<i>S</i>)nickel(II) dihydrate and triaqua(1,10-phenanthroline-<i>N</i>,<i>N</i>')(thiosulfato-<i>S</i>)nickel(II) monohydrate","Acta Crystallographica Section C","1999","55","11","1780","1784","10.1107/S010827019900829X","","","0.71073","MoKα","","0.026","0.025","","","","0.071","","","","","","1.09","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009088","15.194","0.003","11.059","0.002","16.262","0.003","90","","102.19","0.03","90","","2670.9","0.9","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C14 H24 Co F6 N4 O6 P3 S2 -","- C14 H24 Co F6 N4 O6 P3 S2 -","- C56 H96 Co4 F24 N16 O24 P12 S8 -","4","1","BK1474","Ye-Xiang Tong; Cheng-Yong Su; Bei-Sheng Kang; Xiao-Lan Yu; Xiao-Ming Chen","Bis(pyrimidine-2-thiolato-<i>N</i>,<i>S</i>)bis(trimethyl phosphite-<i>P</i>)cobalt(III) hexafluorophosphate","Acta Crystallographica Section C","1999","55","11","1800","1802","10.1107/S0108270199009488","","","0.71073","MoKα","","0.125","0.067","","","","0.164","","","","","","1.079","","","","has coordinates,has disorder","189124","2020-10-21","18:00:00",""
"2009089","13.32","0.002","16.118","0.002","13.609","0.002","90","","94.76","0.01","90","","2911.7","0.7","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Chloro-bis(2-(2-hydroxyphenyl)benzothiazolato) oxorhenium (V). 1.5CH~2~Cl~2~","","- C27.5 H19 Cl4 N2 O3 Re S2 -","- C27.5 H18 Cl4 N2 O3 Re S2 -","- C110 H72 Cl16 N8 O12 Re4 S8 -","4","1","BK1478","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Tung, Shu-Fang; Chattopadhyay, Pabitra; Lo, Jem-Mau; Chung, Chung-Sun","Bis[2-(1,3-benzothiazol-2-yl)phenolato-<i>O</i>,<i>N</i>]chlorooxorhenium(V)‒dichloromethane (1/1.5)","Acta Crystallographica Section C","1999","55","11","1802","1804","10.1107/S0108270199010008","","","0.71073","MoKα","","0.0843","0.0394","","","","0.096","","","","","","0.962","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009090","7.25","0.003","9.938","0.005","11.169","0.006","72.88","0.04","82.74","0.04","83.4","0.04","760.3","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","spiro-1',1'-(2-methylamino-tio-troponyl)-2',4',6'-trinitrocyclohexadiene.","","- C14 H10 N4 O6 S -","- C14 H10 N4 O6 S -","- C28 H20 N8 O12 S2 -","2","1","BM1341","Borbulevych, Oleg Ya.; Shishkin, Oleg V.; Budarina, Zoya N.; Antipin, Michail Yu.; Olekhnovich, Lev P.","2,3-Dihydro-3-methyl-2',4',6'-trinitrospiro[1,3-thiazolotropylium-2,1'-cyclohexadienide]","Acta Crystallographica Section C","1999","55","11","1915","1918","10.1107/S0108270199009646","","","0.71073","MoKα","","0.1571","0.0721","","0.2095","","0.1626","","","0.93","","","1.158","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2009091","12.984","0.007","13.034","0.005","16.749","0.008","82.04","0.03","72.31","0.04","87.45","0.04","2674","2","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H36 F6 N6 O14 -","- C31 H18 F3 N3 O7 -","- C124 H72 F12 N12 O28 -","4","2","BM1342","Kovalevsky, A. Yu.; Shishkin, O. V.; Ponomarev, I. I.","<i>N</i>,<i>N</i>'-(Pyridine-2,6-diyl)bis(naphthalenedicarboximide) trifluoroacetic acid monohydrate","Acta Crystallographica Section C","1999","55","11","1914","1915","10.1107/S0108270199009385","","","0.71073","MoKα","","0.1918","0.062","","0.1796","","0.1777","","","0.883","","","1.154","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2009092","12.996","0.005","10.106","0.005","12.717","0.011","90","","110.35","0.06","90","","1566","1.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-(3,5-Dinitropyridyl-2-oxy)-3,5,7-trimethylcyclohepta-2,4,6-trien-1-one","","- C15 H13 N3 O6 -","- C15 H13 N3 O6 -","- C60 H52 N12 O24 -","4","1","BM1347","Borbulevych, Oleg Ya.; Kurbatov, Sergey V.; Vaslyaeva, Galina S.; Antipin, Michail Yu.; Olekhnovich, Lev P.","2-(3,5-Dinitropyridyl-2-oxy)-3,5,7-trimethylcyclohepta-2,4,6-trien-1-one","Acta Crystallographica Section C","1999","55","11","1920","1921","10.1107/S0108270199009166","","","0.71073","MoKα","","0.08","0.057","","0.161","","0.131","","","1.08","","","1.14","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009093","7.879","0.003","10.971","0.006","19.831","0.009","90","","91.2","0.03","90","","1713.8","1.4","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(4-triethylammoniomethyl-1,3-dioxolane)-2-spiro-1'-2',4',6'-trinitro- cyclohexadienide","","- C15 H22 N4 O8 -","- C15 H22 N4 O8 -","- C60 H88 N16 O32 -","4","1","BM1348","Borbulevych, Oleg Ya.; Shishkin, Oleg V.; Knyazev, Victor N.","4-Triethylammoniomethyl-1,3-dioxolane-2-spiro-1'-2',4',6'-trinitrocyclohexadienide","Acta Crystallographica Section C","1999","55","11","1918","1920","10.1107/S0108270199009233","","","0.71073","MoKα","","0.2099","0.0771","","0.264","","0.1722","","","0.876","","","1.177","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2009094","8.905","0.004","9.497","0.003","10.321","0.005","93.83","0.03","99.9","0.03","90.42","0.03","857.8","0.6","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H23.5 F7.5 N2 O11.5 -","- C36 H23 F7.5 N2 O11.5 -","- C36 H23 F7.5 N2 O11.5 -","1","0.5","BM1349","Kovalevsky, A.Yu.; Shishkin, O. V.; Ponomarev, I.I.; Shishkina, S. V.","<i>N</i>,<i>N</i>'-Bis(3-methoxyphenyl)-1,8:4,5-naphthalenetetracarboximide‒trifluoroacetic acid‒phenol (1/2.5/0.5)","Acta Crystallographica Section C","1999","55","11","1911","1913","10.1107/S010827019900949X","","","0.71073","MoKα","","","0.0887","","","","0.236","","","","","","1.13","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2009095","11.9557","0.0007","12.111","0.0007","17.931","0.001","99.79","0.001","98.943","0.001","114.365","0.001","2255.8","0.2","188","2","188","2","","","","","","","","6","P -1","-P 1","2","","(tpp)Zr(Cl)[N(SiMe~3~)~2~] (tpp = 5,10,15,20-tetraphenylporphyrinato dianion)","","- C50 H46 Cl N5 Si2 Zr -","- C50 H46 Cl N5 Si2 Zr -","- C100 H92 Cl2 N10 Si4 Zr2 -","2","1","BM1353","Kim, Hee-Joon; Kim, Kimoon","The first amidozirconium(IV)‒porphyrin complex: <i>cis</i>-[bis(trimethylsilyl)amido]chloro(tetraphenylporphyrinato)zirconium(IV)","Acta Crystallographica Section C","1999","55","11","1814","1815","10.1107/S0108270199009919","","","0.71073","MoKα","","0.039","0.032","","","","0.081","","","","","","1.104","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009096","7.7939","0.0008","12.3957","0.0014","7.978","0.001","90","","97.48","0.01","90","","764.2","0.15","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4-Hydroxypiperidinium iodide","","- C5 H12 I N O -","- C5 H12 I N O -","- C20 H48 I4 N4 O4 -","4","1","BM1355","Freytag, Matthias; Jones, Peter G.","Hydrogen bonding in two piperidinium derivatives","Acta Crystallographica Section C","1999","55","11","1874","1877","10.1107/S0108270199009567","","","0.71073","MoKα","","0.017","0.014","","","","0.035","","","","","","1.071","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009097","9.1378","0.001","10.9924","0.0014","30.58","0.003","90","","90","","90","","3071.6","0.6","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","4-Methylpiperidinium 4-Methylpyridine-N-carboxylate Monohydrate","","- C13 H28 N2 O3 -","- C13 H28 N2 O3 -","- C104 H224 N16 O24 -","8","1","BM1355","Freytag, Matthias; Jones, Peter G.","Hydrogen bonding in two piperidinium derivatives","Acta Crystallographica Section C","1999","55","11","1874","1877","10.1107/S0108270199009567","","","0.71073","MoKα","","0.088","0.038","","","","0.078","","","","","","0.797","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009098","16.3206","0.0007","15.6683","0.0007","19.3267","0.0009","90","","90","","90","","4942.1","0.4","160","2","160","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C13 H14 B N O2 -","- C13 H14 B N O2 -","- C208 H224 B16 N16 O32 -","16","2","BM1357","Clegg, William; Scott, Andrew J.; Souza, Fábio E.S.; Marder, Todd B.","1:1 Adducts of 4-picoline with methylcatecholborane and phenylcatecholborane","Acta Crystallographica Section C","1999","55","11","1885","1888","10.1107/S0108270199010343","","","0.71073","MoKα","","0.0618","0.0474","","","","0.118","","","","","","1.062","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009099","9.729","0.0013","10.3311","0.0014","15.589","0.002","91.087","0.003","106.477","0.003","94.123","0.003","1497.4","0.3","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H16 B N O2 -","- C18 H16 B N O2 -","- C72 H64 B4 N4 O8 -","4","2","BM1357","Clegg, William; Scott, Andrew J.; Souza, Fábio E.S.; Marder, Todd B.","1:1 Adducts of 4-picoline with methylcatecholborane and phenylcatecholborane","Acta Crystallographica Section C","1999","55","11","1885","1888","10.1107/S0108270199010343","","","0.71073","MoKα","","0.1219","0.0644","","","","0.1669","","","","","","0.872","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009100","12.564","0.004","13.452","0.004","7.021","0.002","90","","113.74","0.03","90","","1086.2","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Cadmium sodium trivanadate","","- Cd3.23 Na1.41 O12 V3.36 -","- Cd3.229 Na1.409 O12 V3.362 -","- Cd12.916 Na5.636 O48 V13.448 -","4","0.5","BR1215","Lahcen El Ammari; Mohamed Azrour; Wulf Depmeier; K.-F. Hesse; Brahim Elouadi","Cadmium sodium trivanadate","Acta Crystallographica Section C","1999","55","11","1743","1746","10.1107/S0108270199007787","","","0.71069","MoKα","","0.036","0.027","","0.066","","0.063","","","1.063","","","1.1","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009101","6.266","0.001","6.266","0.001","8.103","0.002","90","","90","","120","","275.52","0.09","350","1","350","1","","","","","","","","3","P -3 m 1","-P 3 2""","164","Thallium Molybdate","Dithallium molybdate","","- Mo O4 Tl2 -","- Mo O4 Tl2 -","- Mo2 O8 Tl4 -","2","0.166667","BR1242","Friese, K.; Madariaga, G.; Breczewski, T.","Tl~2~MoO~4~ at 350K","Acta Crystallographica Section C","1999","55","11","1753","1755","10.1107/S0108270199008616","","","0.71073","MoKα","","0.046","0.039","","","","0.092","","","","","","1.053","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009102","9.124","0.004","7.792","0.0018","13.059","0.004","90","","90","","90","","928.4","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","silver iododiphosphate","","","- Ag5 I O7 P2 -","- Ag5 I O7 P2 -","- Ag20 I4 O28 P8 -","4","1","BR1248","Adams, Stefan; Preusser, Andrea","Silver-ion conduction pathways in Ag~5~IP~2~O~7~","Acta Crystallographica Section C","1999","55","11","1741","1743","10.1107/S0108270199009634","","","0.71073","MoKα","","0.028","0.025","","","","0.063","","","","","","1.118","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009103","8.4551","0.0003","8.4551","0.0003","8.4551","0.0003","90","","90","","90","","604.44","0.04","293","2","298","2","","","","","","","","4","F d -3 m :2","-F 4vw 2vw 3","227","Franklinite","Zinc Iron Oxide","","- Fe1.96 Mn0.36 O4 Zn0.68 -","- Fe2 Mn0.35 O4 Zn0.65 -","- Fe16 Mn2.8 O32 Zn5.2 -","8","0.0416667","BR1249","Doriguetto, Antônio C.; Fernandes, Nelson G.","Manganese-rich natural Franklinite","Acta Crystallographica Section C","1999","55","11","1751","1753","10.1107/S0108270199010045","","","0.71073","MoKα","","0.018","0.017","","","","0.026","","","","","","1.3","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009104","8.045","0.002","18.037","0.002","10.056","0.001","90","","99.27","0.01","90","","1440.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","Tetrakis(Cyclopropylammonium)Cyclotetraphosphate Tetrahydrate","","- C12 H40 N4 O16 P4 -","- C12 H40 N4 O16 P4 -","- C24 H80 N8 O32 P8 -","2","0.5","CF1294","Soumhi, El Hassane; Saadoune, Ismael; Driss, Ahmed; Jouini, Tahar","Tetrakis(cyclopropylammonium) cyclotetraphosphate tetrahydrate","Acta Crystallographica Section C","1999","55","11","1932","1934","10.1107/S010827019900877X","","","0.71069","MoKα","","0.0396","0.0335","","","","0.0906","","","","","","1.058","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009105","13.0824","0.0019","18.808","0.003","29.608","0.005","90","","90","","90","","7285","2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","(R,R)-Jacobsen's Catalyst","(1R,2R)-(-)-1,2-Cyclohexanediamino-N,N'-bis(3,5-di-t-butyl-salicylidene) manganese(III) chloride: A Jacobsen's Catalyst","","- C36 H52 Cl Mn N2 O2 -","- C36 H52 Cl Mn N2 O2 -","- C288 H416 Cl8 Mn8 N16 O16 -","8","2","CF1320","Yoon, Jae Woong; Yoon, Tae-Sung; Lee, Soon Won; Shin, Whanchul","(1<i>R</i>,2<i>R</i>)-(‒)-[Bis(3,5-di-<i>tert</i>-butylsalicylidene)-1,2-cyclohexanediamine]chloromanganese(III), an (<i>R</i>,<i>R</i>)-Jacobsen catalyst","Acta Crystallographica Section C","1999","55","11","1766","1769","10.1107/S0108270199009397","","","0.71073","MoKα","","0.065","0.048","","","","0.138","","","","","","1.029","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009106","11.905","0.002","9.9448","0.0014","14.8508","0.0015","90","","110.079","0.01","90","","1651.4","0.4","150","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H13 Cl5 O3 Zr -","- C18 H24 Cl10 O6 Zr2 -","- C36 H48 Cl20 O12 Zr4 -","2","0.5","CF1324","Coles, Simon J.; Hursthouse, Michael B.; Kelly, David G.; Walker, Neil M.","The salt of the di-μ-chloro-bis[tetrachlorozirconium(IV)] anion with protonated 1,3,5-trimethoxybenzene as cation","Acta Crystallographica Section C","1999","55","11","1789","1791","10.1107/S0108270199010355","","","0.71069","MoKα","","","0.036","","","","0.147","","","","","","0.975","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009107","12.0332","0.0006","10.5925","0.0006","12.1984","0.0007","90","","107.432","0.003","90","","1483.42","0.14","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Cl3 H6 In O3 -","- Cl3 H6 In O3 -","- Cl24 H48 In8 O24 -","8","2","CF1325","Aris, Damian R.; Errington, William; Willey, Gerald R.","<i>fac</i>-Triaquatrichloroindium(III)","Acta Crystallographica Section C","1999","55","11","1746","1748","10.1107/S0108270199008793","","","0.71073","MoKα","","0.028","0.022","","","","0.048","","","","","","0.977","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009108","9.645","0.008","9.994","0.002","12.918","0.006","90","","90","","90","","1245.2","1.2","203","2","203","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","bis(trimetylamine) aluminiumtrichloride","","- C6 H18 Al Cl3 N2 -","- C6 H18 Al Cl3 N2 -","- C24 H72 Al4 Cl12 N8 -","4","0.5","CF1327","Gelbrich, Thomas; Dümichen, Ulf; Sieler, Joachim","Bis-adduct of trimethylamine with aluminium trichloride","Acta Crystallographica Section C","1999","55","11","1797","1798","10.1107/S0108270199009658","","","0.71069","MoKα","","0.026","0.02","","","","0.059","","","","","","1.053","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009109","10.1159","0.0005","15.5291","0.0007","13.363","0.0006","90","","110.744","0.001","90","","1963.12","0.16","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3'-(2,3-Dimethyl-5-oxo-1-phenyl-3-pyrazolin-4-yl) Spiro (5-fluoro-3H-indol-3,2'-thiazolidine)-2,4'-(1H)-dione","","- C21 H17 F N4 O3 S -","- C21 H17 F N4 O3 S -","- C84 H68 F4 N16 O12 S4 -","4","1","CF1329","Jain, Subhash C.; Sinha, Juhi; Bhagat, Sunita; Babu, B. Ravindra; Bali, Shilpika","3'-(2,3-Dimethyl-5-oxo-1-phenyl-3-pyrazolin-4-yl)-5-fluorospiro[3<i>H</i>-indole-3,2'-thiazolidine]-2(1<i>H</i>),4'-dione","Acta Crystallographica Section C","1999","55","11","1826","1829","10.1107/S010827019900966X","","","0.71073","MoKα","","0.053","0.037","","0.097","0.09","","","","1.03","1.094","1.094","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009110","11.7637","0.0013","13.961","0.0015","9.6642","0.001","90","","113.054","0.003","90","","1460.4","0.3","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3-Diphenyl-5-acetoxyisoxazolidene","","- C17 H17 N O3 -","- C17 H17 N O3 -","- C68 H68 N4 O12 -","4","1","CF1330","Mukherjee, Shubhasish; Parmar, Virinder S; Errington, William","5-Acetoxy-2,3-diphenylisoxazolidine and 5-acetoxy-3-(4-nitrophenyl)-2-phenylisoxazolidine","Acta Crystallographica Section C","1999","55","11","1829","1831","10.1107/S0108270199010367","","","0.71073","MoKα","","0.0955","0.0505","","","","0.123","","","","","","0.997","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009111","17.9115","0.0013","11.6279","0.0013","7.701","0.0007","90","","95.842","0.003","90","","1595.6","0.3","180","2","180","2","","","","","","","","4","C 1 c 1","C -2yc","9","","2-phenyl-3-(4-nitrophenyl)-5-acetoxyisoxazolidine","","- C17 H16 N2 O5 -","- C17 H16 N2 O5 -","- C68 H64 N8 O20 -","4","1","CF1330","Mukherjee, Shubhasish; Parmar, Virinder S; Errington, William","5-Acetoxy-2,3-diphenylisoxazolidine and 5-acetoxy-3-(4-nitrophenyl)-2-phenylisoxazolidine","Acta Crystallographica Section C","1999","55","11","1829","1831","10.1107/S0108270199010367","","","0.71073","MoKα","","0.0632","0.0431","","","","0.0977","","","","","","0.912","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009112","17.3562","0.0019","6.0765","0.0006","15.8695","0.0017","90","","98.732","0.004","90","","1654.3","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(4-Chlorophenyl-N-methylcyanamide","","- C8 H7 Cl N2 -","- C8 H7 Cl N2 -","- C64 H56 Cl8 N16 -","8","1","CF1331","Cunningham, Ian D.; Light, Mark E.; Hursthouse, Michael B.","<i>N</i>-(4-Chlorophenyl)-<i>N</i>-methylcyanamide","Acta Crystallographica Section C","1999","55","11","1833","1835","10.1107/S0108270199010379","","","0.71073","MoKα","","","0.0486","","","","0.1408","","","","","","0.993","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009113","6.108","0.001","7.026","0.002","11.492","0.002","97.21","0.02","99.23","0.02","96.39","0.02","478.57","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2,2'-bipyridine-5-sulfonic acid","","- C10 H8 N2 O3 S -","- C10 H8 N2 O3 S -","- C20 H16 N4 O6 S2 -","2","1","DA1080","Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.","2,2'-Bipyridine-5-sulfonic acid","Acta Crystallographica Section C","1999","55","11","1921","1923","10.1107/S0108270199010203","","","0.71069","MoKα","","0.032","0.029","","0.082","0.077","","","","1.075","1.105","1.105","","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009114","6.2452","0.0005","7.869","0.0006","24.151","0.0014","90","","90","","90","","1186.86","0.15","297","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H18 N2 O3 -","- C12 H18 N2 O3 -","- C48 H72 N8 O12 -","4","1","DA1097","Billodeaux, Damon R.; Fronczek, Frank R.; Dürüst, Yaşar","2,6-Dimethylspiro[1-oxa-2,5-diazabicyclo[3.3.0]octane-3,1'-cyclohexane]-4,6-dione","Acta Crystallographica Section C","1999","55","11","1943","1945","10.1107/S0108270199010082","","","1.54184","CuKα","","0.036","0.034","","","","0.106","","","","","","1.063","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009115","9.866","0.002","6.01","0.003","21.697","0.005","90","","99.58","0.01","90","","1268.6","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(±)-endo3-Benzoylbicyclo[2.2.1]heptane-endo2-carboxylic acid","","- C15 H16 O3 -","- C15 H16 O3 -","- C60 H64 O12 -","4","1","FG1565","Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.","(±)-3-Benzoylbicyclo[2.2.1]heptane-2-carboxylic acid: structures and hydrogen-bonding patterns of the di-<i>endo</i> and the 2-<i>endo</i>-3-<i>exo</i> isomers","Acta Crystallographica Section C","1999","55","11","1905","1908","10.1107/S0108270199009245","","","0.71073","MoKα","","0.106","0.052","","","","0.122","","","","","","1.06","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009116","7.646","0.002","10.799","0.004","15.446","0.005","90","","93.02","0.02","90","","1273.6","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(±)-exo3-Benzoylbicyclo[2.2.1]heptane-endo2-carboxylic acid","","- C15 H16 O3 -","- C15 H16 O3 -","- C60 H64 O12 -","4","1","FG1565","Brunskill, Andrew P. J.; Lalancette, Roger A.; Thompson, Hugh W.","(±)-3-Benzoylbicyclo[2.2.1]heptane-2-carboxylic acid: structures and hydrogen-bonding patterns of the di-<i>endo</i> and the 2-<i>endo</i>-3-<i>exo</i> isomers","Acta Crystallographica Section C","1999","55","11","1905","1908","10.1107/S0108270199009245","","","0.71073","MoKα","","0.067","0.044","","","","0.101","","","","","","1.02","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009117","10.399","0.002","15.132","0.003","14.28","0.003","90","","91.21","0.03","90","","2246.6","0.8","150","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H9 N3 O2 S2 -","- C9 H9 N3 O2 S2 -","- C72 H72 N24 O16 S16 -","8","2","FG1566","Hughes, David S.; Hursthouse, Michael B.; Threlfall, Terry; Tavener, Stewart","A new polymorph of sulfathiazole","Acta Crystallographica Section C","1999","55","11","1831","1833","10.1107/S0108270199010112","","","0.71073","MoKα","","","0.046","","","","0.079","","","","","","0.858","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009118","12.269","0.002","6.081","0.001","20.176","0.002","90","","102.629","0.009","90","","1468.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H13 Cl3 O Te -","- C12 H13 Cl3 O Te -","- C48 H52 Cl12 O4 Te4 -","4","1","FG1570","Zukerman-Schpector, J.; Camillo, Robinson L.; Comasseto, João V.; Cunha, Rodrigo L. O. R.; Lemos, Francisco C.D.; Caracelli, I.","Acetonyldichloro[(<i>Z</i>)-2-chloro-1-methyl-2-phenylethenyl]tellurium(IV)","Acta Crystallographica Section C","1999","55","11","1930","1932","10.1107/S0108270199009269","","","0.71073","MoKα","","0.039","0.03","","","","0.086","","","","","","1.047","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009119","7.385","0.001","11.491","0.002","15.202","0.002","90","","101.94","0.01","90","","1262.1","0.3","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","(+)-3-Oxoglycyrrhetinic acid","(+)-10,13-dioxo-2α,4aβ,6aα,6bβ,9,9,-12aβ-heptamethyl -1,2,3,4,4a,5,6,6a,6b,7,8,8aα,9,10,11,12,12a,12bα,13,14bβ -icosahydropicene-2β-carboxylic acid","","- C30 H44 O4 -","- C30 H44 O4 -","- C60 H88 O8 -","2","1","FG1571","Brunskill, Andrew P. J.; Thompson, Hugh W.; Lalancette, Roger A.","(+)-3-Oxoglycyrrhetinic acid: catemeric hydrogen bonding in a non-racemic triterpenoid diketo acid","Acta Crystallographica Section C","1999","55","11","1902","1905","10.1107/S0108270199010124","","","0.71073","MoKα","","0.061","0.041","","","","0.095","","","","","","1.03","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009120","10.741","0.001","12.387","0.001","12.196","0.002","90","","112.61","0.01","90","","1497.9","0.3","295","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C17 H10 Cl N3 O S -","- C17 H10 Cl N3 O S -","- C68 H40 Cl4 N12 O4 S4 -","4","1","FR1204","Özbey, Süheyla; Kendi, Engin; Tozkoparan, Birsen; Ertan, Mevlüt","6-Benzylidene-2-(2-chlorophenyl)thiazolo[3,2-<i>b</i>]-1,2,4-triazol-5(6<i>H</i>)-one","Acta Crystallographica Section C","1999","55","11","1939","1941","10.1107/S0108270199009816","","","0.71069","MoKα","","","0.035","","","","0.045","","","","","","0.9","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009121","15.14","0.002","9.671","0.001","7.621","0.002","90","","117.85","0.01","90","","986.6","0.3","296","","296","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","acenaphthene-5,6-dicarboxylic anhydride","","","- C14 H8 O3 -","- C14 H8 O3 -","- C56 H32 O12 -","4","0.5","FR1213","Blackburn, Anthony C.; Fitzgerald, Lawrence J.; Gerkin, Roger E.","C—H···O interactions in acenaphthene-5,6-dicarboxylic anhydride","Acta Crystallographica Section C","1999","55","11","1852","1854","10.1107/S0108270199009270","","","0.71073","MoKα","","","0.041","","","","0.079","","","","","","1.85","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009122","10.4475","0.0001","10.4475","0.0001","22.8183","0.0002","90","","90","","90","","2490.62","0.04","293","2","293","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","10,11-Dibromo-3,6-ditosyl-3,6-diazabicyclo[6.4.0]dodeca-1(8),9,11-triene","","- C24 H24 Br2 N2 O4 S2 -","- C24 H24 Br2 N2 O4 S2 -","- C96 H96 Br8 N8 O16 S8 -","4","0.5","FR1214","Şamil Işık; Sema Öztürk; Hoong-Kun Fun; Erbil Ag̃ar; Selami Şaşmaz","10,11-Dibromo-3,6-ditosyl-3,6-diazabicyclo[6.4.0]dodeca-1(8),9,11-triene","Acta Crystallographica Section C","1999","55","11","1850","1852","10.1107/S0108270199010136","","","0.71073","MoKα","","0.128","0.06","","","","0.141","","","","","","1.01","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009123","4.963","0.001","10.458","0.002","28.31","0.004","90","","94.716","0.016","90","","1464.4","0.5","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 N O2 S -","- C18 H15 N O2 S -","- C72 H60 N4 O8 S4 -","4","1","FR1217","Luck, Rudy L.; Bates, Dallas K.; Li, Kexue; Xia, Mingde","1-[(1,3-Dihydro-2-benzothienyl)acetyl]-1<i>H</i>-indole <i>S</i>-oxide","Acta Crystallographica Section C","1999","55","11","1873","1874","10.1107/S0108270199010148","","","0.71069","MoKα","","","0.035","","","","0.104","","","","","","1.053","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009124","9.374","0.002","10.391","0.001","13.41","0.001","90","","105.54","0.01","90","","1258.5","0.3","296","","296","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","2',5'-dimethylbiphenyl-2-carboxylic acid","","","- C15 H14 O2 -","- C15 H14 O2 -","- C60 H56 O8 -","4","1","FR1218","Gerkin, Roger E.","2',5'-Dimethylbiphenyl-2-carboxylic acid","Acta Crystallographica Section C","1999","55","11","1859","1861","10.1107/S010827019900904X","","","0.71073","MoKα","","","0.056","","","","0.063","","","","","","1.52","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009125","5.318","0.001","23.1","0.001","7.619","0.002","90","","109.92","0.01","90","","880","0.3","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","3-(2-methylphenyl)propan-1-oic acid","","","- C10 H12 O2 -","- C10 H12 O2 -","- C40 H48 O8 -","4","1","FR1221","Gerkin, Roger E.","3-(2-Methylphenyl)propanoic acid","Acta Crystallographica Section C","1999","55","11","1857","1859","10.1107/S0108270199009063","","","0.71073","MoKα","","","0.051","","","","0.082","","","","","","1.44","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009126","17.4","0.003","27.085","0.002","6.119","0.002","90","","90","","90","","2883.8","1.1","296","","296","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C18 H14 O4 -","- C18 H14 O4 -","- C144 H112 O32 -","8","1","FR1226","Aumiller, Wade D.; Gerkin, Roger E.","Network of C—H···O interactions in dimethyl anthracene-1,8-dicarboxylate","Acta Crystallographica Section C","1999","55","11","1855","1857","10.1107/S010827019900983X","","","0.71073","MoKα","","","0.063","","","","0.076","","","","","","1.29","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009127","10.361","0.006","8.144","0.004","20.158","0.003","90","","101.299","0.008","90","","1668","1.3","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Bis(1-dimethylaminomethyl-8-dimethylammoniomethylnaphthalene) 3,4-dioxocyclobut-1-ene-1,2-diolate dihydrate","","- C36 H50 N4 O6 -","- C36 H50 N4 O6 -","- C72 H100 N8 O12 -","2","0.5","GD1043","Bouma, Barend; Kooijman, Huub; Kroon, Jan; Grech, Eugeniusz; Brzezinski, Bogumił","1,8-Bis(dimethylaminomethyl)naphthalene bis(squaric acid) dihydrate","Acta Crystallographica Section C","1999","55","11","1824","1826","10.1107/S0108270199009853","","","0.71073","MoKα","","0.0787","0.0483","","","","0.1366","","","","","","1.043","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009128","9.8833","0.001","17.9581","0.001","19.2752","0.001","90","","90.578","0.01","90","","3420.9","0.4","120","2","120","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(8-Dimethylamino-1-naphtyl)dimethylammonium 6-fluoro-2-(trifluoromethyl)-4-quinolinolate -6-fluoro-2-(trifluoromethyl)-4-quinolinol","","- C36 H31 F8 N5 O2 -","- C34 H28 F8 N4 O2 -","- C136 H112 F32 N16 O8 -","4","0.5","GD1044","Vergeer, Peter; Kooijman, Huub; Schreurs, Antoine M.M.; Kroon, Jan; Grech, Eugeniusz","1,8-Bis(dimethylamino)naphthalene bis[6-fluoro-2-(trifluoromethyl)-4-quinolinol] acetonitrile solvate","Acta Crystallographica Section C","1999","55","11","1822","1824","10.1107/S0108270199009671","","","0.7173","MoKα","","0.0896","0.058","","","","0.12","","","","","","1.119","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009129","7.3872","0.0009","9.6082","0.0013","7.4972","0.0014","90","","115.444","0.01","90","","480.52","0.13","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","(+)-trans-Pinononic acid","(+)-trans-3-acetyl-2,2-dimethylcyclobutanecarboxylic acid","","- C9 H14 O3 -","- C9 H14 O3 -","- C18 H28 O6 -","2","1","GD1053","Barcon, Alan; Brunskill, Andrew P. J.; Thompson, Hugh W.; Lalancette, Roger A.","(+)-<i>trans</i>-Pinononic acid: hydrogen-bonding patterns in a non-racemic δ-keto acid","Acta Crystallographica Section C","1999","55","11","1899","1902","10.1107/S0108270199010380","","","0.71073","MoKα","","0.041","0.035","","","","0.09","","","","","","1.06","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009130","8.623","0.002","8.631","0.0008","14.896","0.003","90","","102.848","0.009","90","","1080.9","0.3","293","2","293","2","","","","","","","","5","P 1 c 1","P -2yc","7","yttrium sodium oxalate tetrahydrate","","","- C4 H8 Na O12 Y -","- C4 H8 Na O12 Y -","- C16 H32 Na4 O48 Y4 -","4","2","GS1049","Bataille, Thierry; Louër, Daniel","Yttrium sodium oxalate tetrahydrate, [Y(H~2~ O)]Na(C~2~O~4~)~2~^.^3H~2~O","Acta Crystallographica Section C","1999","55","11","1760","1762","10.1107/S0108270199009683","","","0.71073","MoKα","","0.115","0.042","","","","0.096","","","","","","1.011","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009131","11.2968","0.0004","11.8091","0.0007","12.8835","0.001","90","","90","","90","","1718.72","0.18","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","7-Chloro-(S)-3-[1-(cyclohexyl)ethylamino]-4H-1,2,4-benzothiadiazine 1,1-dioxide","","- C15 H20 Cl N3 O2 S -","- C15 H20 Cl N3 O2 S -","- C60 H80 Cl4 N12 O8 S4 -","4","1","GS1050","Dupont, Léon; de Tullio, Pascal; Khelili, Smail; Somers, Fabian; Delarge, Jacques; Pirotte, Bernard","7-Chloro-(<i>R</i>)-3-[1-(cyclohexyl)ethylamino]-4<i>H</i>-1,2,4-benzothiadiazine 1,1-dioxide and 7-chloro-(<i>S</i>)-3-[1-(cyclohexyl)ethylamino]-4<i>H</i>-1,2,4-benzothiadiazine 1,1-dioxide","Acta Crystallographica Section C","1999","55","11","1945","1947","10.1107/S0108270199010069","","","1.5418","CuKα","","0.0533","0.0402","","","","0.1118","","","","","","1.035","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009132","11.2963","0.0008","11.8026","0.0011","12.8831","0.0011","90","","90","","90","","1717.6","0.2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","7-Chloro-(R)-3-[1-(cyclohexyl)ethylamino]-4H-1,2,4-benzothiadiazine 1,1-dioxide","","- C15 H20 Cl N3 O2 S -","- C15 H20 Cl N3 O2 S -","- C60 H80 Cl4 N12 O8 S4 -","4","1","GS1050","Dupont, Léon; de Tullio, Pascal; Khelili, Smail; Somers, Fabian; Delarge, Jacques; Pirotte, Bernard","7-Chloro-(<i>R</i>)-3-[1-(cyclohexyl)ethylamino]-4<i>H</i>-1,2,4-benzothiadiazine 1,1-dioxide and 7-chloro-(<i>S</i>)-3-[1-(cyclohexyl)ethylamino]-4<i>H</i>-1,2,4-benzothiadiazine 1,1-dioxide","Acta Crystallographica Section C","1999","55","11","1945","1947","10.1107/S0108270199010069","","","1.5418","CuKα","","0.0482","0.0354","","","","0.098","","","","","","0.988","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009133","11.963","0.002","7.824","0.002","17.573","0.002","90","0.02","106.9","0.02","90","0.03","1573.8","0.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","Salannin","Salannin","","- C34 H44 O9 -","- C34 H44 O9 -","- C68 H88 O18 -","2","1","HA1256","V. Kabaleeswaran; S. S. Rajan; Geetha Gopalakrishnan; T. R. Govindachari","Salannin and 3-deacetylsalannin","Acta Crystallographica Section C","1999","55","11","1952","1955","10.1107/S010827019900880X","","","1.5418","CuKα","","0.08","0.058","","","","0.212","","","","","","0.833","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009134","7.236","0.003","12.764","0.004","31.892","0.004","90","","90","","90","","2945.6","1.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","3-deacetylsalannin","3-deacetylsalannin","","- C32 H42 O8 -","- C32 H42 O8 -","- C128 H168 O32 -","4","1","HA1256","V. Kabaleeswaran; S. S. Rajan; Geetha Gopalakrishnan; T. R. Govindachari","Salannin and 3-deacetylsalannin","Acta Crystallographica Section C","1999","55","11","1952","1955","10.1107/S010827019900880X","","","1.5418","CuKα","","0.05","0.044","","","","0.134","","","","","","1.079","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009135","29.0676","0.0002","8.8013","0.0001","18.447","0.0001","90","","125.978","0.001","90","","3819.1","0.07","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","1,1'-Diacetylferrocene bis(thiosemicarbazone) monohydrate","","- C16 H22 Fe N6 O S2 -","- C16 H22 Fe N6 O S2 -","- C128 H176 Fe8 N48 O8 S16 -","8","1","HA1259","Wen Xiao; Zhong-Lin Lu; Rui-Ying Li; Cheng-Xong Su; Bei-Sheng Kang; S. Shanmuga Sundara Raj; Hoong-Kun Fun","1,1'-Diacetylferrocene bis(thiosemicarbazone) monohydrate","Acta Crystallographica Section C","1999","55","11","1762","1764","10.1107/S0108270199008811","","","0.71073","MoKα","","0.056","0.038","","","","0.092","","","","","","1.08","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009136","11.611","0.005","10.297","0.006","13.165","0.003","90","","115.58","0.03","90","","1419.7","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H11 Cl N4 Ni S -","- C13 H11 Cl N4 Ni S -","- C52 H44 Cl4 N16 Ni4 S4 -","4","1","HA1262","Liu, Ze-Hua; Liu, Yong-Jiang; Duan, Chun-Ying; You, Xiao-Zeng","(2-Benzoylpyridine-<i>N</i> thiosemicarbazonato-<i>N</i>^1^,<i>S</i>)chloronickel(II)","Acta Crystallographica Section C","1999","55","11","1804","1806","10.1107/S0108270199008823","","","0.71073","MoKα","","0.065","0.038","","0.091","0.08","","","","1.024","1.076","1.076","","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009137","9.919","0.001","12.898","0.002","14.045","0.002","90","","101.983","0.005","90","","1757.7","0.4","220","2","220","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,10,13,18-tetraazatetracyclo[8.6.6.0^3,8^]docasa-3,5,7-triene-11,17-dione monohydrate","","- C18 H28 N4 O3 -","- C18 H28 N4 O3 -","- C72 H112 N16 O12 -","4","1","HA1263","Hubin, Timothy J.; Tyryshkin, Nickolay; Alcock, Nathaniel W.; Busch, Daryle H.","An <i>o</i>-xylyl cross-bridged 5,12-dioxocyclam","Acta Crystallographica Section C","1999","55","11","1888","1889","10.1107/S0108270199008835","","","0.71073","MoKα","","0.071","0.047","","","0.124","0.137","","","","","","1.061","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2009138","10.7311","0.0007","23.123","0.002","11.0657","0.0008","90","","112.043","0.004","90","","2545.1","0.3","300","2","300","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","14,14-Dimethyl-12-oxa-tricyclo[9.2.1.03,8]tetradeca- 3,5,7-trien-13-one","","- C15 H18 O2 -","- C15 H13.5 O2 -","- C120 H108 O16 -","8","2","JA1001","Zimmer, Reinhold; Zahn, Gernot; Khan, Faiz Ahmed; Reissig, Hans-Ulrich","Configurational analysis of 14,14-dimethyl-12-oxatricyclo[9.2.1.0^3,8^]tetradeca-3,5,7-trien-13-one","Acta Crystallographica Section C","1999","55","11","1941","1943","10.1107/S0108270199009014","","","0.71073","MoKα","","0.0943","0.0514","","","","0.1185","","","","","","1.138","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009139","8.906","0.001","18.295","0.002","21.855","0.003","90","","90","","90","","3561","0.7","291","2","18","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","phenanthroline–tetraaqua–zinc(II) sulfate dihydrate","","- C12 H20 N2 O10 S Zn -","- C12 H20 N2 O10 S Zn -","- C96 H160 N16 O80 S8 Zn8 -","8","1","JA1003","Zhang, Cungen; Yu, Kaibei; Wu, Dan; Zhao, Chengxue","Tetraaqua(1,10-phenanthroline)zinc(II) sulfate dihydrate","Acta Crystallographica Section C","1999","55","11","1815","1817","10.1107/S0108270199009294","","","0.71073","MoKα","","0.073","0.035","","0.077","","0.07","","","0.841","","","1.008","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009140","11.101","0.002","8.404","0.002","12.836","0.003","90","","92.68","0.03","90","","1196.2","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H14 N2 O2 -","- C14 H14 N2 O2 -","- C56 H56 N8 O8 -","4","1","JZ1351","Wolska, Irena; Herold, Franciszek","4-Phenyl-2,3,5,6,7,8-hexahydro-1<i>H</i>-pyrido[1,2-<i>c</i>]pyrimidine-1,3-dione","Acta Crystallographica Section C","1999","55","11","1950","1952","10.1107/S0108270199009026","","","1.54178","CuKα","","0.0473","0.0419","","0.1397","","0.1194","","","1.049","","","1.102","","","","has coordinates,has disorder","301791","2025-08-18","23:15:33",""
"2009141","11.015","0.002","7.678","0.003","30.045","0.004","90","","99.02","0.01","90","","2509.6","1.1","293","2","293","2","","","","","","","","2","P 1 21 1","P 2yb","4","","","","- C30 H50 -","- C30 H50 -","- C120 H200 -","4","2","JZ1362","González-Platas, Javier; Ruiz-Pérez, Catalina; González, Antonio G.; Hernández Silva, Margarita; García, Candelaria; Alfayate, M. Carmen; Bermejo, Jaime","Filic-3-ene, a pentacyclic triterpene from <i>Davallia canariensis</i>","Acta Crystallographica Section C","1999","55","11","1835","1837","10.1107/S0108270199009762","","","0.71073","MoKα","","0.1598","0.0598","","","","0.1971","","","","","","0.884","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009142","8.762","0.001","9.596","0.002","16.363","0.003","90","","90","","90","","1375.8","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3-hydroxy-3-hydroxymethyl-9-methyl-6-methyleneperhydroazuleno[4,5-b]furan- 2,8-dione","","- C15 H20 O5 -","- C15 H20 O5 -","- C60 H80 O20 -","4","1","JZ1363","González-Platas, Javier; Ruiz-Pérez, Catalina; González, Antonio G.; Bermejo, Jaime; Medjroubi, Kamel","4β,15-Dihydro-3-dehydrosolstitialin A","Acta Crystallographica Section C","1999","55","11","1837","1839","10.1107/S010827019900918X","","","0.71073","MoKα","","0.045","0.034","","","","0.098","","","","","","1.031","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009143","9.377","0.002","9.94","0.001","15.344","0.002","93.06","0.02","98.17","0.03","98.23","0.02","1397.1","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Diacetato-bis(3-amino-5-phenylpyrazole)zinc(II)","","- C24 H32 N6 O6 Zn -","- C24 H32 N6 O6 Zn -","- C48 H64 N12 O12 Zn2 -","2","1","KA1325","Jaćimović, Zeljko K.; Tomić, Zoran D.; Bogdanović, Goran A.; Ivegeš, Erika Z.; Leovac, Vukadin M.","Transition metal complexes with pyrazole-derived ligands. X. [Zn(CH~3~COO)~2~<i>L</i>~2~]^.^2MeOH (<i>L</i> = 3-amino-5-phenylpyrazole)","Acta Crystallographica Section C","1999","55","11","1769","1771","10.1107/S0108270199010331","","","0.71073","MoKα","","0.0845","0.0506","","0.1643","","0.1459","","","1.027","","","1.131","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009144","5.826","0.001","17.925","0.004","17.949","0.004","90","","90","","90","","1874.4","0.7","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C8 H24 Cl5 N2 Sb -","- C8 H24 Cl5 N2 Sb -","- C32 H96 Cl20 N8 Sb4 -","4","1","KA1330","Bujak, Maciej; Zaleski, Jacek","Phase transition in bis(ethyldimethylammonium) pentachloroantimonate(III)","Acta Crystallographica Section C","1999","55","11","1775","1778","10.1107/S0108270199009464","","","0.71073","MoKα","","0.04","0.03","","","","0.079","","","","","","1.121","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2009145","7.5598","0.0001","15.5263","0.0002","13.0732","0.0002","90","","98.1394","0.001","90","","1519.02","0.04","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-(2-hydroxyphenyl)-1-(2,4-dinitrophenyl)-4-methyl-1H-pyrazole.","","- C16 H12 N4 O5 -","- C16 H12 N4 O5 -","- C64 H48 N16 O20 -","4","1","KA1331","Jeyakanthan, J.; Velmurugan, D.; Selvi, S.; Perumal, P. T","1-(2,4-Dinitrophenyl)-3-(2-hydroxyphenyl)-4-methyl-1<i>H</i>-pyrazole","Acta Crystallographica Section C","1999","55","11","1926","1928","10.1107/S0108270199008276","","","1.5418","CuKα","","0.0777","0.0524","","","","0.2397","","","","","","1.094","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009146","7.242","0.0014","10.862","0.002","14.2846","0.0016","90","","90","","90","","1123.7","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","8-Aza-7-deaza-2'-deoxyadenosine","","","- C10 H13 N5 O3 -","- C10 H13 N5 O3 -","- C40 H52 N20 O12 -","4","1","KA1335","Seela, Frank; Zulauf, Matthias; Reuter, Hans; Kastner, Guido","The anomers of 8-aza-7-deaza-2'-deoxyadenosine","Acta Crystallographica Section C","1999","55","11","1947","1950","10.1107/S010827019901015X","","","0.71073","MoKα","","0.035","0.033","","","","0.088","","","","","","1.065","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009147","5.869","0.0006","10.8869","0.0013","17.5477","0.0014","90","","90","","90","","1121.2","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","9-(2'-deoxy-α-D-erythro-pentofuranosyl)-8-aza-7-deazaadenine","","","- C10 H13 N5 O3 -","- C10 H13 N5 O3 -","- C40 H52 N20 O12 -","4","1","KA1335","Seela, Frank; Zulauf, Matthias; Reuter, Hans; Kastner, Guido","The anomers of 8-aza-7-deaza-2'-deoxyadenosine","Acta Crystallographica Section C","1999","55","11","1947","1950","10.1107/S010827019901015X","","","0.71073","MoKα","","0.046","0.041","","","","0.11","","","","","","1.065","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:33",""
"2009148","18.864","0.008","14.476","0.004","5.473","0.001","90","","90","","90","","1494.5","0.8","293","2","293","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","Carpaine","Carpaine","","- C28 H50 N2 O4 -","- C28 H50 N2 O4 -","- C56 H100 N4 O8 -","2","0.5","NA1417","V.Kabaleeswaran; S.S.Rajan; G.N.Krishnakumari; T.R.Govindachari","Conformational flexibility of carpaine and its hydrobromide derivative","Acta Crystallographica Section C","1999","55","11","1935","1937","10.1107/S0108270199008938","","","1.5418","CuKα","","0.0462","0.0413","","","","0.1363","","","","","","1.438","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009149","11.96","0.001","7.403","0.001","18.978","0.001","90","0.01","99.67","0.01","90","0.01","1656.4","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","Carpaine hydrobromide","Carpaine hydrobromide","","- C28 H54 Br2 N2 O5 -","- C28 H54 Br2 N2 O5 -","- C56 H108 Br4 N4 O10 -","2","1","NA1417","V.Kabaleeswaran; S.S.Rajan; G.N.Krishnakumari; T.R.Govindachari","Conformational flexibility of carpaine and its hydrobromide derivative","Acta Crystallographica Section C","1999","55","11","1935","1937","10.1107/S0108270199008938","","","1.5418","CuKα","","0.0536","0.0359","","","","0.0908","","","","","","1.101","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009150","13.4224","0.0001","11.1181","0.0001","7.5341","0.0006","90","","97.761","0.003","90","","1114.03","0.09","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N,N'-Bis(picolinoyl)hydrazine","","- C12 H10 N4 O2 -","- C12 H10 N4 O2 -","- C48 H40 N16 O8 -","4","0.5","NA1420","Sichang Shao; Dunru Zhu; You Song; Xiao Zeng You; S. Shanmuga Sundara Raj; Hoong-Kun Fun","<i>N</i>,<i>N</i>'-Bis(picolinoyl)hydrazine","Acta Crystallographica Section C","1999","55","11","1841","1843","10.1107/S0108270199009890","","","0.71073","MoKα","","0.072","0.052","","","","0.146","","","","","","1.042","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009151","9.341","0.0001","9.8782","0.0001","12.4671","0.0002","87.427","0.001","88.548","0.001","88.604","0.001","1148.53","0.03","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-Chloro-2-(n-morpholinomethyl)-1-phenol","","- C11 H14 Cl N O2 -","- C11 H14 Cl N O2 -","- C44 H56 Cl4 N4 O8 -","4","2","NA1421","Hoong-Kun Fun; S. Shanmuga Sundara Raj; Kandasamy Chinnakali; Jing-Zhi Tian; Zhen Shen; Jin-Qi Zhang; Xiao-Zeng You","4-Chloro-2-(morpholinomethyl)phenol","Acta Crystallographica Section C","1999","55","11","1843","1845","10.1107/S0108270199009907","","","0.71073","MoKα","","0.154","0.065","","","","0.205","","","","","","1.007","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009152","12.783","0.004","16.645","0.003","9.834","0.003","90","","90","","90","","2092.4","1","298","","298","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","endo-{6,6'-Diethoxy-2,2'-[(R)-propane-1,2-diylbis(nitrilomethylidene)] diphenolato-O,N,N',O'}oxovanadium(IV)","","","- C21 H24 N2 O5 V -","- C21 H24 N2 O5 V -","- C84 H96 N8 O20 V4 -","4","1","OA1089","Hoshina, Gakuse; Tsuchimoto, Masanobu; Ohba, Shigeru","<i>endo</i>-{6,6'-Diethoxy-2,2'-[(<i>R</i>)-propane-1,2-diylbis(nitrilomethylidene)]diphenolato-<i>O</i>,<i>N</i>,<i>N</i>',<i>O</i>'}oxovanadium(IV)","Acta Crystallographica Section C","1999","55","11","1812","1813","10.1107/S0108270199008847","","","0.71073","MoKα","","0.067","0.048","","","","0.12","","","","","","1.25","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009153","7.419","0.002","7.419","","19.935","0.004","90","","90","","90","","1097.3","0.4","293","","293","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","Dichlorobis(pyrimidine)cobalt(II)","","- C8 H8 Cl2 Co N4 -","- C8 H8 Cl2 Co N4 -","- C32 H32 Cl8 Co4 N16 -","4","0.25","OA1090","Hashizume, Daisuke; Takayama, Ryo; Nakayama, Kensuke; Ishida, Takayuki; Nogami, Takashi; Yasui, Masanori; Iwasaki, Fujiko","Dichlorobis(pyrimidine-<i>N</i>)cobalt(II) and its bromo derivative","Acta Crystallographica Section C","1999","55","11","1793","1797","10.1107/S0108270199009221","","","0.71073","MoKα","","0.042","0.031","","","","0.0735","","","","","","1.025","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009154","7.576","0.001","7.576","","19.889","0.002","90","","90","","90","","1141.54","0.19","293","","293","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","Dibromobis(pyrimidine)cobalt(II)","","- C8 H8 Br2 Co N4 -","- C8 H8 Br2 Co N4 -","- C32 H32 Br8 Co4 N16 -","4","0.25","OA1090","Hashizume, Daisuke; Takayama, Ryo; Nakayama, Kensuke; Ishida, Takayuki; Nogami, Takashi; Yasui, Masanori; Iwasaki, Fujiko","Dichlorobis(pyrimidine-<i>N</i>)cobalt(II) and its bromo derivative","Acta Crystallographica Section C","1999","55","11","1793","1797","10.1107/S0108270199009221","","","0.71073","MoKα","","0.0636","0.051","","","","0.1398","","","","","","1.037","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009155","7.357","0.002","15.528","0.002","15.137","0.002","90","","94.68","0.02","90","","1723.5","0.6","293.2","","293.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H20 Cl2 N4 O2 Pt -","- C14 H20 Cl2 N4 O2 Pt -","- C56 H80 Cl8 N16 O8 Pt4 -","4","1","OA1091","Kato, Masako; Takahashi, Junko","Anion-controlled π-stacks of (ethylenediamine-<i>N</i>,<i>N</i>')(1,10-phenanthroline-<i>N</i>,<i>N</i>')platinum(II)","Acta Crystallographica Section C","1999","55","11","1809","1812","10.1107/S0108270199008859","","","0.7107","MoKα","","0.041","0.026","","0.08","","0.08","","","0.929","","","0.929","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009156","7.483","0.004","15.061","0.004","18.836","0.005","90","","99.7","0.04","90","","2092.5","1.4","295.2","","295.2","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C14 H16 F12 N4 P2 Pt -","- C14 H16 F12 N4 P2 Pt -","- C56 H64 F48 N16 P8 Pt4 -","4","1","OA1091","Kato, Masako; Takahashi, Junko","Anion-controlled π-stacks of (ethylenediamine-<i>N</i>,<i>N</i>')(1,10-phenanthroline-<i>N</i>,<i>N</i>')platinum(II)","Acta Crystallographica Section C","1999","55","11","1809","1812","10.1107/S0108270199008859","","","0.7107","MoKα","","0.061","0.046","","0.669","","0.127","","","5.962","","","1.306","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009157","10.8176","0.0018","9.7701","0.0013","15.242","0.003","90","","108.832","0.018","90","","1524.7","0.5","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","N-[phenyl(2,4,6-tri-tert-butylphenyl)selenonio]-4-toluenesulfonamidate","","- C31 H41 N O2 S Se -","- C31 H41 N O2 S Se -","- C62 H82 N2 O4 S2 Se2 -","2","1","OA1092","Yasui, Masanori; Taka, Hideo; Shimizu, Toshio; Kamigata, Nobumasa; Iwasaki, Fujiko","Absolute configuration of 2,4,6-tri-<i>tert</i>-butyl-diphenylselenonium-<i>N</i>-toluene-4'-sulfonimide","Acta Crystallographica Section C","1999","55","11","1861","1862","10.1107/S0108270199008860","","","0.71073","MoKα","","0.063","0.039","","","","0.105","","","","","","1.033","","","","has coordinates","301791","2025-08-18","23:15:33",""
"2009158","13.356","0.005","23.06","0.005","14.719","0.005","90","0.005","90","0.005","90","0.005","4533","2","296","2","296","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C19 H25 Ca N3 O5 S2 -","- C19 H25 Ca N3 O5 S2 -","- C152 H200 Ca8 N24 O40 S16 -","8","1","OB1014","Kubo, Kanji; Yamamoto, Emi; Kato, Nobuo; Mori, Akira","<i>N</i>-(Tropon-2-yl)-1,4,7,10-tetraoxa-13-azacyclopentadecane with calcium thiocyanate","Acta Crystallographica Section C","1999","55","11","1819","1821","10.1107/S0108270199009300","","","1.54184","CuKα","","0.061","0.04","","","","0.117","","","","","","1.04","","","","has coordinates,has Fobs","201955","2020-10-21","18:00:00",""
"2009159","8.296","0.005","6.654","0.002","10.993","0.002","90","","101.6","0.03","90","","594.4","0.4","297","","296","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C10 H6 Cl2 N2 O4 -","- C10 H6 Cl2 N2 O4 -","- C20 H12 Cl4 N4 O8 -","2","0.25","OB1016","Ishida, Hiroyuki; Kashino, Setsuo","1:1 Complexes of chloranilic acid with pyrazine and morpholine: one- and two-dimensional hydrogen-bond networks","Acta Crystallographica Section C","1999","55","11","1923","1926","10.1107/S0108270199009841","","","0.71073","MoKα","","0.039","0.037","","0.087","","0.084","","","1.76","","","1.76","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009160","9.222","0.002","9.241","0.004","8.644","0.004","116.26","0.03","113.55","0.03","92.65","0.03","582.9","0.5","300","","300","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H11 Cl2 N O5 -","- C10 H11 Cl2 N O5 -","- C20 H22 Cl4 N2 O10 -","2","1","OB1016","Ishida, Hiroyuki; Kashino, Setsuo","1:1 Complexes of chloranilic acid with pyrazine and morpholine: one- and two-dimensional hydrogen-bond networks","Acta Crystallographica Section C","1999","55","11","1923","1926","10.1107/S0108270199009841","","","0.71073","MoKα","","0.046","0.045","","0.079","","0.077","","","1.51","","","1.51","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009161","13.142","0.01","15.479","0.008","14.712","0.006","90","","109.83","0.04","90","","2815","3","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Chloro-(meso-tetrapropylporphyrinato)-iron(III)","","- C32 H36 Cl Fe N4 -","- C32 H36 Cl Fe N4 -","- C128 H144 Cl4 Fe4 N16 -","4","1","OB1017","Ohgo, Yoshiki; Ikeue, Takahisa; Nakamura, Mikio","Chloro(<i>meso</i>-tetrapropylporphyrinato)iron(III)","Acta Crystallographica Section C","1999","55","11","1817","1819","10.1107/S0108270199009312","","","0.71069","MoKα","","0.1109","0.052","","","","0.208","","","","","","1.11","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009162","3.3504","0.0003","5.8341","0.0007","12.07","0.005","90","","90","","90","","235.93","0.1","296.2","","295","","","","","","","","","4","C m c m","-C 2c 2","63","","","","- Fe0.33 In O3.33 Ti0.67 -","- Fe0.33 In O3.33 Ti0.67 -","- Fe1.32 In4 O13.32 Ti2.68 -","4","0.25","OH1115","Michiue, Yuichi; Brown, Francisco; Kimizuka, Noboru; Watanabe, Mamoru; Orita, Masahiro; Ohta, Hiromichi","Orthorhombic InFe~0.33~Ti~0.67~O~3.33~","Acta Crystallographica Section C","1999","55","11","1755","1757","10.1107/S0108270199009038","","","0.7107","MoKα","","0.0508","0.0323","","0.0569","","0.0569","","","3.957","","","3.957","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009163","16.249","0.002","16.3338","0.0012","17.414","0.003","81.362","0.01","87.18","0.012","67.335","0.009","4216.3","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Tris[3,6-bis(2'-pyridyl)pyridazine-N^1^,N^6^]nickel(II) diperchlorate 0.11-hydrate","","- C42 H30.22 Cl2 N12 Ni O8.11 -","- C42 H30.226 Cl2 N12 Ni O8.113 -","- C168 H120.904 Cl8 N48 Ni4 O32.452 -","4","2","OS1057","Jau-Shuenn Wang; Chou-Fu Sheu; Jung-Si Lee","Tris[3,6-bis(2-pyridyl)pyridazine-<i>N</i>^1^,<i>N</i>^6^]nickel(II) diperchlorate 0.11-hydrate","Acta Crystallographica Section C","1999","55","11","1806","1809","10.1107/S0108270199009087","","","0.71073","MoKα","","0.096","0.057","","0.168","0.139","","","","1.046","1.081","1.081","","","","","has coordinates","211159","2020-10-21","18:00:00",""
"2009164","5.4902","0.0007","10.2004","0.0012","12.373","0.003","90","","100.783","0.014","90","","680.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Calcium dibarium bis(hydrogenphosphate) bis(dihydrogenphosphate)","","- Ba2 Ca H6 O16 P4 -","- Ba2 Ca H6 O16 P4 -","- Ba4 Ca2 H12 O32 P8 -","2","0.5","OS1058","Ben Tahar, Lotfi; Smiri, Leila; Driss, Ahmed","Refinement of CaBa~2~(HPO~4~)~2~(H~2~PO~4~)~2~","Acta Crystallographica Section C","1999","55","11","1757","1759","10.1107/S0108270199009427","","","0.71073","MoKα","","0.032","0.02","","0.047","","0.043","","","1.078","","","1.119","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009165","9.0081","0.001","9.5235","0.001","11.934","0.0013","97.054","0.009","105.34","0.009","106.471","0.009","924.9","0.19","295","","","","","","","","","","","7","P -1","-P 1","2","","","","- C17 H16 Br2 Cu Hg N2 O2 -","- C17 H16 Br2 Cu Hg N2 O2 -","- C34 H32 Br4 Cu2 Hg2 N4 O4 -","2","1","OS1060","Kaynak, F. Betül; Ülkü, Dinçer; Atakol, Orhan; Durmus̨, Sefa","{[μ-Bis(salicylidene)-1,3-propanediaminato]-copper(II)}dibromomercury(II)","Acta Crystallographica Section C","1999","55","11","1784","1785","10.1107/S0108270199009191","","","0.71073","MoKα","","","0.024","","","","0.032","","","","","","1.14","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009166","15.502","0.007","10.91","0.004","3.848","0.001","90","","90","","90","","650.8","0.4","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","Niobium heptaoxide chloride","","- Cl Nb3 O7 -","- Cl Nb3 O7 -","- Cl4 Nb12 O28 -","4","0.5","QA0167","Kim, Jongmin; Dong, Yongkwan; Yun, Hoseop","Redetermination of Nb~3~O~7~Cl","Acta Crystallographica Section C","1999","55","11","IUC9900133","","10.1107/S0108270199098601","","","0.7107","MoKα","","0.038","0.037","","","","0.0981","","","","","","1.14","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009167","28.91","0.003","5.519","0.001","8.601","0.002","90","","95.25","0.01","90","","1366.6","0.4","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,5-Diphenylpentane-2,4-dione","","- C17 H16 O2 -","- C17 H16 O2 -","- C68 H64 O8 -","4","0.5","QA0181","Pulkkinen, Juha T.; Ahlgrén, Markku J.","1,5-Diphenylpentane-2,4-dione and 1,5-bis(2-naphthyl)pentane-2,4-dione","Acta Crystallographica Section C","1999","55","11","IUC9900142","","10.1107/S0108270199098546","","","1.54178","CuKα","","0.04","0.035","","","","0.098","","","","","","1.071","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009168","37.501","0.008","5.805","0.001","8.313","0.002","90","","90.09","0.03","90","","1809.7","0.7","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,5-Di-(2-naphtyl)pentane-2,4-dione","","- C25 H20 O2 -","- C25 H20 O2 -","- C100 H80 O8 -","4","0.5","QA0181","Pulkkinen, Juha T.; Ahlgrén, Markku J.","1,5-Diphenylpentane-2,4-dione and 1,5-bis(2-naphthyl)pentane-2,4-dione","Acta Crystallographica Section C","1999","55","11","IUC9900142","","10.1107/S0108270199098546","","","0.71073","MoKα","","0.0794","0.0441","","","","0.0931","","","","","","1.03","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009169","14.9099","0.0013","14.9099","0.0013","8.548","0.002","90","","90","","90","","1900.3","0.5","150","2","150","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","5-Hydroxy-1-phosphabicyclo[3.3.1]nonansulfide","","- C8 H15 O P S -","- C8 H15 O P S -","- C64 H120 O8 P8 S8 -","8","1","QA0182","Ziemer, Burkhard; Krauss, Babett","5-Hydroxy-1-phosphabicyclo[3.3.1]nonane <i>P</i>-sulfide","Acta Crystallographica Section C","1999","55","11","IUC9900143","","10.1107/S0108270199098534","","","0.71073","MoKα","","0.021","0.02","","0.055","0.054","","","","1.079","1.083","1.083","","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009170","13.108","0.003","11.694","0.002","13.41","0.003","90","","116.71","0.02","90","","1836.2","0.7","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","cis-1-Phosphabicyclo[4.3.0]nonansulfide","","- C8 H15 P S -","- C8 H15 P S -","- C64 H120 P8 S8 -","8","2","QA0183","Krauss, Babett; Ziemer, Burkhard","<i>cis</i>-1-Phosphabicyclo[4.3.0]nonane <i>P</i>-sulfide","Acta Crystallographica Section C","1999","55","11","IUC9900148","","10.1107/S0108270199098522","","","0.71073","MoKα","","0.058","0.035","","0.105","0.079","","","","0.925","1.062","1.062","","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009171","12.208","0.0015","8.4399","0.0012","16.375","0.003","90","","100.429","0.01","90","","1659.3","0.4","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","ap 9-(o-Isopropylphenyl)-9-fluorenol","","- C22 H20 O -","- C22 H20 O -","- C88 H80 O4 -","4","1","QB0106","Hou, Yuqing; Robinson, Paul D.; Meyers, Cal Y.","<i>ap</i>-9-(<i>o</i>-Isopropylphenyl)-9-fluorenol","Acta Crystallographica Section C","1999","55","11","IUC9900144","","10.1107/S0108270199098510","","","0.71069","MoKα","","0.116","0.036","","","","0.114","","","","","","1.001","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009172","8.746","0.005","23.837","0.005","9.982","0.005","90","","125.43","0.03","90","","1695.7","1.5","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","AP-9-(o-isopropylphenyl)-9-fluorenyl Peroxide","","- C44 H38 O2 -","- C44 H38 O2 -","- C88 H76 O4 -","2","0.5","QB0107","Robinson, Paul D.; Hou, Yuqing; Meyers, Cal Y.","<i>ap</i>-9-(<i>o</i>-Isopropylphenyl)-9-fluorenyl peroxide","Acta Crystallographica Section C","1999","55","11","IUC9900147","","10.1107/S0108270199098509","","","0.71069","MoKα","","0.137","0.04","","","","0.121","","","","","","1.01","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009173","8.1295","0.0011","13.7607","0.0013","10.0224","0.0019","90","","107.804","0.01","90","","1067.5","0.3","153","2","153","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(+)-(2S,3S,4S,5S,R~S~)-2-{N-[(R)-1-Hydroxy-3-methylbut-2-yl]-4-methylphenyl- sulfonimidoylmethyl}-4-hydroxy-3-methyl-1-azabicyclo[3.3.0]octane","","- C21 H34 N2 O3 S -","- C21 H34 N2 O3 S -","- C42 H68 N4 O6 S2 -","2","1","QB0109","Heinrich, Timo; Reggelin, Michael; Bats, Jan W.","(+)-(2<i>S</i>,3<i>S</i>,4<i>S</i>,5<i>S</i>,<i>R</i>~S~)-4-Hydroxy-2-{<i>N</i>-[(<i>R</i>)-1-Hydroxy-3-methylbut-2-yl]-4-methylphenylsulfonimidoylmethyl}-3-methyl-1-azabicyclo[3.3.0]octane at 153K","Acta Crystallographica Section C","1999","55","11","IUC9900131","","10.1107/S0108270199098492","","","0.71073","MoKα","","0.0835","0.0633","","","","0.1417","","","","","","1.277","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009174","9.0144","0.0003","18.0745","0.0004","9.1181","0.0003","90","","90.548","0.002","90","","1485.55","0.08","100","1","100","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","4-Hydroxyisochroman-3-one","","- C9 H8 O3 -","- C9 H8 O3 -","- C72 H64 O24 -","8","2","QB0110","Kresge, A. J.; Lough, Alan J.; Popik, V. V.","4-Hydroxyisochroman-3-one","Acta Crystallographica Section C","1999","55","11","IUC9900138","","10.1107/S0108270199098480","","","0.71073","MoKα","","0.064","0.04","","","","0.105","","","","","","0.994","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009175","27.22","0.003","4.1574","0.0006","17.2303","0.0014","90","","123.817","0.006","90","","1620","0.3","100","0.1","100","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,3-Dihydrobenzo[c]thiophene-1-carboxylic Acid","","- C9 H8 O2 S -","- C9 H8 O2 S -","- C72 H64 O16 S8 -","8","1","QB0112","Kresge, A. J.; Lough, Alan J.; Popik, V. V.","1,3-Dihydrobenzo[<i>c</i>]thiophene-1-carboxylic acid","Acta Crystallographica Section C","1999","55","11","IUC9900139","","10.1107/S0108270199098479","","","0.71073","MoKα","","0.049","0.036","","","","0.098","","","","","","1.088","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009176","7.9452","0.0003","3.9485","0.0002","8.7627","0.0004","90","","102.119","0.003","90","","268.77","0.02","100","0.1","100","2","","","","","","","","4","P 1 n 1","P -2yac","7","","2-Hydroxy-N-methylcyanoacetamide","","- C4 H6 N2 O2 -","- C4 H6 N2 O2 -","- C8 H12 N4 O4 -","2","1","QB0114","Kresge, A. J.; Lough, Alan J.; Popik, V. V.","2-Hydroxy-<i>N</i>-methylcyanoacetamide","Acta Crystallographica Section C","1999","55","11","IUC9900140","","10.1107/S0108270199098467","","","0.71073","MoKα","","0.026","0.024","","","","0.061","","","","","","1.066","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009177","7.108","0.001","25.795","0.001","10.69","0.001","90","","94.88","0.01","90","","1952.9","0.3","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(Napthalene-2,3-diolato)(1,3-diphenylpropen-1,3-diolato)boron","","- C25 H17 B O4 -","- C25 H17 B O4 -","- C100 H68 B4 O16 -","4","1","QB0115","Lim, Hock Chuan; Tou, Teck Yong; Ng, Seik Weng; Huang, You-Qing; Hu, Sheng-Zhi; Rapta, Peter; Chow, Yuan L.; Ishiyama, Jun-Ichi","(1,3-Diphenylpropene-1,3-diolato)(naphthalene-2,3-diolato)boron","Acta Crystallographica Section C","1999","55","11","IUC9900135","","10.1107/S0108270199098455","","","1.54178","CuKα","","0.095","0.06","","","","0.18","","","","","","1.014","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009178","9.986","0.001","14.823","0.002","9.514","0.001","98.24","0.01","91.32","0.01","80.49","0.01","1374.6","0.3","297","","","","","","","","","","","3","P 1","P 1","1","","","","- C34 H34 O4 -","- C34 H34 O4 -","- C68 H68 O8 -","2","2","QB0116","Hamazaki, Hiroshi; Hosomi, Hiroyuki; Ohba, Shigeru","A triclinic polymorph of (<i>R</i>,<i>R</i>)-(–)-<i>trans</i>-1,4-dioxaspiro[4,5]decane-2,3-diylbis(diphenylmethanol)","Acta Crystallographica Section C","1999","55","11","IUC9900132","","10.1107/S0108270199098443","","","0.71073","MoKα","","","0.035","","","","0.083","","","","","","1.05","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009179","11.964","0.003","10.021","0.003","25.021","0.006","90","","94.69","0.02","90","","2989.8","1.4","296","2","296","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","fac-[aqua-tricarbonyl-(1,2-bis(diphenylphosphino)ethane-P,P')manganese] tetrafluoroborate","","- C29 H26 B F4 Mn O4 P2 -","- C29 H26 B F4 Mn O4 P2 -","- C116 H104 B4 F16 Mn4 O16 P8 -","4","1","QB0117","Becker, Thomas M.; Krause Bauer, Jeanette A.","<i>fac</i>-Aqua[1,2-bis(diphenylphosphino)ethane-<i>P</i>,<i>P</i>']tricarbonylmanganese tetrafluoroborate (monoclinic form)","Acta Crystallographica Section C","1999","55","11","IUC9900141","","10.1107/S010827019909856X","","","0.71073","MoKα","","0.097","0.054","","0.279","","0.126","","","","","","1.059","","","","has coordinates,has Fobs","201201","2020-10-21","18:00:00",""
"2009180","4.9511","0.001","8.0427","0.0016","8.4362","0.0017","90","","90","","90","","335.93","0.12","293","2","293","2","","","","","","","","2","I m m a","-I 2b 2","74","","","","- Ag2 Ba -","- Ag2 Ba -","- Ag8 Ba4 -","4","0.25","QB0118","Kang, Sung Kwon; Miller, Gordon J.","BaAg~2~","Acta Crystallographica Section C","1999","55","11","IUC9900134","","10.1107/S0108270199098595","","","0.71073","MoKα","","0.057","0.037","","","","0.074","","","","","","1.277","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009181","10.72","0.002","10.7","0.002","15.35","0.002","90","","90","","90","","1760.7","0.5","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C9 H6 N2 O4 -","- C9 H6 N2 O4 -","- C72 H48 N16 O32 -","8","1","QB0119","Kovalevsky, A. Yu.; Ponomarev, I. I.","2-Methyl-7-nitro-4<i>H</i>-3,1-benzoxazin-4-one","Acta Crystallographica Section C","1999","55","11","IUC9900136","","10.1107/S0108270199098431","","","0.71073","MoKα","","0.072","0.041","","0.149","","0.119","","","1","","","1.195","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009182","10.8394","0.0006","10.9358","0.0006","12.7335","0.0007","83.858","0.001","66.789","0.001","84.065","0.001","1376.16","0.13","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","(2,2'-Dipyridyl-N,N')bis(1,1,1- trifluoro-4-phenylbutane-2,4-dionato-O,O')manganese(II)","","- C30 H20 F6 Mn N2 O4 -","- C30 H20 F6 Mn N2 O4 -","- C60 H40 F12 Mn2 N4 O8 -","2","1","QB0121","Dickman, Michael H.","(2,2'-Bipyridyl-<i>N</i>,<i>N</i>')bis(4,4,4-trifluoro-1-phenylbutane-1,3-dionato-<i>O</i>,<i>O</i>')manganese(II) at 173K","Acta Crystallographica Section C","1999","55","11","IUC9900146","","10.1107/S0108270199098558","","","0.71073","MoKα","","0.076","0.045","","","","0.13","","","","","","1.014","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009183","9.563","0.002","9.563","0.002","23.347","0.005","90","","90","","90","","2135.1","0.8","150","2","150","2","","","","","","","","5","I -4 2 d","I -4 2bw","122","","Tetrachloro(1,2-dimethoxyethane)titanium(IV)","","- C4 H10 Cl4 O2 Ti -","- C4 H10 Cl4 O2 Ti -","- C32 H80 Cl32 O16 Ti8 -","8","0.5","QB0122","Batsanov, Andrei S.; Howard, Judith A. K.; Hughes, Andrew K.; Kingsley, Andrew J.","Tetrachloro(1,2-dimethoxyethane-<i>O</i>,<i>O</i>')titanium(IV)","Acta Crystallographica Section C","1999","55","11","IUC9900137","","10.1107/S0108270199098571","","","0.71073","MoKα","","0.02","0.019","","","","0.052","","","","","","1.016","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009184","8.5812","0.001","9.9084","0.0011","5.8016","0.0009","90","","105.128","0.01","90","","476.19","0.11","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- H Na2 O5 P Zn -","- H Na2 O5 P Zn -","- H4 Na8 O20 P4 Zn4 -","4","1","QB0123","Ng, Hunt Y.; Harrison, William T. A.","Sodium zinc phosphate hydroxide, Na~2~Zn(OH)PO~4~","Acta Crystallographica Section C","1999","55","11","IUC9900145","","10.1107/S0108270199098583","","","0.71073","MoKα","","","0.0295","","","","0.0307","","","","","","0.997","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009185","6.3618","0.0014","7.5586","0.0012","11.059","0.002","90","","90","","90","","531.79","0.17","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- F5 H8 N2 Ti -","- F5 H8 N2 Ti -","- F20 H32 N8 Ti4 -","4","0.5","SK1262","Dadachov, Mike; Eriksson, Lars","Diammonium titanium pentafluoride, (NH~4~)~2~TiF~5~, containing Ti^3+^","Acta Crystallographica Section C","1999","55","11","1739","1741","10.1107/S0108270199008689","","","0.71073","MoKα","","0.0779","0.0333","","","","0.0649","","","","","","0.737","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009186","21.897","0.002","6.8919","0.0005","21.694","0.002","90","","90.953","0.007","90","","3273.4","0.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","21,22,23,24-Tetraoxaquaterene-2,7,12,17-tetraspirocyclohexane","","- C40 H48 O4 -","- C40 H48 O4 -","- C160 H192 O16 -","4","0.5","SK1288","Pajewski, Robert; Pęcak, Agnieszka; Ostaszewski, Ryszard; Jurczak, Janusz","Tetracyclohexyloxaquaterene","Acta Crystallographica Section C","1999","55","","1862","1864","10.1107/S0108270199009099","","","1.54178","CuKα","","0.067","0.051","","0.146","","0.135","","","1.154","","","1.154","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009187","28.194","0.001","9.5793","0.0004","6.905","0.0003","90","","90","","90","","1864.89","0.13","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","5-Nitroisophthalic acid hydrate","","- C8 H7 N O7 -","- C8 H7 N O7 -","- C64 H56 N8 O56 -","8","1","SK1301","Ajit Kumar Mahapatra; Avijit Adak; Shyamaprosad Goswami; Gur Dayal Nigam; Kandasamy Chinnakali; S. Shanmuga Sundara Raj; Ibrahim Abdul Razak; Hoong-Kun Fun","5-Nitroisophthalic acid hydrate","Acta Crystallographica Section C","1999","55","11","1845","1847","10.1107/S0108270199009105","","","0.71073","MoKα","","0.105","0.056","","","","0.127","","","","","","1.03","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009188","9.6596","0.0018","7.0354","0.0012","12.436","0.002","90","","90","","90","","845.1","0.3","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","Rubidiumtetrathiomolybdat","dirubidium tetrasulfidomolybdate(2-)","","- Mo Rb2 S4 -","- Mo Rb2 S4 -","- Mo4 Rb8 S16 -","4","0.5","SK1304","Ellermeier, Jan; Näther, Christian; Bensch, Wolfgang","Rb~2~MoS~4~","Acta Crystallographica Section C","1999","55","11","1748","1751","10.1107/S0108270199008549","","","0.71073","MoKα","","0.048","0.027","","","","0.066","","","","","","0.998","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009189","19.7378","0.001","5.5717","0.0002","25.6759","0.0011","90","","128.311","0.003","90","","2215.6","0.19","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4'-Bipyridyl–4,4–thiodiphenol (3/2)","","- C54 H44 N6 O4 S2 -","- C54 H44 N6 O4 S2 -","- C108 H88 N12 O8 S4 -","2","0.5","SK1306","Lough, Alan J.; Gregson, Richard M.; Ferguson, George; Glidewell, Christopher","Centrosymmetric molecular strings in the hydrogen-bonded structure of 4,4'-bipyridyl–4,4'-thiodiphenol (3/2)","Acta Crystallographica Section C","1999","55","11","1890","1892","10.1107/S0108270199008963","","","0.71073","MoKα","","0.0774","0.0405","","","","0.1016","","","","","","0.956","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009190","21.097","0.005","5.356","0.007","26.09","0.004","90","","107.173","0.013","90","","2817","4","173","1","173","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","N-phenyl-5-benzylidene-rhodanine","3-phenyl-5-(phenylmethylidene)-2-thioxo-1,3-thiazolidin-4-one","","- C16 H11 N O S2 -","- C16 H11 N O S2 -","- C128 H88 N8 O8 S16 -","8","1","SK1307","Linden, Anthony; Awad, Enas M. A. H.; Heimgartner, Heinz","A rhodanine derivative and its cycloadduct with diphenyl nitrile imine","Acta Crystallographica Section C","1999","55","11","1877","1881","10.1107/S0108270199008975","","","0.71069","MoKα","","0.0729","0.0481","","","","0.1582","","","","","","1.032","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009191","9.91","0.003","16.737","0.003","14.412","0.002","90","","93.571","0.017","90","","2385.8","0.9","173","1","173","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,4,9-triphenyl-7-(phenymethylidene)-1,6-dithia-3,4,9- triazaspiro[4.4]non-2-en-8-one","","- C29 H21 N3 O S2 -","- C29 H21 N3 O S2 -","- C116 H84 N12 O4 S8 -","4","1","SK1307","Linden, Anthony; Awad, Enas M. A. H.; Heimgartner, Heinz","A rhodanine derivative and its cycloadduct with diphenyl nitrile imine","Acta Crystallographica Section C","1999","55","11","1877","1881","10.1107/S0108270199008975","","","0.71069","MoKα","","0.0747","0.0431","","","","0.1152","","","","","","1.035","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009192","10.7817","0.0003","7.4435","0.0002","15.9041","0.0004","90","","95.405","0.001","90","","1270.69","0.06","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Di-μ-azido-bis[2-(2-aminoethyl)pyridine-aquo]dicopper(II) diperchlorate","","- C14 H24 Cl2 Cu2 N10 O10 -","- C14 H24 Cl2 Cu2 N10 O10 -","- C28 H48 Cl4 Cu4 N20 O20 -","2","0.5","SK1311","Ibrahim Abdul Razak; Hoong-Kun Fun; Kandasamy Chinnakali; S. Shanmuga Sundara Raj; Jia-Cheng Liu; Xiao-Zeng You","Di-μ-azido-bis{[2-(2-aminoethyl)pyridine-<i>N</i>,<i>N</i>']aquacopper(II)} diperchlorate","Acta Crystallographica Section C","1999","55","11","1764","1766","10.1107/S0108270199008987","","","0.71073","MoKα","","0.037","0.03","","","","0.082","","","","","","1.1","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009193","9.877","0.001","4.737","0.001","12.877","0.001","90","","112.044","0.002","90","","558.44","0.14","298","2","298","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","DL-cysteine","","","- C3 H7 N O2 S -","- C3 H7 N O2 S -","- C12 H28 N4 O8 S4 -","4","1","SK1312","Luger, Peter; Weber, Manuela","<small>DL</small>-Cysteine at 298K","Acta Crystallographica Section C","1999","55","11","1882","1885","10.1107/S0108270199009208","","","0.71073","MoKα","","0.074","0.06","","","","0.202","","","","","","1.06","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009194","10.9776","0.0001","14.0734","0.0002","17.3262","0.0002","90","","90","","90","","2676.76","0.05","293","2","293","2","","","","","","","","6","P b c m","-P 2c 2b","57","","11-carboxylatomethyl-15-carboxymethyl- 11,15-diazonia-3,23-dioxa-28-thiatetracyclo[23.2.1.0^4,9^.0^17,22^octacosa- 4,6,8,17,19,21,25,27-octene bromide","","- C27 H31 Br N2 O6 S -","- C27 H31 Br N2 O6 S -","- C108 H124 Br4 N8 O24 S4 -","4","0.5","SK1313","Yin-Han Zhang; Suchada Chantrapromma; S. Shanmuga Sundara Raj; Hoong-Kun Fun; Yu-Peng Tian; Fu-Xin Xie; Zu-Yao Chen","11-Carboxylatomethyl-15-carboxymethyl-11,15-diazonia-3,23-dioxa-28-thiatetracyclo[23.2.1.0^4,9^.0^17,22^]octacosa-4,6,8,17,19,21,25,27-octaene bromide","Acta Crystallographica Section C","1999","55","11","1839","1841","10.1107/S0108270199009117","","","0.71073","MoKα","","0.075","0.057","","","","0.182","","","","","","1.077","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2009195","8.6658","0.0004","8.3101","0.0004","13.1431","0.0005","90","","98.336","0.001","90","","936.48","0.07","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-1,2-bis(3,4-dihydro-1-methoxynaphthalen-2-yl)ethylene","","- C24 H24 O2 -","- C24 H24 O2 -","- C48 H48 O4 -","2","0.5","SK1314","Jayanta Kumar Ray; Susmita Gupta; S. Shanmuga Sundara Raj; Hoong-Kun Fun","(<i>E</i>)-1,2-Bis(3,4-dihydro-1-methoxynaphthalen-2-yl)ethylene","Acta Crystallographica Section C","1999","55","11","1847","1849","10.1107/S010827019900921X","","","0.71073","MoKα","","0.068","0.048","","","","0.14","","","","","","1.051","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009196","3.7335","0.0007","20.116","0.004","18.033","0.004","90","","91.708","0.005","90","","1353.7","0.5","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,4'-Bipyridyl 3,4-dihydroxy-3-cyclobutenedione (2/3)","","- C32 H22 N4 O12 -","- C32 H22 N4 O12 -","- C64 H44 N8 O24 -","2","0.5","SK1316","MacLean, Elizabeth J.; Wheatley, Paul S.; Ferguson, George; Glidewell, Christopher","Self-templating of large rings by small rings in 4,4'-bipyridyl‒3,4-dihydroxy-3-cyclobutene-1,2-dione (2/3)","Acta Crystallographica Section C","1999","55","11","1892","1896","10.1107/S010827019900952X","","","0.6891","synchrotron","","0.12","0.058","","","","0.144","","","","","","0.894","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009197","8.3594","0.0003","6.936","0.0004","9.5026","0.0003","90","","109.462","0.002","90","","519.49","0.04","100","0.1","100","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Piperazinium squarate dihydrate","Piperazine‒3,4-dihydroxy-3-butenedione‒water (1/1/2)","","- C8 H16 N2 O6 -","- C8 H16 N2 O6 -","- C16 H32 N4 O12 -","2","0.5","SK1317","MacLean, Elizabeth J.; Wheatley, Paul S.; Ferguson, George; Glidewell, Christopher; Lough, Alan J.","A three-dimensional hydrogen-bonded framework in piperazine‒3,4-dihydroxy-3-cyclobutene-1,2-dione‒water (1/1/2)","Acta Crystallographica Section C","1999","55","11","1896","1899","10.1107/S0108270199009531","","","0.71073","MoKα","","0.049","0.037","","","","0.098","","","","","","1.088","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009198","8.3393","0.0008","6.936","0.0007","9.5034","0.0009","90","","109.294","0.002","90","","518.82","0.09","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Piperazinium squarate dihydrate","Piperazine‒3,4-dihydroxy-3-butenedione‒water (1/1/2)","","- C8 H16 N2 O6 -","- C8 H16 N2 O6 -","- C16 H32 N4 O12 -","2","0.5","SK1317","MacLean, Elizabeth J.; Wheatley, Paul S.; Ferguson, George; Glidewell, Christopher; Lough, Alan J.","A three-dimensional hydrogen-bonded framework in piperazine‒3,4-dihydroxy-3-cyclobutene-1,2-dione‒water (1/1/2)","Acta Crystallographica Section C","1999","55","11","1896","1899","10.1107/S0108270199009531","","","0.6891","synchrotron","","0.049","0.043","","","","0.115","","","","","","1.069","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009199","7.5611","0.0002","8.1393","0.0001","18.9671","0.0004","90","","94.798","0.001","90","","1163.18","0.04","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","7-Methoxy-2-methylnaphtho[1,2-b]thiophene","","- C14 H12 O S -","- C14 H12 O S -","- C56 H48 O4 S4 -","4","1","SK1318","Jayanta Kumar Ray; Dipanjan Pan; S. Shanmuga Sundara Raj; Hoong-Kun Fun","7-Methoxy-2-methylnaphtho[1,2-<i>b</i>]thiophene","Acta Crystallographica Section C","1999","55","11","1849","1850","10.1107/S0108270199009543","","","0.71073","MoKα","","0.057","0.041","","","","0.121","","","","","","1.043","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009200","16.318","0.001","7.362","0.001","8.229","0.001","90","","113.09","0.01","90","","909.38","0.19","173","2","173","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C14 H18 Br4 Ge N2 -","- C14 H18 Br4 Ge N2 -","- C28 H36 Br8 Ge2 N4 -","2","0.25","SK1320","Hensen, Karl; Faber, Alexander; Bolte, Michael","<i>trans</i>-Tetrabromobis(3,5-dimethylpyridine)germanium(IV), a non-merohedral twin","Acta Crystallographica Section C","1999","55","11","1774","1775","10.1107/S0108270199010409","","","0.71073","MoKα","","0.0934","0.0588","","","","0.1593","","","","","","0.998","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009201","9.7615","0.0009","13.0362","0.0012","9.7878","0.0009","90","","90.199","0.002","90","","1245.5","0.2","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Hexamethylenetetramine–2,2'-biphenol (1/2)","","- C30 H32 N4 O4 -","- C30 H32 N4 O4 -","- C60 H64 N8 O8 -","2","1","SK1324","MacLean, Elizabeth J.; Glidewell, Christopher; Ferguson, George; Gregson, Richard M.; Lough, Alan J.","Hexamethylenetetramine is a fourfold acceptor of O—H···N hydrogen bonds in its 1:2 adduct with 2,2'-biphenol","Acta Crystallographica Section C","1999","55","11","1867","1870","10.1107/S0108270199010422","","","0.6888","synchrotron","","0.075","0.066","","","","0.144","","","","","","1.101","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009202","14.19","0.003","57.435","0.01","17.4063","0.0018","90","","90","","90","","14186","4","293","2","293","2","","","","","","","","4","C 2 2 21","C 2c 2","20","C-Ile","Cytosinyl-L-isoleucine dipeptide","","- C52 H99 N16 O25.5 -","- C53 H99 N16 O24.5 -","- C424 H792 N128 O196 -","8","1","SX1078","Mitsunobu Doi; Kazuto Tsunemichi; Akiko Asano; Mariko Tarui; Toshimasa Ishida; Masaaki Shiono","<i>N</i>-[3-(Cytosin-1-yl)propionyl]-<small>L</small>-isoleucine, a heavily hydrated structure with four cytosine‒isoleucine hybrids in the asymmetric unit","Acta Crystallographica Section C","1999","55","11","1865","1867","10.1107/S0108270199003650","","","1.5418","CuKα","","0.086","0.076","","","","0.222","","","","","","1.003","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2009203","14.024","0.0019","18.884","0.001","19.6861","0.0016","90","","91.056","0.008","90","","5212.6","0.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C55 H56.34 I0.17 O6.49 P4 Re1.83 -","- C55 H56 I0.17 O6.49 P4 Re1.83 -","- C220 H224 I0.68 O25.96 P16 Re7.32 -","4","1","SX1086","Suescun, Leopoldo; Mombrú, Alvaro W.; Mariezcurrena, Raúl A.; Kremer, Carlos; Rivero, Mario; Kremer, Eduardo; Domínguez, Sixto; Mederos, Alfredo","[ReO~2~(dppp)~2~]I~<i>x~</i>[ReO~4~]~1-<i>x~</i>^.^<i>x</i>H~2~O^.^CH~3~OH for <i>x</i> = 0.17 (1), 0.36 (1) and 1 [dppp is 1,3-bis(diphenylphosphino)propane]","Acta Crystallographica Section C","1999","55","11","1785","1789","10.1107/S0108270199008628","","","0.71069","MoKα","","0.109","0.057","","","","0.171","","","","","","1.041","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009204","13.943","0.005","18.864","0.004","19.671","0.008","90","","91.23","0.03","90","","5173","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C55 H56.72 I0.36 O5.92 P4 Re1.64 -","- C55 H56 I0.358 O5.926 P4 Re1.642 -","- C220 H224 I1.432 O23.704 P16 Re6.568 -","4","1","SX1086","Suescun, Leopoldo; Mombrú, Alvaro W.; Mariezcurrena, Raúl A.; Kremer, Carlos; Rivero, Mario; Kremer, Eduardo; Domínguez, Sixto; Mederos, Alfredo","[ReO~2~(dppp)~2~]I~<i>x~</i>[ReO~4~]~1-<i>x~</i>^.^<i>x</i>H~2~O^.^CH~3~OH for <i>x</i> = 0.17 (1), 0.36 (1) and 1 [dppp is 1,3-bis(diphenylphosphino)propane]","Acta Crystallographica Section C","1999","55","11","1785","1789","10.1107/S0108270199008628","","","0.71069","MoKα","","0.11","0.064","","","","0.179","","","","","","1.018","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009205","13.832","0.007","18.746","0.01","19.654","0.007","90","","90.99","0.03","90","","5095","4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis[1,3-bis(diphenylphosphino)propane]dioxorhenium(V) iodide methanol solvate monohydrate","","- C55 H58 I O4 P4 Re -","- C55 H58 I O4 P4 Re -","- C220 H232 I4 O16 P16 Re4 -","4","1","SX1086","Suescun, Leopoldo; Mombrú, Alvaro W.; Mariezcurrena, Raúl A.; Kremer, Carlos; Rivero, Mario; Kremer, Eduardo; Domínguez, Sixto; Mederos, Alfredo","[ReO~2~(dppp)~2~]I~<i>x~</i>[ReO~4~]~1-<i>x~</i>^.^<i>x</i>H~2~O^.^CH~3~OH for <i>x</i> = 0.17 (1), 0.36 (1) and 1 [dppp is 1,3-bis(diphenylphosphino)propane]","Acta Crystallographica Section C","1999","55","11","1785","1789","10.1107/S0108270199008628","","","0.71069","MoKα","","0.12","0.077","","","","0.247","","","","","","1.049","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009206","8.889","0.001","8.107","0.001","28.715","0.001","90","","94.68","0.01","90","","2062.4","0.4","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cis-bis(ethylenediamine)-bis(pyridyl)nickel(II) nitrate","","- C14 H26 N8 Ni O6 -","- C14 H26 N8 Ni O6 -","- C56 H104 N32 Ni4 O24 -","4","1","SX1089","Baldwin, Michael J.; Krause Bauer, Jeanette A.","<i>cis</i>-Bis(ethylenediamine)bis(pyridine)nickel(II) dinitrate","Acta Crystallographica Section C","1999","55","11","1772","1773","10.1107/S0108270199010458","","","0.71073","MoKα","","0.102","0.055","","","","0.118","","","","","","1.018","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009207","6.484","0.0011","15.208","0.0011","28.047","0.003","90","","90","","90","","2765.7","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","[3S-(3a,3aα,5aβ,9aα,9bβ)]-9a-Acetyl-3a,4,5,5a,9a,9b-hexahydro -3,5a-dimethyl-2H-furo[3,2-h][1]benzopyran-2,8(3H)-dione,","","- C15 H18 O5 -","- C15 H18 O5 -","- C120 H144 O40 -","8","2","SX1090","Bates, R. B.; Malik, B. L.; Paknikar, S. K.; McClure, K. J.; Carducci, M. D.","An unexpected oxidation product of α-santonin","Acta Crystallographica Section C","1999","55","11","1881","1882","10.1107/S010827019901046X","","","0.71073","MoKα","","0.14","0.048","","","","0.118","","","","","","1.004","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009208","12.5471","0.0002","17.0445","0.0001","16.7432","0.0003","90","","111.06","0.001","90","","3341.51","0.09","203","2","203","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H37 Cl3 Ir N2 O2 P -","- C33 H37 Cl3 Ir N2 O2 P -","- C132 H148 Cl12 Ir4 N8 O8 P4 -","4","1","TA1247","Dinger, Maarten B.; Henderson, William; Oliver, Allen G.; Rickard, Clifton E. F.","[<i>N</i>-Acetyl-<i>N</i>'-methylureato(2 ‒)-<i>N</i>,<i>N</i>'](η^5^-pentamethylcyclopentadienyl)(triphenylphosphine-<i>P</i>)iridium(III) chloroform solvate","Acta Crystallographica Section C","1999","55","11","1778","1780","10.1107/S0108270199007581","","","0.71073","MoKα","","0.04","0.028","","","","0.066","","","","","","1.067","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009209","12.346","0.003","20.167","0.007","11.269","0.003","97.49","0.02","101.12","0.02","106.44","0.02","2589.1","1.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H58 Cu4 N2 O Se6 -","- C45 H58 Cu4 N2 O Se6 -","- C90 H116 Cu8 N4 O2 Se12 -","2","1","TA1255","Jin, Xianglin; Tang, Kaluo; Long, Yaoling; Tang, Youqi","A tetranuclear copper(I) cluster complex with a benzeneselenolate ligand, (Me~4~N)~2~[Cu~4~(SePh)~6~]^.^CH~3~OH","Acta Crystallographica Section C","1999","55","11","1799","1800","10.1107/S0108270199009403","","","0.71073","MoKα","","0.149","0.043","","","","0.108","","","","","","0.957","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009210","7.503","0.008","9.702","0.005","10.501","0.003","93.93","0.04","103.99","0.03","107.26","0.07","700.2","0.9","293","2","","","","","","","","","","5","P -1","-P 1","2","","4-Benzoimidazol-2-yl-pyridinium N-oxide dihydrogenphosphate monohydrate","","- C12 H14 N3 O6 P -","- C12 H14 N3 O6 P -","- C24 H28 N6 O12 P2 -","2","1","TA1261","Zhang, Bing-guang; Liu, Yong-Jiang; Gou, Shao-hua; Duan, Chun-Ying; You, Xiao-Zeng","4-(1<i>H</i>,3<i>H</i>^+^-1,3-Benzimidazol-2-ylio)pyridine <i>N</i>-oxide dihydrogenphosphate monohydrate","Acta Crystallographica Section C","1999","55","11","1929","1930","10.1107/S0108270199010185","","","0.71073","MoKα","","0.041","0.033","","0.094","0.089","","","","1.065","1.086","1.086","","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009211","9.272","0.002","11.134","0.008","10.434","0.005","90","","113.86","0.02","90","","985.1","0.9","100","","100","","","","","","","","","4","P 1 21 1","P 2yb","4","1,3-propane sultone","3-hydroxy-1-propanesulfonic acid γ-sultone","","- C3 H6 O3 S -","- C3 H6 O3 S -","- C24 H48 O24 S8 -","8","4","BK1475","Billodeaux, Damon R.; Owens, Clyde V.; Sayes, Christie M.; Soper, Steven A.; Fronczek, Frank R.","Pseudosymmetry with <i>Z</i>' = 4 in 1,3-propanesultone at 100K","Acta Crystallographica Section C","1999","55","12","2126","2129","10.1107/S0108270199011592","","","0.71073","MoKα","","0.049","0.039","","","","0.11","","","","","","1.042","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009212","13.177","0.002","5.111","0.001","12.972","0.002","90","","116.63","0.01","90","","781","0.2","293","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Copper(II) hydrogenphthalate dihydrate","","- C16 H14 Cu O10 -","- C16 H14 Cu O10 -","- C32 H28 Cu2 O20 -","2","0.5","BK1480","Rodrigues, Bernardo Lages; Costa, Marcia D. D.; Fernandes, Nelson G.","Diaquabis(hydrogen phthalato)copper(II), a new phase","Acta Crystallographica Section C","1999","55","12","1997","2000","10.1107/S0108270199011610","","","0.71073","MoKα","","0.035","0.029","","","","0.092","","","","","","1.11","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009213","11.793","0.007","7.766","0.002","14.926","0.004","90","","96.65","0.04","90","","1357.8","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","acetylferrocene thiosemicarbazone","","- C13 H15 Fe N3 S -","- C13 H15 Fe N3 S -","- C52 H60 Fe4 N12 S4 -","4","1","BK1482","Fang, Chen-Jie; Han, Gang; Liu, Yong-Jiang; Duan, Chun-Ying; Meng, Qing-Jin","Acetylferrocene thiosemicarbazone","Acta Crystallographica Section C","1999","55","12","2058","2060","10.1107/S010827019901077X","","","0.71073","MoKα","","0.052","0.044","","0.126","0.114","","","","1.085","1.081","1.081","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009214","5.894","0.001","8.806","0.001","17.176","0.001","90","","92.92","0.01","90","","890.32","0.19","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,4-Bis(2-hydroxy-5-methylbenzyl)piperazine","","- C20 H26 N2 O2 -","- C20 H26 N2 O2 -","- C40 H52 N4 O4 -","2","0.5","BK1485","Kuppayee, M.; Kumaran, D.; Ponnuswamy, M. N.; Kandaswamy, M.; Jayanthi Violet, M.; Chinnakali, K.; Hoong-Kun Fun","1,4-Bis(2-hydroxy-5-methylbenzyl)piperazine","Acta Crystallographica Section C","1999","55","12","2147","2149","10.1107/S0108270199010781","","","0.71073","MoKα","","0.068","0.044","","0.134","0.12","","","","0.868","0.975","0.975","","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009215","15.144","0.003","8.672","0.001","14.23","0.003","90","","124.79","0.01","90","","1534.8","0.5","298","","298","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C2 H12 Cl6 N6 Sn -","- C2 H12 Cl6 N6 Sn -","- C8 H48 Cl24 N24 Sn4 -","4","0.5","BK1486","Ishida, Hiroyuki; Furukawa, Yoshihiro; Kashino, Setsuo","Bis(guanidinium) hexachlorostannate(IV)","Acta Crystallographica Section C","1999","55","12","1995","1997","10.1107/S0108270199012032","","","0.71073","MoKα","","0.039","0.032","","0.039","","0.036","","","1.23","","","1.23","","","","has coordinates","201955","2020-10-21","18:00:00",""
"2009216","4.4957","0.0003","18.8581","0.0013","20.848","0.0015","90","","91.685","0.001","90","","1766.7","0.2","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","N-[2-(2,5-dimethoxyphenylethyl)]-N'-[2-(5-bromopyridyl)]-thiourea","","- C16 H18 Br N3 O2 S -","- C16 H18 Br N3 O2 S -","- C64 H72 Br4 N12 O8 S4 -","4","1","BK1492","Sudbeck, Elise A.; Jennissen, Jason D.; Venkatachalam, Taracad K.; Uckun, Fatih M.","Inhibitor of HIV-1 reverse transcriptase: <i>N</i>'-(5-bromo-2-pyridyl)-<i>N</i>-[2-(2,5-dimethoxyphenyl)ethyl]thiourea","Acta Crystallographica Section C","1999","55","12","2122","2124","10.1107/S0108270199012044","","","0.71073","MoKα","","0.0915","0.0369","","","","0.0972","","","","","","0.869","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009217","16.161","0.006","9.262","0.002","7.133","0.003","90","","90","","90","","1067.7","0.6","297","2","297","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","copper(I) cyanide/morpholine 3/1","","- C7 H9 Cu3 N4 S -","- C7 H9 Cu3 N4 S -","- C28 H36 Cu12 N16 S4 -","4","0.5","BK1494","Britton, Doyle; Stocker, Fred B.; Staeva, Teodora P.","Copper(I) cyanide‒thiomorpholine (3/1)","Acta Crystallographica Section C","1999","55","12","2014","2016","10.1107/S0108270199011622","","","0.71073","MoKα","","0.0849","0.051","","0.125","","0.111","","","0.985","","","1.08","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009218","12.412","0.002","9.68","0.002","11.191","0.002","90","","90","","90","","1344.6","0.4","143","2","143","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","(E)-3,4-Di(tert-butyl)-3-hexene-2,5-dione","","- C14 H24 O2 -","- C14 H24 O2 -","- C56 H96 O8 -","4","0.5","BM1331","Klein, Oliver; Dix, Ina; Hopf, Henning; Jones, Peter G.","(<i>E</i>)-3,4-Di-<i>tert</i>-butylhex-3-ene-2,5-dione","Acta Crystallographica Section C","1999","55","12","2078","2080","10.1107/S0108270199012731","","","0.71073","MoKα","","0.063","0.048","","","","0.134","","","","","","1.058","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009219","47.6","0.006","6.6063","0.0008","22.135","0.002","90","","116.371","0.009","90","","6236.2","1.3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","trans-[Dimethyltetrakis(urea-O)tin(IV)]bis[di(methanesulfonyl)amidate] acetonitrile monosolvate","","- C12 H37 N11 O12 S4 Sn -","- C12 H37 N11 O12 S4 Sn -","- C96 H296 N88 O96 S32 Sn8 -","8","1","BM1351","Wirth, Andreas; Moers, Oliver; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. CXIV. <i>trans</i>-Dimethyltetrakis(urea-<i>O</i>)tin(IV) bis[di(methanesulfonyl)amidate] acetonitrile monosolvate","Acta Crystallographica Section C","1999","55","12","2033","2035","10.1107/S0108270199011634","","","0.71073","MoKα","","0.0476","0.0298","","","","0.0615","","","","","","0.907","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009220","9.311","0.005","12.877","0.007","19.806","0.01","90","","94.74","0.04","90","","2367","2","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Spiro(4,8-dibenzyl-1,3-dioxaazulenium-2,1'-2',4',6'-trinitrohexadienide)","","- C27 H19 N3 O8 -","- C27 H19 N3 O8 -","- C108 H76 N12 O32 -","4","1","BM1362","Borbulevych, Oleg Ya.; Antipin, Michail Yu.; Olekhnovich, Lev P.","4,8-Dibenzyl-2',4',6'-trinitrospiro[1,3-dioxaazulenium-2,1'-cyclohexadienide]","Acta Crystallographica Section C","1999","55","12","2177","2179","10.1107/S010827019901241X","","","0.71073","MoKα","","0.1537","0.0719","","0.1659","","0.1211","","","0.998","","","1.225","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009221","6.345","0.0015","10.242","0.003","21.554","0.006","90","","93.05","0.02","90","","1398.7","0.7","178","2","178","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N-bis(methanesulfonyl)-1-adamantylamine","","- C12 H21 N O4 S2 -","- C12 H21 N O4 S2 -","- C48 H84 N4 O16 S8 -","4","1","BM1364","Pröhl, Hans-Heinrich; Näveke, Martina; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. CXXI. Three <i>N</i>,<i>N</i>-disulfonylated 1-adamantylamines","Acta Crystallographica Section C","1999","55","12","2080","2084","10.1107/S0108270199011646","","","0.71073","MoKα","","0.0364","0.0317","","","","0.0872","","","","","","1.041","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009222","13.08","0.003","11.978","0.003","27.915","0.004","90","","90","","90","","4373.5","1.6","178","2","178","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N,N-bis(p-toluenesulfonyl)-1-adamantylamine","","- C24 H29 N O4 S2 -","- C24 H29 N O4 S2 -","- C192 H232 N8 O32 S16 -","8","1","BM1364","Pröhl, Hans-Heinrich; Näveke, Martina; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. CXXI. Three <i>N</i>,<i>N</i>-disulfonylated 1-adamantylamines","Acta Crystallographica Section C","1999","55","12","2080","2084","10.1107/S0108270199011646","","","0.71073","MoKα","","0.0963","0.044","","","","0.1289","","","","","","0.944","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009223","7.2362","0.0018","7.2831","0.0015","29.526","0.006","90","","90","","90","","1556.1","0.6","178","2","178","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-(1-adamantyl)-1,1,3,3-tetraoxo-1,3,2-benzodithiazole","","- C16 H19 N O4 S2 -","- C16 H19 N O4 S2 -","- C64 H76 N4 O16 S8 -","4","1","BM1364","Pröhl, Hans-Heinrich; Näveke, Martina; Jones, Peter G.; Blaschette, Armand","Polysulfonylamines. CXXI. Three <i>N</i>,<i>N</i>-disulfonylated 1-adamantylamines","Acta Crystallographica Section C","1999","55","12","2080","2084","10.1107/S0108270199011646","","","0.71073","MoKα","","0.0378","0.0326","","","","0.0869","","","","","","1.032","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009224","8.057","0.0014","11.564","0.002","14.445","0.002","90","","95.225","0.004","90","","1340.3","0.4","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N-[2-(2-formylphenyl)ethyl]-2-fluoro-4-nitroaniline","","- C15 H13 F N2 O3 -","- C15 H13 F N2 O3 -","- C60 H52 F4 N8 O12 -","4","1","BM1367","Clegg, William; Elsegood, Mark R. J.; Stanforth, Stephen P.; Hedley, K. Andrew; Stanley, Alan L.; Raper, Eric S.; Creighton, James R.","2-(2-Fluoro-4-nitroanilinoethyl)benzaldehyde and <i>N</i>-(2-fluoro-4-nitrophenyl)-1-methoxy-1,2,3,4-tetrahydroisoquinoline","Acta Crystallographica Section C","1999","55","12","2163","2167","10.1107/S010827019901104X","","","0.71073","MoKα","","0.046","0.037","","","","0.102","","","","","","1.041","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009225","13.534","0.003","7.0535","0.0014","29.526","0.008","90","","90","","90","","2818.6","1.1","160","2","160","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","N-(2-fluoro-4-nitro)-1-methoxy-1,2,3,4-tetrahydroisoquinoline","","- C16 H15 F N2 O3 -","- C16 H15 F N2 O3 -","- C128 H120 F8 N16 O24 -","8","1","BM1367","Clegg, William; Elsegood, Mark R. J.; Stanforth, Stephen P.; Hedley, K. Andrew; Stanley, Alan L.; Raper, Eric S.; Creighton, James R.","2-(2-Fluoro-4-nitroanilinoethyl)benzaldehyde and <i>N</i>-(2-fluoro-4-nitrophenyl)-1-methoxy-1,2,3,4-tetrahydroisoquinoline","Acta Crystallographica Section C","1999","55","12","2163","2167","10.1107/S010827019901104X","","","0.71073","MoKα","","0.098","0.057","","","","0.211","","","","","","1.115","","","","has coordinates,has disorder","301791","2025-08-18","23:15:34",""
"2009226","8.3093","0.0004","8.3093","0.0004","8.3093","0.0004","90","","90","","90","","573.71","0.05","302","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Cr2 Ni O4 -","- Cr2 Ni O4 -","- Cr16 Ni8 O32 -","8","0.0416667","BR1244","Ueno, Go; Sato, Shoichi; Kino, Yoshihiro","The low-temperature tetragonal phase of NiCr~2~O~4~","Acta Crystallographica Section C","1999","55","12","1963","1966","10.1107/S0108270199011713","","","0.7107","MoKα","","","0.022","","","","0.058","","","","","","1.894","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009227","5.8102","0.0008","5.8102","0.0008","8.4806","0.0009","90","","90","","90","","286.29","0.06","200.2","","","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","","","- Cr2 Ni O4 -","- Cr2 Ni O4 -","- Cr8 Ni4 O16 -","4","0.125","BR1244","Ueno, Go; Sato, Shoichi; Kino, Yoshihiro","The low-temperature tetragonal phase of NiCr~2~O~4~","Acta Crystallographica Section C","1999","55","12","1963","1966","10.1107/S0108270199011713","","","0.7107","MoKα","","","0.0226","","","","0.0412","","","","","","1.862","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009228","5.772","0.001","5.772","0.001","26.538","0.001","90","","90","","120","","765.69","0.19","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","calcium oxide‒dialuminium trioxide‒calcium diiodate hydrate (3/1/1/10)","","- Al Ca2 H10 I O8 -","- Al Ca2 H10.002 I6 O8 -","- Al3 Ca6 H30.006 I18 O24 -","3","0.166667","BR1245","Jean-Philippe Rapin; Alain Walcarius; Grégory Lefevre; Michel François","A double-layered hydroxide, 3CaO.Al~2~O~3~.CaI~2~.10H~2~O","Acta Crystallographica Section C","1999","55","12","1957","1959","10.1107/S0108270199008665","","","1.54058","CuKα","","0.04","0.039","","","","0.112","","","","","","1.1","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009229","9.288","0.0006","7.418","0.0007","9.383","0.0004","90","","90","","90","","646.47","0.08","293","2","293","2","","","","","","","","3","C m c m","-C 2c 2","63","Trierbium digallide trigermanide","Trierbium digallide trigermanide","","- Er3 Ga2.21 Ge2.79 -","- Er3 Ga2.213 Ge2.787 -","- Er12 Ga8.852 Ge11.148 -","4","0.25","BR1251","Richard Welter; Gerard Venturini","Trierbium digallide trigermanide","Acta Crystallographica Section C","1999","55","12","1969","1970","10.1107/S0108270199010501","","","0.5609","AgKα","","0.026","0.02","","","","0.054","","","","","","0.704","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009230","6.722","0.002","11.088","0.002","13.475","0.004","90","","90","","90","","1004.3","0.5","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- As3 Ba3 O Ta -","- As3 Ba3 O Ta -","- As12 Ba12 O4 Ta4 -","4","0.5","BR1254","Derrien, Gaëlle; Monconduit, Laure; Tillard, Monique; Belin, Claude","Ba~3~TaAs~3~O displaying the distorted tetrahedral TaAs~3~O^6-^ anion","Acta Crystallographica Section C","1999","55","12","1976","1978","10.1107/S0108270199010057","","","0.71069","MoKα","","0.118","0.049","","","","0.13","","","","","","0.952","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009231","5.6969","0.0006","5.6969","0.0006","23.523","0.003","90","","90","","120","","661.15","0.13","293","2","293","2","","","","","","","","4","R 3 2 :H","R 3 2""","155","sodium calcium tantalate","disodiumtricalciumditantalumnonaoxide","","- Ca3 Na2 O9 Ta2 -","- Ca3 Na2 O9 Ta2 -","- Ca9 Na6 O27 Ta6 -","3","0.166667","BR1255","Yamane, Hisanori; Takahashi, Hiroki; Kajiwara, Takashi; Shimada, Masahiko","Na~2~Ca~3~Ta~2~O~9~ with a simple stacking of oxygen triangular nets","Acta Crystallographica Section C","1999","55","12","1978","1980","10.1107/S0108270199010513","","","0.71073","MoKα","","0.022","0.021","","","","0.057","","","","","","1.187","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009232","8.0432","0.0003","8.0805","0.0003","8.8836","0.0003","65.119","0.001","67.516","0.001","68.326","0.001","468.77","0.03","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- H2 O10 Se3 Zn3 -","- O10 Se3 Zn3 -","- O20 Se6 Zn6 -","2","1","BR1257","Harrison, William T. A.","An extreme case of ZnO~6~ octahedral distortion in trizinc tris(selenite) hydrate, Zn~3~(SeO~3~)~3~","Acta Crystallographica Section C","1999","55","12","1980","1983","10.1107/S0108270199011099","","","0.71073","MoKα","","0.0434","0.0299","","","","0.0593","","","","","","0.978","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009233","7.237","0.001","7.237","0.001","4.208","0.001","90","","90","","90","","220.39","0.07","293","2","293","2","","","","","","","","4","P 4/m m m","-P 4 2","123","Potassium chloro-bromopalladate","Potassium chloro-bromopalladate(II)A","","- Br2.24 Cl1.76 K2 Pd -","- Br2.24 Cl1.76 K2 Pd -","- Br2.24 Cl1.76 K2 Pd -","1","0.0625","BR1258","Omrani, Hedi; Welter, Richard; Vangelisti, Rene","The solid solution of composition K~2~PdBr~2.24~Cl~1.76~","Acta Crystallographica Section C","1999","55","12","1970","1972","10.1107/S0108270199011725","","","0.56087","AgKα","","0.036","0.03","","","","0.076","","","","","","1.189","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009234","14.593","0.0003","10.801","0.0002","7.309","0.0002","90","","108.35","0.02","90","","1093.46","0.13","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Dioxoniobium disodium arsenate","","- As Na2 Nb O6 -","- As Na2 Nb O6 -","- As8 Na16 Nb8 O48 -","8","1","BR1262","Hizaoui, Khaled; Jouini, Noureddine; Driss, Ahmed; Jouini, Tahar","Na~2~NbO~2~AsO~4~, a new niobium monoarsenate","Acta Crystallographica Section C","1999","55","12","1972","1974","10.1107/S0108270199012421","","","0.71069","MoKα","","0.023","0.021","","0.059","","0.057","","","1.177","","","1.192","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009235","11.4944","0.0017","14.1547","0.0018","16.292","0.002","108.284","0.009","92.329","0.013","110.712","0.011","2319.7","0.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H41 B N9 O4 Tb -","- C54 H41 B N9 O4 Tb -","- C108 H82 B2 N18 O8 Tb2 -","2","1","CF1328","Ward, Michael D.; McCleverty, Jon A.; Mann, Karen L. V.; Jeffery, John C.; Motson, Graham R.; Hurst, Joanne","Ternary lanthanide complexes of hydrotris[3-(2-pyridyl)pyrazol-1-yl]borate (Tp^py^) and anionic <i>O</i>,<i>O</i>-bidentate chelates: [Tb(Tp^py^)(dbm)~2~] and [Eu(Tp^py^)(trop)(NO~3~)] (Hdbm is dibenzoylmethane and Htrop is tropolone)","Acta Crystallographica Section C","1999","55","12","2055","2058","10.1107/S0108270199011051","","","0.71073","MoKα","","0.0876","0.0477","","","","0.0826","","","","","","0.97","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009236","10.2193","0.0019","10.9574","0.0012","15.994","0.003","85.895","0.009","72.163","0.01","78.536","0.008","1670.7","0.5","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C32 H26 B Cl2 Eu N10 O5 -","- C32 H26 B Cl2 Eu N10 O5 -","- C64 H52 B2 Cl4 Eu2 N20 O10 -","2","1","CF1328","Ward, Michael D.; McCleverty, Jon A.; Mann, Karen L. V.; Jeffery, John C.; Motson, Graham R.; Hurst, Joanne","Ternary lanthanide complexes of hydrotris[3-(2-pyridyl)pyrazol-1-yl]borate (Tp^py^) and anionic <i>O</i>,<i>O</i>-bidentate chelates: [Tb(Tp^py^)(dbm)~2~] and [Eu(Tp^py^)(trop)(NO~3~)] (Hdbm is dibenzoylmethane and Htrop is tropolone)","Acta Crystallographica Section C","1999","55","12","2055","2058","10.1107/S0108270199011051","","","0.71073","MoKα","","0.0388","0.0279","","","","0.0581","","","","","","0.976","","","","has coordinates,has disorder","301791","2025-08-18","23:15:34",""
"2009237","12.8648","0.0007","17.1212","0.001","18.7567","0.0011","101.627","0.001","91.701","0.001","111.515","0.001","3740.2","0.4","193","","193","","","","","","","","","7","P -1","-P 1","2","","[trans-dioxo-bis(en)osmium(VI)] [trans-dioxo-bis(en)osmium(VI) -disulfatoferrate(II)","","- C16 H100 Fe4 N16 O58 Os4 S8 -","- C16 H64 Fe4 N16 O58 Os4 S8 -","- C32 H128 Fe8 N32 O116 Os8 S16 -","2","1","DA1073","Murmann, R. Kent; Barnes, Charles L.","[<i>trans</i>-Bis(en)dioxoosmium(VI)] <i>trans</i>-bis(en)dioxoosmium(VI)[aqua-η^1^-sulfato-η^2^-sulfatoiron(II)][diaquabis(η^1^-sulfato)iron(II)] hexahydrate","Acta Crystallographica Section C","1999","55","12","2004","2007","10.1107/S0108270199010070","","","0.7093","MoKα","","0.046","0.048","","0.056","","0.059","","","","","","1.19","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009238","4.993","0.001","8.418","0.002","7.858","0.002","90","","96.41","0.03","90","","328.22","0.13","294","2","296","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","ammonium trivanadate(V)","","- H4 N O8 V3 -","- H4 N O8 V3 -","- H8 N2 O16 V6 -","2","0.5","DA1075","Bi-Zhou Lin; Shi-Xiong Liu","Ammonium trivanadate(V), NH~4~V~3~O~8~","Acta Crystallographica Section C","1999","55","12","1961","1963","10.1107/S0108270199007702","","","0.71069","MoKα","","0.043","0.036","","0.115","","0.102","","","1.151","","","1.173","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009239","21.85","0.002","11.7687","0.0007","13.3256","0.0008","90","","100.544","0.002","90","","3368.8","0.4","298.2","","298.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H28 Cd N10 O10 -","- C32 H28 Cd N10 O10 -","- C128 H112 Cd4 N40 O40 -","4","0.5","DA1076","Huang, Songping D.; Lewandowski, Brad J.; Liu, Chibiao (Charles); Shan, Yongkui","[Cd(4,4'-bipy)~2~(NO~3~)~2~](2-nitroaniline)~2~, a novel two-dimensional lattice inclusion compound","Acta Crystallographica Section C","1999","55","12","2016","2018","10.1107/S0108270199011130","","","0.7107","MoKα","","0.055","0.051","","0.089","","0.083","","","1.06","","","1.09","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009240","16.482","0.005","14.258","0.005","9.838","0.004","90","","90","","90","","2311.9","1.4","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","1-tert-butoxycarbonyl-7,9-dibenzyl-2-oxo-1,7,9-triazaspiro[4,5]dec-3-ene","","- C26 H31 N3 O3 -","- C26 H31 N3 O3 -","- C104 H124 N12 O12 -","4","0.5","DA1077","Dong, Yongkwan; Yun, Hoseop; Suh, Jang-Min; Ahn, Young-Gil; Ha, Hyun-Joon","Mirror symmetry in 7,9-dibenzyl-1-<i>tert</i>-butoxycarbonyl-1,7,9-triazaspiro[4.5]dec-3-en-2-one","Acta Crystallographica Section C","1999","55","12","2088","2090","10.1107/S0108270199011373","","","0.71073","MoKα","","0.1169","0.0575","","","","0.1163","","","","","","1.009","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009241","11.093","0.002","21.665","0.004","16.823","0.005","90","","104.404","0.018","90","","3916","1.6","294","2","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","Trichloro(phenylimido)(1,1'-bis(diphenylphosphino)ferrocene)rhenium(V)","","- C41 H35 Cl5 Fe N P2 Re -","- C41 H35 Cl5 Fe N P2 Re -","- C164 H140 Cl20 Fe4 N4 P8 Re4 -","4","1","DA1088","Lee, Soon W.; Choi, Nam-Sun","[1,1'-Bis(diphenylphosphino)ferrocene]trichloro(phenylimido)rhenium(V) dichloromethane solvate","Acta Crystallographica Section C","1999","55","12","2018","2020","10.1107/S0108270199011385","","","0.71073","MoKα","","","0.0375","","","","0.0771","","","","","","1.03","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009242","5.2955","0.0004","10.0638","0.0007","11.2503","0.0008","103.951","0.002","102.516","0.001","105.121","0.002","536.13","0.07","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","α-cyano-β-hydroxy-β-methyl-N-(3-chlorophenyl)propenamide","","- C11 H9 Cl N2 O2 -","- C11 H9 Cl N2 O2 -","- C22 H18 Cl2 N4 O4 -","2","1","DA1089","Ghosh, Sutapa; Zheng, Yaguo; Uckun, Fatih M.","Five analogs of the active metabolite of leflunomide","Acta Crystallographica Section C","1999","55","12","2117","2122","10.1107/S0108270199011142","","","0.71073","MoKα","","0.0683","0.0508","","","","0.1357","","","","","","1.024","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009243","4.7724","0.0001","24.1536","0.0001","9.1565","0.0002","90","","95.937","0.001","90","","1049.81","0.03","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","α-cyano-β-hydroxy-β-methyl-N-(5-flurophenyl)propenamide","","- C11 H9 F N2 O2 -","- C11 H9 F N2 O2 -","- C44 H36 F4 N8 O8 -","4","1","DA1089","Ghosh, Sutapa; Zheng, Yaguo; Uckun, Fatih M.","Five analogs of the active metabolite of leflunomide","Acta Crystallographica Section C","1999","55","12","2117","2122","10.1107/S0108270199011142","","","0.71073","MoKα","","0.0656","0.0528","","","","0.1698","","","","","","1.07","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009244","4.9906","0.0002","9.3735","0.0003","11.8869","0.0001","77.394","0.002","86.404","0.002","88.065","0.002","541.47","0.03","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","α-cyano-β-hydroxy-N-(4-bromophenyl)but-2-enamide","","- C11 H9 Br N2 O2 -","- C11 H9 Br N2 O2 -","- C22 H18 Br2 N4 O4 -","2","1","DA1089","Ghosh, Sutapa; Zheng, Yaguo; Uckun, Fatih M.","Five analogs of the active metabolite of leflunomide","Acta Crystallographica Section C","1999","55","12","2117","2122","10.1107/S0108270199011142","","","0.71073","MoKα","","0.0789","0.0635","","","","0.1655","","","","","","1.043","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009245","8.9641","0.0008","14.1215","0.0012","8.327","0.0007","90","","101.023","0.002","90","","1034.64","0.15","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","α-cyano-β-hydroxy-N-(2-flurophenyl)but-2-enamide","","- C11 H9 F N2 O2 -","- C11 H9 F N2 O2 -","- C44 H36 F4 N8 O8 -","4","1","DA1089","Ghosh, Sutapa; Zheng, Yaguo; Uckun, Fatih M.","Five analogs of the active metabolite of leflunomide","Acta Crystallographica Section C","1999","55","12","2117","2122","10.1107/S0108270199011142","","","0.71073","MoKα","","0.0792","0.0555","","","","0.1468","","","","","","1.202","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009246","5.2782","0.0002","10.2335","0.0004","11.5754","0.0004","69.792","0.001","78.592","0.001","75.837","0.001","564.49","0.04","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","α-cyano-β-hydroxy-β-methyl-N-(3-bromophenyl)propenamide","","- C11 H9 Br N2 O2 -","- C11 H9 Br N2 O2 -","- C22 H18 Br2 N4 O4 -","2","1","DA1089","Ghosh, Sutapa; Zheng, Yaguo; Uckun, Fatih M.","Five analogs of the active metabolite of leflunomide","Acta Crystallographica Section C","1999","55","12","2117","2122","10.1107/S0108270199011142","","","0.71073","MoKα","","0.0683","0.056","","","","0.1545","","","","","","0.988","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009247","8.425","0.003","9.427","0.002","8.087","0.002","103.64","0.02","109","0.02","108.39","0.02","533.7","0.3","296","","296","","","","","","","","","4","P -1","-P 1","2","","","","- C8 H14 N4 S -","- C8 H14 N4 S -","- C16 H28 N8 S2 -","2","1","DA1094","McCarrick, Robert M.; Squattrito, Philip J.; Singh, Rajkumar Noren; Handa, Ram N.; Dubey, Surendra N.","Two Schiff base derivatives of 4-amino-3-propyl-1,2,4-triazole-5-thione","Acta Crystallographica Section C","1999","55","12","2111","2114","10.1107/S0108270199011397","","","0.7107","MoKα","","","0.052","","","","0.037","","","","","","2.27","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009248","9.539","0.002","14.177","0.002","5.275","0.002","99.64","0.02","95.69","0.03","90.03","0.01","699.7","0.3","296","","296","","","","","","","","","5","P -1","-P 1","2","","","","- C13 H16 N4 O S -","- C13 H16 N4 O S -","- C26 H32 N8 O2 S2 -","2","1","DA1094","McCarrick, Robert M.; Squattrito, Philip J.; Singh, Rajkumar Noren; Handa, Ram N.; Dubey, Surendra N.","Two Schiff base derivatives of 4-amino-3-propyl-1,2,4-triazole-5-thione","Acta Crystallographica Section C","1999","55","12","2111","2114","10.1107/S0108270199011397","","","0.7107","MoKα","","","0.063","","","","0.088","","","","","","2.23","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009249","13.513","0.002","6.288","0.0009","32.903","0.003","90","","98.22","0.03","90","","2767","0.7","100","","100","","","","","","","","","3","C 1 2 1","C 2y","5","","D-Friedoolean-14-en-3β-ol acetate","","- C32 H52 O2 -","- C32 H52 O2 -","- C128 H208 O8 -","4","1","DA1098","Billodeaux, Damon R.; Benavides, Gloria A.; Fischer, Nikolaus H.; Fronczek, Frank R.","Taraxerol acetate at 100K","Acta Crystallographica Section C","1999","55","12","2129","2131","10.1107/S0108270199011403","","","0.71073","MoKα","","0.141","0.063","","","","0.249","","","","","","0.813","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009250","8.533","0.008","10.643","0.008","12.287","0.012","110.23","0.07","92.65","0.07","103.34","0.07","1009","1.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Trichloro((p-aminophenyl)imido)(N-pchloro-pyridine-2-aldimine)rhenium(V).","","- C18 H15 Cl4 N4 Re -","- C18 H15 Cl4 N4 Re -","- C36 H30 Cl8 N8 Re2 -","2","1","DE1115","Banerjee, Sangeeta; Bhattacharyya, Sibaprasad; Chakraborty, Indranil; Dirghangi, Bimal Kumar","A rhenium(V)‒arylimide species incorporating pyridine-2-aldimine chelation","Acta Crystallographica Section C","1999","55","12","2000","2002","10.1107/S0108270199010732","","","0.71073","MoKα","","0.03","0.026","","0.067","","0.061","","","1.077","","","1.086","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009251","6.952","0.002","8.909","0.003","6.531","0.002","94.76","0.03","111.03","0.02","73.74","0.02","362.4","0.2","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","trans-dinitro bis(N-ethyl ethane-1,2-diamine)nickel(II)","","- C8 H24 N6 Ni O4 -","- C8 H24 N6 Ni O4 -","- C8 H24 N6 Ni O4 -","1","0.5","DE1116","Inamur Rahaman Laskar; Golam Mostafa; Debasis Das; Ken-ichi Okamoto; N. Ray Chaudhuri","<i>trans</i>-Bis(<i>N</i>-ethylethane-1,2-diamine)dinitronickel(II)","Acta Crystallographica Section C","1999","55","12","1994","1995","10.1107/S0108270199011063","","","0.7107","MoKα","","","0.029","","","","0.0393","","","","","","1.122","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009252","7.7234","0.0009","21.356","0.003","16.252","0.005","90","","92.882","0.015","90","","2677.2","1","289","2","289","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-(4-Methylphenyl)-3-(4-pyridyl)-1H-1,2,4-triazole-5(4H)-thione","","- C14 H12 N4 S -","- C14 H12 N4 S -","- C112 H96 N32 S8 -","8","2","FG1553","Lakshmanan Govindasamy; Devadasan Velmurugan; Annamalai Senthilvelan; Il-Hawn Suh","4-(4-Methylphenyl)-3-(4-pyridyl)-1<i>H</i>-1,2,4-triazole-5(4<i>H</i>)-thione","Acta Crystallographica Section C","1999","55","12","2098","2100","10.1107/S0108270199010094","","","0.71069","MoKα","","0.078","0.046","","","","0.118","","","","","","1.018","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009253","12.1605","0.0006","12.414","0.0006","25.061","0.001","83.771","0.001","82.672","0.001","62.875","0.001","3334.2","0.3","120","","120","","","","","","","","","4","P -1","-P 1","2","","bis[(μ~3~-oxo)-μ~2~-(2-formylbenzoato-O,O')-(2-formylbenzoato-O)-bis(dibutyl- tin(IV)]","","- C64 H92 O14 Sn4 -","- C64 H92 O14 Sn4 -","- C128 H184 O28 Sn8 -","2","1","FG1568","Khoo, Lian Ee; Hazell, Alan","3-Hydroxyphthalide and its adduct with dibutyltin oxide","Acta Crystallographica Section C","1999","55","12","2070","2073","10.1107/S0108270199009282","","","0.71073","MoKα","","","0.037","","","","0.037","","","","","","1.243","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009254","3.9463","0.0006","11.423","0.002","7.327","0.0011","90","","97.02","0.003","90","","327.81","0.09","120","","120","","","","","","","","","3","P 1 21 1","P 2yb","4","","3-hydroxyphthalide","","- C8 H6 O3 -","- C8 H6 O3 -","- C16 H12 O6 -","2","1","FG1568","Khoo, Lian Ee; Hazell, Alan","3-Hydroxyphthalide and its adduct with dibutyltin oxide","Acta Crystallographica Section C","1999","55","12","2070","2073","10.1107/S0108270199009282","","","0.71073","MoKα","","","0.028","","","","0.037","","","","","","1.7","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009255","9.1149","0.0006","7.5153","0.0004","18.1463","0.0008","90","","92.03","0.01","90","","1242.26","0.12","293","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","5-[(Dimethylamino)methyleneamino]-3-methyl-1-phenylpyrazole","","- C13 H16 N4 -","- C13 H16 N4 -","- C52 H64 N16 -","4","1","FR1200","Moreno-Fuquen, Rodolfo; Quiroga, Jairo; Insuasty, Braulio","5-[(Dimethylamino)methyleneamino]-3-methyl-1-phenylpyrazole","Acta Crystallographica Section C","1999","55","12","2096","2098","10.1107/S0108270199010793","","","0.71073","MoKα","","0.069","0.047","","0.157","0.129","","","","1.097","1.043","1.043","","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009256","6.4731","0.0001","11.4104","0.0001","20.4092","0.0003","90","","90","","90","","1507.44","0.03","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","1-trimethylsilyl-3,6-dimethyl-3,6-diaza-1,4,5-tricarbaheptaborane(10)","","- C10 H30 B2 N2 Si -","- C10 H30 B2 N2 Si -","- C40 H120 B8 N8 Si4 -","4","1","FR1209","Zheng, Chong; Hosmane, Narayan S.","3,3,6,6-Tetramethyl-1-trimethylsilyl-3,6-diaza-1,4,5-tricarbaheptaborane(10)","Acta Crystallographica Section C","1999","55","12","2107","2109","10.1107/S0108270199011294","","","0.71073","MoKα","","0.046","0.043","","","","0.115","","","","","","1.243","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009257","10.364","0.001","12.657","0.001","26.59","0.002","90","","98.58","0.01","90","","3449","0.5","273","2","273","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(μ‒dimethylacetylenedicarboxylate)manganese cobalt heptacarbonyl","","- C13 H6 Co Mn O11 -","- C13 H6 Co Mn O11 -","- C104 H48 Co8 Mn8 O88 -","8","1","FR1210","Beck, Karsten; Krause Bauer, Jeanette A.; Alexander, John J.","Carbonyl-μ-dimethylacetylene dicarboxylate and carbonyl-μ-methyltetraolate manganesecobalt complexes","Acta Crystallographica Section C","1999","55","12","2020","2023","10.1107/S0108270199009828","","","0.71073","MoKα","","0.063","0.038","","","","0.088","","","","","","1.094","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009258","8.026","0.0001","8.1299","0.0001","12.6612","0.0001","87.343","0.001","71.85","0.003","79.125","0.001","770.88","0.02","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","(μ‒methyltetrolate)manganese cobalt heptacarbonyl","","- C12 H6 Co Mn O9 -","- C12 H6 Co Mn O9 -","- C24 H12 Co2 Mn2 O18 -","2","1","FR1210","Beck, Karsten; Krause Bauer, Jeanette A.; Alexander, John J.","Carbonyl-μ-dimethylacetylene dicarboxylate and carbonyl-μ-methyltetraolate manganesecobalt complexes","Acta Crystallographica Section C","1999","55","12","2020","2023","10.1107/S0108270199009828","","","0.71073","MoKα","","0.042","0.029","","","","0.073","","","","","","1.052","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009259","9.3376","0.0004","10.1794","0.0004","10.9289","0.0005","95.498","0.001","103.262","0.001","90.284","0.001","1006.06","0.07","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","N-benzyl-N-(2-iodo-4-methylphenyl)cinnamamide","","- C23 H20 I N O -","- C23 H20 I N O -","- C46 H40 I2 N2 O2 -","2","1","FR1216","Shanmuga Sundara Raj, S.; Renganayaki, S.; Subramanian, E.; Fun, Hoong-Kun","<i>N</i>-Benzyl-<i>N</i>-(2-iodo-4-methylphenyl)cinnamamide and <i>N</i>-benzyl-<i>N</i>-(<i>p</i>-tolyl)cinnamamide","Acta Crystallographica Section C","1999","55","12","2182","2184","10.1107/S0108270199011749","","","0.71073","MoKα","","0.06","0.043","","","","0.119","","","","","","1.037","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009260","15.1665","0.0016","6.2451","0.0006","19.946","0.002","90","","99.65","0.002","90","","1862.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-benzyl-N-(p-tolyl)cinnamamide","","- C23 H21 N O -","- C23 H21 N O -","- C92 H84 N4 O4 -","4","1","FR1216","Shanmuga Sundara Raj, S.; Renganayaki, S.; Subramanian, E.; Fun, Hoong-Kun","<i>N</i>-Benzyl-<i>N</i>-(2-iodo-4-methylphenyl)cinnamamide and <i>N</i>-benzyl-<i>N</i>-(<i>p</i>-tolyl)cinnamamide","Acta Crystallographica Section C","1999","55","12","2182","2184","10.1107/S0108270199011749","","","0.71073","MoKα","","0.146","0.068","","","","0.157","","","","","","1.036","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009261","13.035","0.001","11.6","0.001","8.668","0.001","90","","81.23","0.009","90","","1295.3","0.2","296","","296","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","4-benzyloxy-3-methoxybenzaldehyde (vanillin benzyl ether)","","","- C15 H14 O3 -","- C15 H14 O3 -","- C60 H56 O12 -","4","1","FR1220","Gerkin, Roger E.","Network of C—H···O interactions in 4-benzyloxy-3-methoxybenzaldehyde (vanillin benzyl ether)","Acta Crystallographica Section C","1999","55","12","2140","2142","10.1107/S0108270199009051","","","0.71073","MoKα","","","0.05","","","","0.068","","","","","","1.61","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009262","5.71","0.0008","7.8019","0.0015","7.9527","0.0007","75.319","0.012","79.168","0.009","77.967","0.016","331.75","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Bis(ethylenediamine-N,N')bis(perchlorato-O)copper(II)","","- C4 H16 Cl2 Cu N4 O8 -","- C4 H16 Cl2 Cu N4 O8 -","- C4 H16 Cl2 Cu N4 O8 -","1","0.5","FR1222","Maxcy, Karen R.; Turnbull, Mark M.","A redetermination of bis(ethylenediamine-<i>N</i>,<i>N</i>')bis(perchlorato-<i>O</i>)copper(II)","Acta Crystallographica Section C","1999","55","12","1986","1988","10.1107/S010827019901152X","","","0.71073","MoKα","","0.042","0.041","","","","0.146","","","","","","1.179","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009263","23.433","0.005","7.018","0.004","9.554","0.004","90","","90","","90","","1571.2","1.2","293","2","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C18 H16 Br2 -","- C18 H16 Br2 -","- C72 H64 Br8 -","4","0.5","FR1224","Luck, Rudy L.; Mendenhall, G. David","2-<i>tert</i>-Butyl-9,10-dibromoanthracene","Acta Crystallographica Section C","1999","55","12","2090","2091","10.1107/S0108270199011968","","","0.71069","MoKα","","","0.04","","","","0.112","","","","","","1.028","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009264","7.811","0.001","11.1324","0.0008","11.831","0.001","87.508","0.007","71.538","0.008","87.198","0.009","974.23","0.17","296","","296","","","","","","","","","5","P -1","-P 1","2","di[quinolinium-4-carboxylic acid] sulfate monohydrate","bis(4-carboxyquinolinium) sulfate monohydrate","","- C20 H18 N2 O9 S -","- C20 H18 N2 O9 S -","- C40 H36 N4 O18 S2 -","2","1","FR1225","Dobson, Allison J.; Gerkin, Roger E.","Hydrogen bonding and C—H···O interactions in bis(4-carboxyquinolinium) sulfate monohydrate","Acta Crystallographica Section C","1999","55","12","2142","2145","10.1107/S0108270199010586","","","0.71073","MoKα","","","0.056","","","","0.098","","","","","","1.61","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009265","10.996","0.003","11.423","0.003","13.501","0.003","102.36","0.02","111.79","0.02","100.28","0.02","1474.7","0.7","115","2","115","2","","","","","","","","5","P -1","-P 1","2","naphthyl 18-crown-6 t-butyl ammonium perchlorate complex","tert-butylammonium perchlorate‒2,5,8,11,14,17-hexaoxatricyclo[16.8.0.0^20,25^]hexacosa- 1(26),18,20(25),21,23-pentaene‒ethyl acetate‒dichloromethane (4/4/1/1)","","- C25.25 H40.5 Cl1.5 N O10.5 -","- C25.25 H40.5 Cl1.5 N O10.5 -","- C50.5 H81 Cl3 N2 O21 -","2","1","FR1227","Knobler, Carolyn B.; Maverick, Emily F.; Trueblood, Kenneth N.; Weiss, Robert M.","The <i>tert</i>-butylammonium perchlorate complex of 2,3-naphtho-18-crown-6 at 115K","Acta Crystallographica Section C","1999","55","12","2091","2093","10.1107/S010827019901080X","","","0.7107","MoKα","","0.088","0.074","","0.249","","0.249","","","","","","1.06","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"2009266","6.718","0.01","13.595","0.01","15.637","0.01","114.015","0.01","95.196","0.01","94.984","0.01","1287","2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","bis-ethylenediaminedinitrocobalt(III) perchlor","","","- C4 H16 Cl Co N6 O8 -","- C4 H16 Cl Co N6 O8 -","- C16 H64 Cl4 Co4 N24 O32 -","4","2","FR1228","Maxcy, Karen R.; Turnbull, Mark M.","<i>trans</i>-Bis(ethylenediamine)dinitrocobalt(III) perchlorate","Acta Crystallographica Section C","1999","55","12","1984","1986","10.1107/S010827019901197X","","","0.71073","MoKα","","0.0847","0.063","","","","0.2043","","","","","","1.207","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:34",""
"2009267","6.9473","0.0006","7.4535","0.0006","25.0846","0.0017","90","","96.998","0.006","90","","1289.25","0.18","273","2","273","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(4-amino-1-methyl-5-nitroso-6-oxo-1,6-dihydropyrimidin-2-yl)glicinato hexaaaquo zinc(II)","","- C14 H32 N10 O16 Zn -","- C14 H32 N10 O16 Zn -","- C28 H64 N20 O32 Zn2 -","2","0.5","GD1042","Arranz-Mascarós, Paloma; Godino, M. Luz; López, Rafael; Cuesta, Rafael; Valenzuela-Calahorro, Cristóbal; Martín-Ramos, Daniel","Hexaaquazinc(II) bis[<i>N</i>-(4-amino-1-methyl-5-nitroso-6-oxo-1,6-dihydropyrimidin-2-yl)glycinate] dihydrate","Acta Crystallographica Section C","1999","55","12","2049","2051","10.1107/S0108270199009518","","","0.71073","MoKα","","0.058","0.034","","","","0.087","","","","","","0.985","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009268","11.611","0.002","12.14","0.007","13.584","0.004","110.13","0.04","97.62","0.02","94.56","0.04","1765.7","1.3","299","3","299","3","","","","","","","","5","P -1","-P 1","2","","Bis[μ-(hydrogen benzene-1,2-dicarboxylato)-O:O']- bis[bis(1,10-phenanthroline-N,N')cobalt(II)] bis(hydrogen benzene-1,2-dicarboxylate) dihydrate","","- C80 H56 Co2 N8 O18 -","- C80 H56 Co2 N8 O18 -","- C80 H56 Co2 N8 O18 -","1","0.5","GD1046","Poleti, Dejan; Karanović, Ljiljana; Bogdanović, Goran A.; Spasojević-de Biré, Anne","Bis[μ-(hydrogen benzene-1,2-dicarboxylato)-<i>O</i>:<i>O</i>']bis[bis(1,10-phenanthroline-<i>N</i>,<i>N</i>')cobalt(II)] bis(hydrogen benzene-1,2-dicarboxylate) dihydrate","Acta Crystallographica Section C","1999","55","12","2061","2063","10.1107/S0108270199010720","","","0.7107","MoKα","","0.109","0.05","","","","0.126","","","","","","0.985","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009269","8.542","0.0005","11.8734","0.0007","15.0938","0.0005","90","","90","","90","","1530.85","0.14","291","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H16 Mo O2 -","- C17 H16 Mo O2 -","- C68 H64 Mo4 O8 -","4","1","GD1047","Alexander Kuhl; Farrugia, Louis J.; Philip J. Kocieński","Absolute configuration of <i>exo</i>-<i>syn</i>-<i>syn</i>-dicarbonyl(η^5^-cyclopentadienyl)[(1,2,3-η)-(1<i>R</i>,2<i>S</i>,3<i>S</i>)-1-phenylbut-2-en-1-yl]molybdenum(II)","Acta Crystallographica Section C","1999","55","12","2041","2043","10.1107/S0108270199010197","","","0.71073","MoKα","","","0.026","","","","0.07","","","","","","1.056","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009270","5.021","0.0002","11.3959","0.0006","11.9972","0.0006","90","","97.323","0.005","90","","680.87","0.06","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","4,4'-Bipyridinium diperchlorate","","- C10 H10 Cl2 N2 O8 -","- C10 H10 Cl2 N2 O8 -","- C20 H20 Cl4 N4 O16 -","2","0.5","GD1048","Ng, Seik Weng","4,4'-Bipyridinium diperchlorate","Acta Crystallographica Section C","1999","55","12","2105","2107","10.1107/S0108270199012196","","","0.71073","MoKα","","0.0638","0.0512","","","","0.1363","","","","","","1.055","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009271","9.8336","0.0001","16.711","0.0003","9.8352","0.0001","90","","104.223","0.001","90","","1566.67","0.04","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Dicyclohexylammonium trifluoroacetate","","- C14 H24 F3 N O2 -","- C14 H24 F3 N O2 -","- C56 H96 F12 N4 O8 -","4","1","GD1050","Ng, Seik Weng; Hoong-Kun Fun; S. Shanmuga Sundara Raj","Dicyclohexylammonium trifluoroacetate","Acta Crystallographica Section C","1999","55","12","2145","2147","10.1107/S0108270199010999","","","0.71073","MoKα","","0.0621","0.0473","","","","0.1516","","","","","","1.064","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009272","11.3483","0.0015","8.9413","0.001","14.705","0.003","90","","104.586","0.013","90","","1444","0.4","294","1","294","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(2R/2S)-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-(3-hydroxyphenyl)propanoic acid","","- C17 H15 N O4 -","- C17 H15 N O4 -","- C68 H60 N4 O16 -","4","1","GD1055","Gallagher, John F.; Murphy, Carol","C—H···π~arene~, C<i>sp</i>^3^—H···O=C and O—H···O intermolecular interactions in (2<i>R</i>/2<i>S</i>)-3-(3-hydroxyphenyl)-2-(1-oxo-1,3-dihydro-2<i>H</i>-isoindol-2-yl)propanoic acid: a <i>meta</i>-tyrosine derivative","Acta Crystallographica Section C","1999","55","12","2167","2169","10.1107/S0108270199010884","","","0.7107","MolybdenumKα","","0.1071","0.0406","","","","0.0847","","","","","","0.941","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009273","8.3898","0.001","8.7094","0.0009","13.8304","0.0017","89.695","0.009","79.108","0.006","62.568","0.009","876.92","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Tetrakis(1-methylimidazole)octacyanotetracadmium(II)","","- C24 H24 Cd4 N16 -","- C24 H24 Cd4 N16 -","- C24 H24 Cd4 N16 -","1","0.5","GD1056","Yun, Sock-Sung; Kim, Young-Pill; Kim, Chong-Hyeak","A three-dimensional framework formed from cadmium(II) cyanide and 1-methylimidazole","Acta Crystallographica Section C","1999","55","12","2026","2028","10.1107/S0108270199011336","","","0.71073","MoKα","","0.028","0.027","","","","0.077","","","","","","1.174","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009274","13.788","0.002","7.3827","0.0012","14.0672","0.0017","90","","105.66","0.02","90","","1378.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Pt-salen","N,N'-Ethylene-bis-salicylaldimine-Platin(II)","","- C16 H14 N2 O2 Pt -","- C16 H14 N2 O2 Pt -","- C64 H56 N8 O8 Pt4 -","4","1","GS1038","Sawodny, Wolfgang; Thewalt, Ulf; Potthoff, Edith; Ohl, Reinhard","[<i>N</i>,<i>N</i>'-Bis(salicylidene)ethylenediaminato-<i>N</i>,<i>N</i>',<i>O</i>,<i>O</i>']platinum(II)","Acta Crystallographica Section C","1999","55","12","2060","2061","10.1107/S0108270199010690","","","0.71069","MoKα","","0.0324","0.0272","","","","0.0684","","","","","","1.051","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009275","10.734","0.004","10.734","0.004","35.245","0.006","90","","90","","120","","3517","1","293","","293","","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C20 H29 Cl N2 O2 Pd -","- C20 H29 Cl N2 O2 Pd -","- C120 H174 Cl6 N12 O12 Pd6 -","6","1","","Bouquillon, Sandrine; du Moulinet d'Hardemare, Amaury; Averbuch-Pouchot, Marie-Thérèse; Hénin, Françoise; Muzart, Jacques; Durif, André","A coordination compound of (-)-ephedrine and palladium(II)","Acta Crystallographica Section C","1999","55","","2028","2030","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009276","12.949","0.004","13.031","0.008","13.97","0.01","66.08","0.07","85.89","0.05","69.08","0.03","2005","2","293","2","","","","","","","","","","5","P -1","-P 1","2","","Bis[(μ-O,O'-salicylato)(1,10-phenanthroline)copper(II)], acetylsalicylic acid solvate, diaqua solvate.","","- C43 H36 Cu2 N4 O12 -","- C43 H36 Cu2 N4 O12 -","- C86 H72 Cu4 N8 O24 -","2","1","GS1051","Lemoine, Pascale; Nguyen-Huy, Dung; Viossat, Bernard; Léger, Jean-Michel; Tomas, Alain","Bis[(μ-<i>O</i>,<i>O</i>'-salicylato)(2,2'-bipyridyl)copper(II)] acetylsalicylic acid dihydrate","Acta Crystallographica Section C","1999","55","12","2068","2070","10.1107/S0108270199012068","","","1.5418","CuKα","","0.0536","0.0342","","0.0944","0.0839","","","","1.037","1.079","1.079","","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009277","20.521","0.003","20.521","0.003","6.1384","0.0007","90","","90","","90","","2585","0.6","180","2","180","2","","","","","","","","4","I 4","I 4","79","","(2S,4S)-(hydroxymethyl)-2-dioxane-1,3]-ferrocene","","- C15 H18 Fe O3 -","- C15 H18 Fe O3 -","- C120 H144 Fe8 O24 -","8","1","GS1052","Jerome Chiffre; Eric Manoury; Jean-Claude Daran; Gilbert G. A. Balavoine","[(2<i>S</i>,4<i>S</i>)-4-Hydroxymethyl-1,3-dioxan-2-yl]ferrocene","Acta Crystallographica Section C","1999","55","12","2045","2047","10.1107/S010827019901207X","","","0.71073","MoKα","","0.0268","0.024","","","","0.0663","","","","","","1.133","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009278","14.157","0.0002","12.9188","0.0002","7.2671","0.0001","90","","104.776","0.001","90","","1285.14","0.03","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","[2-(2'-Pyridyl-N)quinoxaline-N~1~,N~4~]silver (I) nitrate","","- C13 H9 Ag N4 O3 -","- C13 H9 Ag N4 O3 -","- C52 H36 Ag4 N16 O12 -","4","1","HA1261","S.Shanmuga Sundara Raj; Hoong-Kun Fun; Xiao-Feng Chen; Xu-Hui Zhu; Xiao-Zeng You","[2-(2-Pyridyl-<i>N</i>)quinoxaline-<i>N</i>^1^]silver(I) nitrate","Acta Crystallographica Section C","1999","55","12","2035","2037","10.1107/S0108270199010938","","","0.71073","MoKα","","0.0365","0.0317","","","","0.0776","","","","","","0.968","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009279","9.009","0.002","6.756","0.002","21.276","0.009","90","","91.76","0.01","90","","1294.3","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Carbonato-O,O')bis(propane-1,3-diyldiamine-N,N')cobalt(III) chloride monohydrate","","- C7 H22 Cl Co N4 O4 -","- C7 H22 Cl Co N4 O4 -","- C28 H88 Cl4 Co4 N16 O16 -","4","1","HA1264","Zhu, Hai-Liang; Chen, Xiao-Ming","(Carbonato-<i>O</i>,<i>O</i>')bis(propane-1,3-diyldiamine-<i>N</i>,<i>N</i>')cobalt(III) chloride monohydrate","Acta Crystallographica Section C","1999","55","12","2010","2012","10.1107/S0108270199010525","","","0.71073","MoKα","","0.058","0.043","","","","0.115","","","","","","1.045","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009280","8.732","0.0001","21.716","0.0003","11.246","0.0002","90","","90","","90","","2132.51","0.05","293","2","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Disodium bis(μ-2-oxo-2-methylpropanoate dioxovanadium(V) heptahydrate","","- C8 H26 Na2 O17 V2 -","- C8 H12 Na2 O17 V2 -","- C32 H48 Na8 O68 V8 -","4","0.5","HA1265","Bourne, Susan A.; Cruywagen, J.J.; Kleinhorst, Angela","Disodium bis[μ-2-hydroxy-2-methylpropanoato(2 ‒)]-<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^2^;<i>O</i>^2^:<i>O</i>^1^,<i>O</i>^2^-bis[dioxovanadate(V)] heptahydrate","Acta Crystallographica Section C","1999","55","12","2002","2004","10.1107/S010827019901094X","","","0.7107","MoKα","","0.0453","0.0358","","","","0.1211","","","","","","0.958","","","","has coordinates,has disorder,has Fobs","176759","2020-10-21","18:00:00",""
"2009281","8.8253","0.0007","11.5326","0.0009","14.3441","0.0011","69.839","0.001","77.083","0.001","87.933","0.001","1334.45","0.18","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H45 Cl I N4 O0.5 -","- C21.5 H42 Cl I N4 -","- C43 H84 Cl2 I2 N8 -","2","1","HA1266","Hubin, Timothy J.; Alcock, Nathaniel W.; Busch, Daryle H.","A cyclam-like macrocycle side-bridged by a propyl chain","Acta Crystallographica Section C","1999","55","12","2188","2190","10.1107/S0108270199011038","","","0.71073","MoKα","","0.0765","0.049","","","","0.1339","","","","","","1.032","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009282","7.658","0.001","25.364","0.004","11.5","0.002","90","","95.17","0.01","90","","2224.6","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Bis-(2-ethyl-3-Hydroxy-pyranonato)diiodotin(IV) acetonitrile","","- C16 H17 I2 N O6 Sn -","- C16 H17 I2 N O6 Sn -","- C64 H68 I8 N4 O24 Sn4 -","4","1","HA1269","Lu, Zaisheng; Burgess, John; Fawcett, John; Russell, David R.","Bis(2-ethyl-3-hydroxy-4-pyranonato)diiodotin(IV) acetonitrile solvate","Acta Crystallographica Section C","1999","55","12","2051","2053","10.1107/S0108270199011683","","","0.71073","MoKα","","0.077","0.044","","","","0.098","","","","","","1.042","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009283","9.714","0.002","16.742","0.002","16.54","0.002","90","","90","","90","","2689.9","0.7","293","1","293","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-Methyltelluro-N-phenylbenzamide","","- C14 H13 N O Te -","- C14 H13 N O Te -","- C112 H104 N8 O8 Te8 -","8","1","JA1000","Gable, Robert W.; Laws, Melissa J.; Schiesser, Carl H.","2-Methyltelluro-<i>N</i>-phenylbenzamide","Acta Crystallographica Section C","1999","55","12","2100","2102","10.1107/S010827019901118X","","","0.71073","MoKα","","0.036","0.027","","","","0.074","","","","","","1.031","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009284","12.4702","0.0002","15.8641","0.0003","16.9102","0.0003","90","","109.033","0.001","90","","3162.43","0.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H98 Mo2 N2 O8 S2 -","- C52 H98 Mo2 N2 O8 S2 -","- C104 H196 Mo4 N4 O16 S4 -","2","0.5","JA1002","Wei, Qiang; Zhuang, Botao; Chen, Jiutong","A long-chain alkyl-tethered Mo~2~S~2~ core, [Bu~4~N]~2~[Mo~2~(CO)~8~(<i>n</i>-C~6~H~13~ S)~2~]","Acta Crystallographica Section C","1999","55","12","2047","2049","10.1107/S0108270199011191","","","0.71073","MoKα","","0.0624","0.044","","0.1144","","0.1053","","","1.092","","","1.143","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009285","9.496","0.001","10.662","0.0008","12.966","0.002","71.481","0.008","75.78","0.01","66.16","0.01","1128.1","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","di-μ-croconato-bis{μ-[N,N'-bis(3-amino-2,2-dimethylpropyl)oxamidato(2-) -N,O':N',O]-dicopper(II)} tetrahydrate","","- C34 H56 Cu4 N8 O18 -","- C34 H56 Cu4 N8 O18 -","- C34 H56 Cu4 N8 O18 -","1","0.5","JZ1319","Abbati, Gian Luca; Cornia, Andrea; Fabretti, Antonio Costantino","A tetracopper(II) complex containing two μ-oxamidato-dicopper(II) units linked by croconate anions","Acta Crystallographica Section C","1999","55","12","2043","2045","10.1107/S0108270198014504","","","0.71073","MoKα","","0.052","0.032","","0.093","","0.087","","","","","","1.065","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009286","6.056","0.001","26.822","0.003","7.713","0.001","90","","106.61","0.01","90","","1200.6","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2-benzoyl-2-methyl-1,3-dithiane","(2-methyl-1,3-dithian-2-yl)phenylmethanone","","- C12 H14 O S2 -","- C12 H14 O S2 -","- C48 H56 O4 S8 -","4","1","JZ1341","Stahl, Ingfried; Schomberg, Iris; Frenzen, Gerlinde","2-Benzoyl-2-methyl-1,3-dithiane","Acta Crystallographica Section C","1999","55","12","2179","2182","10.1107/S010827019901135X","","","0.71073","MoKα","","0.0698","0.0384","","","","0.079","","","","","","0.999","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009287","16.8265","0.0013","15.7626","0.0013","7.2886","0.0005","90","","90","","90","","1933.2","0.3","200","2","200","2","","","","","","","","5","P n n m","-P 2 2n","58","Cu NH3 Ni(CN)4, 23611","decaammine-5k^3^N,6k^2^N,7k^2^N,8k^3^N-octa-m-cyano-1:5k^2^C:N;1:6k^2^C:N; 2:6k^2^C:N;2:7k^2^C:N;3:6k^2^C:N;3:7k^2^C:N;4:7k^2^C:N;4:8k^2^C:N-octacyano- 1k^2^C,2k^2^C,3k^2^C,4k^2^C-tetracopper(II)tetranickel(II)","","- C16 H36 Cu4 N28 Ni4 -","- C16 H36 Cu4 N28 Ni4 -","- C32 H72 Cu8 N56 Ni8 -","2","0.25","JZ1356","Janiak, Christoph; Wu, He-Ping; Klüfers, Peter; Mayer, Peter","A molecular tetraamminecopper(II)-<i>trans</i>-diamminecopper(II) tetracyanonickelate(II) coordination compound","Acta Crystallographica Section C","1999","55","12","1966","1969","10.1107/S0108270199010859","","","0.71073","MoKα","","0.061","0.033","","","","0.073","","","","","","0.854","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009288","29.143","0.004","7.456","0.002","14.855","0.002","90","","116.33","0.02","90","","2893","1.1","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","3,28-Dimethoxy-3,11,28-trioxo-2,3-seco-18β-olean-12-en-2,9α-olide","","- C32 H46 O7 -","- C32 H46 O7 -","- C128 H184 O28 -","4","1","JZ1358","Gzella, Andrzej","Triterpenoide. XVII. 3,28-Dimethoxy-3,11,28-trioxo-2,3-seco-18β-olean-12-en-2,9α-olid","Acta Crystallographica Section C","1999","55","12","2151","2153","10.1107/S0108270199009178","","","1.54178","CuKα","","0.04","0.033","","","","0.095","","","","","","1.038","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009289","13.8993","0.0007","8.2374","0.0004","12.0633","0.0006","90","","105.843","0.001","90","","1328.71","0.11","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2–Tosylaminobenzaldehyde","","- C14 H13 N O3 S -","- C14 H13 N O3 S -","- C56 H52 N4 O12 S4 -","4","1","JZ1360","Mahía, José; Maestro, Miguel; Vázquez, Miguel; Bermejo, Manuel R.; González, Ana M.; Maneiro, Marcelino","2-Tosylaminobenzaldehyde","Acta Crystallographica Section C","1999","55","12","2158","2160","10.1107/S0108270199011580","","","0.71073","MoKα","","0.0609","0.0417","","","","0.1134","","","","","","1.015","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009290","11.3083","0.0012","13.595","0.0012","17.971","0.0014","90","","90","","90","","2762.8","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","2-Oxo-18β-olean-12-en-28-oic acid methyl ester","","- C31 H48 O3 -","- C31 H48 O3 -","- C124 H192 O12 -","4","1","JZ1361","Gzella, Andrzej","Triterpenoide. XVIII. Kristallstrukturen von 2-Oxo- und 3-Oxo-18β-olean-12-en-28-säure-methylestern","Acta Crystallographica Section C","1999","55","12","2153","2156","10.1107/S0108270199011567","","","1.54178","CuKα","","0.038","0.031","","","","0.09","","","","","","1.058","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009291","6.8765","0.0012","13.607","0.0014","29.118","0.003","90","","90","","90","","2724.5","0.6","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","3-Oxo-18β-olean-12-en-28-oic acid methyl ester","","- C31 H48 O3 -","- C31 H48 O3 -","- C124 H192 O12 -","4","1","JZ1361","Gzella, Andrzej","Triterpenoide. XVIII. Kristallstrukturen von 2-Oxo- und 3-Oxo-18β-olean-12-en-28-säure-methylestern","Acta Crystallographica Section C","1999","55","12","2153","2156","10.1107/S0108270199011567","","","1.54178","CuKα","","0.048","0.037","","","","0.111","","","","","","1.045","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009292","7.393","0.001","7.736","0.001","8.679","0.001","91.01","0.01","105.43","0.01","109.98","0.01","446.44","0.11","293","2","293","2","","","","","","","","4","P -1","-P 1","2","EtOOH","4,6-Diethoxy-1,3,5-triazin-2(1H)-one","","- C7 H11 N3 O3 -","- C7 H11 N3 O3 -","- C14 H22 N6 O6 -","2","1","JZ1365","Greenberg, Mark; Shteiman, Vitaly; Kaftory, Menahem","4,6-Diethoxy-1,3,5-triazin-2(1<i>H</i>)-one","Acta Crystallographica Section C","1999","55","12","2109","2111","10.1107/S010827019901149X","","","0.71073","MoKα","","0.0555","0.0379","","","","0.092","","","","","","0.901","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009293","8.178","0.002","10.674","0.003","12.992","0.003","75.79","0.01","75.94","0.01","88.62","0.01","1065.7","0.5","297","2","297","2","","","","","","","","7","P -1","-P 1","2","","η^5^-pentamethylcyclopentadienyl-η^4^-(2-methylbuta-1,3-diene)-acetonitrile- ruthenium(II) trifluoromethanesulfonate","","- C18 H26 F3 N O3 Ru S -","- C18 H26 F3 N O3 Ru S -","- C36 H52 F6 N2 O6 Ru2 S2 -","2","1","KA1309","Gemel, Christian; Kirchner, Karl; Schmid, Roland; Mereiter, Kurt","(Acetonitrile-<i>N</i>)(η^4^-2-methylbuta-1,3-diene)(η^5^-pentamethylcyclopentadienyl)ruthenium(II) trifluoromethanesulfonate","Acta Crystallographica Section C","1999","55","12","2053","2055","10.1107/S0108270199012342","","","0.71073","MoKα","","0.035","0.03","","","","0.077","","","","","","1.062","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2009294","8.338","0.001","8.973","0.001","14.393","0.002","80.337","0.014","84.339","0.014","63.179","0.013","947","0.2","100","2","","","","","","","","","","3","P -1","-P 1","2","Decabromodiphenylether","Decabromodiphenylether","","- C12 Br10 O -","- C12 Br10 O -","- C24 Br20 O2 -","2","1","KA1314","Eriksson, Johan; Eriksson, Lars; Jakobsson, Eva","Decabromodiphenyl ether","Acta Crystallographica Section C","1999","55","12","2169","2171","10.1107/S0108270199008884","","","0.7107","MoKα","","0.0455","0.0323","","0.045","","0.0443","","","1.667","","","1.844","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009295","7.3308","0.0012","12.733","0.003","37.471","0.007","90","","90","","90","","3497.7","1.2","293","","293","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydro-4b,8,8,10a-tetramethyl- 1,2-phenanthrenedicarboxaldehyde","","- C20 H30 O2 -","- C20 H30 O2 -","- C160 H240 O16 -","8","2","KA1332","Puliti, Raffaella; Mattia, Carlo Andrea","<i>ent</i>-Isocopal-12-ene-15,16-dialdehyde from <i>Spongia officinalis</i>","Acta Crystallographica Section C","1999","55","12","2160","2163","10.1107/S0108270199011233","","","1.54056","CuKα","","0.0614","0.0436","","","","0.0494","","","","","","0.918","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009296","5.865","0.002","14.179","0.003","19.487","0.003","90","","94.33","0.04","90","","1615.9","0.7","295.2","","295.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H12 Cl3 N O2 -","- C16 H12 Cl3 N O2 -","- C64 H48 Cl12 N4 O8 -","4","1","KA1334","Kabak, Mehmet; Elerman, Yalc̨in; Güner, Vildan; Yildirir, Süleyman; Durlu, Tahsin Nuri","3,3-Dichloro-1-(<i>p</i>-chlorophenyl)-4-(<i>p</i>-methoxyphenyl)-2-azetidinone","Acta Crystallographica Section C","1999","55","12","2115","2117","10.1107/S0108270199012093","","","0.7107","MoKα","","0.121","0.065","","","","0.206","","","","","","1.227","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009297","21.644","0.009","5.398","0.002","16.765","0.005","90","","101.97","0.02","90","","1916.1","1.2","200","2","200","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","rac-5,5'-Bis(2-acetoxypropyl)-2,2'-furil","","- C20 H22 O8 -","- C20 H22 O8 -","- C80 H88 O32 -","4","0.5","KA1337","Handrosch, Carsten; Heinemann, Frank W.; Kisch, Horst","<i>rac</i>-5,5'-Bis(2-acetoxypropyl)-2,2'-furil","Acta Crystallographica Section C","1999","55","12","2184","2186","10.1107/S0108270199011919","","","0.71073","MoKα","","0.131","0.067","","","","0.191","","","","","","1.026","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009298","8.4311","0.0012","14.505","0.002","15.609","0.003","73.317","0.01","85.702","0.018","89.375","0.01","1823.3","0.5","158","2","158","2","","","","","","","","3","P -1","-P 1","2","","rac-(3R,5S)-5-(1-cyclopropyl-1-methyl-ethyl)-3,5-diphenyl-dihydrofuran-2-one","","- C22 H24 O2 -","- C22 H24 O2 -","- C88 H96 O8 -","4","2","KA1338","Bats, Jan W.; Hoyer, Karsten; Mulzer, Johann","<i>rac</i>-(3<i>R</i>,5<i>S</i>)-5-(1-Cyclopropyl-1-methylethyl)-3,5-diphenyl-2,3,4,5-tetrahydrofuran-2-one, a triclinic structure with local monoclinic pseudosymmetry","Acta Crystallographica Section C","1999","55","12","2124","2126","10.1107/S0108270199010161","","","0.71073","MoKα","","0.151","0.097","","","","0.147","","","","","","1.708","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009299","7.804","0.004","5.765","0.002","14.164","0.009","90","","102.37","0.01","90","","622.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Poly[bis(imidazole)bis(thiocyanato)cadmium(II)]","","- C8 H8 Cd N6 S2 -","- C8 H8 Cd N6 S2 -","- C16 H16 Cd2 N12 S4 -","2","0.5","OB1018","Chen, Hong-Ji; Yang, Guang; Chen, Xiao-Ming","<i>catena</i>-Poly[[bis(imidazole-<i>N</i>^3^)cadmium(II)]-bis(μ-thiocyanato)-<i>S</i>:<i>N</i>;<i>N</i>:<i>S</i>]","Acta Crystallographica Section C","1999","55","12","2012","2014","10.1107/S0108270199011075","","","0.71073","MoKα","","0.027","0.023","","","","0.059","","","","","","1.114","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009300","8.9483","0.0014","27.469","0.005","9.111","0.002","90","","90","","90","","2239.5","0.7","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","4,5-Bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1H-imidazole/ethyl acetate(3:1)","","- C24.33 H21.67 N3 O4.67 -","- C24.32 H19 N3 O4.66 -","- C97.28 H76 N12 O18.64 -","4","1","OB1019","Inouye, Yoshinobu; Shimokoshi, Shuko; Sakaino, Yoshiko","An ethyl acetate inclusion complex of 4,5-bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1<i>H</i>-imidazole","Acta Crystallographica Section C","1999","55","12","2084","2087","10.1107/S0108270199011087","","","0.71073","MoKα","","0.189","0.077","","0.256","","0.182","","","1.192","","","1.403","","","warnings","has coordinates,has disorder","249443","2020-10-21","18:00:00",""
"2009301","8.896","0.001","26.771","0.005","9.209","0.002","90","","90","","90","","2193.2","0.7","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","4,5-Bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1H-imidazole","","- C23 H19 N3 O4 -","- C23 H19 N3 O4 -","- C92 H76 N12 O16 -","4","1","OB1019","Inouye, Yoshinobu; Shimokoshi, Shuko; Sakaino, Yoshiko","An ethyl acetate inclusion complex of 4,5-bis(4-methoxyphenyl)-2-(3-nitrophenyl)-1<i>H</i>-imidazole","Acta Crystallographica Section C","1999","55","12","2084","2087","10.1107/S0108270199011087","","","0.71073","MoKα","","0.225","0.065","","0.213","","0.142","","","0.95","","","1.06","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009302","6.7367","0.0005","13.6547","0.0005","14.2727","0.0004","90","","93.392","0.005","90","","1310.61","0.11","295","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,3-dicarbomethoxy-1,2-butadienylirontricarbonyl","","- C11 H10 Fe O7 -","- C11 H10 Fe O7 -","- C44 H40 Fe4 O28 -","4","1","OB1020","Kongsaeree, Palangpon; Tanboriphan, Suthad; Tarnchompoo, Bongkoch; Thebtaranonth, Yodhathai","Tricarbonyliron complexes derived from dimethyl 1,3-butadiene-2,3-dicarboxylate: formation of [Fe(CO)~3~]~2~‒dimethyl 1,3-butadiene-2,3-dicarboxylate","Acta Crystallographica Section C","1999","55","12","2007","2010","10.1107/S0108270199011695","","","0.71073","MoKα","","0.0492","0.0385","","","","0.1226","","","","","","0.862","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009303","7.6839","0.0004","8.7128","0.0009","14.049","0.001","105.614","0.008","97.418","0.005","102.04","0.006","868.62","0.13","295","2","","","","","","","","","","4","P -1","-P 1","2","","2,3-dicarbomethoxy-1,2-butadienyl-bis-irontricarbonyl","","- C14 H10 Fe2 O10 -","- C14 H10 Fe2 O10 -","- C28 H20 Fe4 O20 -","2","1","OB1020","Kongsaeree, Palangpon; Tanboriphan, Suthad; Tarnchompoo, Bongkoch; Thebtaranonth, Yodhathai","Tricarbonyliron complexes derived from dimethyl 1,3-butadiene-2,3-dicarboxylate: formation of [Fe(CO)~3~]~2~‒dimethyl 1,3-butadiene-2,3-dicarboxylate","Acta Crystallographica Section C","1999","55","12","2007","2010","10.1107/S0108270199011695","","","0.71073","MoKα","","0.0435","0.0366","","","","0.1126","","","","","","0.883","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009304","12.653","0.003","8.0849","0.0006","5.5247","0.0009","90","","95.408","0.008","90","","562.65","0.17","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","Methyl (R,Z)-(1-phenylethylimino)acetate N-oxide","","- C11 H13 N O3 -","- C11 H13 N O3 -","- C22 H26 N2 O6 -","2","1","OB1021","Inouye, Yoshinobu; Ishimura, Tomoyuki","Methyl (<i>R</i>,<i>Z</i>)-(1-phenylethylimino)acetate <i>N</i>-oxide","Acta Crystallographica Section C","1999","55","12","2087","2088","10.1107/S0108270199011506","","","0.71073","MoKα","","0.093","0.054","","0.268","","0.188","","","0.917","","","0.801","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009305","9.5728","0.0003","16.3086","0.0006","9.0007","0.0003","90","","112.114","0.003","90","","1301.81","0.08","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Poly[[tetraaquapraesodymium(III)-μ-(iminiodiacetato-O,O':O':O'',O''':O''')] dichloride hydrate]","","- C4 H16 Cl2 N O9 Pr -","- C4 H16 Cl2 N O9 Pr -","- C16 H64 Cl8 N4 O36 Pr4 -","4","1","OS1068","Li, Jun-Ran; Wang, Zhe-Ming; Yan, Chun-Hua; Zhou, Li-Ping; Jin, Tian-Zhu","Poly[[tetraaquapraesodymium(III)-μ-(iminiodiacetato-<i>O</i>,<i>O</i>':<i>O</i>':<i>O</i>'',<i>O</i>''':<i>O</i>''')] dichloride hydrate]","Acta Crystallographica Section C","1999","55","12","2073","2075","10.1107/S0108270199011658","","","0.71073","MoKα","","0.021","0.019","","","","0.047","","","","","","1.163","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009306","22.294","0.002","22.294","0.002","22.294","0.002","90","","90","","90","","11080.6","1.7","293","2","293","2","","","","","","","","5","F m -3 m","-F 4 2 3","225","","rubidium tetracontaoxo(hydro)(dodecamolybdo)vanadate tetradecahydrate","","- H29.89 Mo12 O54.95 Rb4.361 V0.616 -","- Mo12 O54.96 Rb4.362 V0.62 -","- Mo96 O439.68 Rb34.896 V4.96 -","8","0.0416667","OS1070","Pay Gómez, Cesar; Eriksson, Lars","Heteropoly blue Rb~4.4~[H~0.6~V~0.6~Mo~12~O~40~]","Acta Crystallographica Section C","1999","55","12","1974","1976","10.1107/S0108270199011208","","","0.71073","MoKα","","0.065","0.054","","","","0.186","","","","","","1.154","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009307","5.4835","0.0004","12.3418","0.0008","29.4245","0.0019","90","","90","","90","","1991.3","0.2","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","L-alanyl-L-phenylalanine–2-propanol solvate (1/2)","","- C18 H32 N2 O5 -","- C18 H32 N2 O5 -","- C72 H128 N8 O20 -","4","1","OS1078","Görbitz, Carl Henrik","<small>L</small>-Alanyl-<small>L</small>-phenylalanine–2-propanol (1/2) (α-form), <small>L</small>-valyl-<small>L</small>-phenylalanine–2-propanol (1/1) and <small>L</small>-leucyl-<small>L</small>-phenylalanine–2-propanol (1/1) (β-form)","Acta Crystallographica Section C","1999","55","12","2171","2177","10.1107/S0108270199011415","","","0.71073","MoKα","","0.113","0.076","","","","0.203","","","","","","1.096","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009308","9.8958","0.0002","22.3517","0.0006","16.4571","0.0003","90","","90.023","0.001","90","","3640.11","0.14","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-valyl-L-phenylalanine–2-propanol solvate (1/1)","","- C17 H28 N2 O4 -","- C17 H28 N2 O4 -","- C136 H224 N16 O32 -","8","4","OS1078","Görbitz, Carl Henrik","<small>L</small>-Alanyl-<small>L</small>-phenylalanine–2-propanol (1/2) (α-form), <small>L</small>-valyl-<small>L</small>-phenylalanine–2-propanol (1/1) and <small>L</small>-leucyl-<small>L</small>-phenylalanine–2-propanol (1/1) (β-form)","Acta Crystallographica Section C","1999","55","12","2171","2177","10.1107/S0108270199011415","","","0.71069","MoKα","","0.158","0.08","","","","0.139","","","","","","1.018","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009309","10.0858","0.0002","16.3754","0.0002","11.7987","0.0002","90","","91.698","0.001","90","","1947.81","0.06","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","L-leucyl-L-phenylalanine‒2-propanol solvate (1/1)","","- C18 H30 N2 O4 -","- C18 H30.102 N2 O4.051 -","- C72 H120.408 N8 O16.204 -","4","2","OS1078","Görbitz, Carl Henrik","<small>L</small>-Alanyl-<small>L</small>-phenylalanine‒2-propanol (1/2) (α-form), <small>L</small>-valyl-<small>L</small>-phenylalanine‒2-propanol (1/1) and <small>L</small>-leucyl-<small>L</small>-phenylalanine‒2-propanol (1/1) (β-form)","Acta Crystallographica Section C","1999","55","12","2171","2177","10.1107/S0108270199011415","","","0.71073","MoKα","","0.153","0.079","","","","0.169","","","","","","1.05","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009310","10.586","0.002","11.925","0.002","7.803","0.002","90","","105.64","0.03","90","","948.6","0.4","193","2","193","2","","","","","","","","6","P 1 2/c 1","-P 2yc","13","","Diaqua{hydrogen bis[1-(pyridin-2-yl)ethanone oximato-N,N']}nickel(II) perchlorate hydrate.","","- C14 H21 Cl N4 Ni O9 -","- C14 H21 Cl N4 Ni O9 -","- C28 H42 Cl2 N8 Ni2 O18 -","2","0.5","OS1079","Pajunen, Aarne; Orama, Marjatta; Saarinen, Heikki","Diaqua{hydrogen bis[1-(2-pyridyl)ethanone oximato-<i>N</i>,<i>N</i>']}nickel(II) perchlorate hydrate","Acta Crystallographica Section C","1999","55","12","2075","2077","10.1107/S010827019901166X","","","0.71073","MoKα","","0.03","0.03","","","","0.084","","","","","","1.115","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009311","7.002","0.002","18.442","0.005","11.443","0.002","90","","102.72","0.02","90","","1441.4","0.6","298.2","","298.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","8-methoxy-1,3-dimethyl-12-thioxopyrido[1',2':3,4]- imidazo[1,2-a][1,3]benzimidazol-2(12H)-one","","- C16 H13 N3 O2 S -","- C16 H13 N3 O2 S -","- C64 H52 N12 O8 S4 -","4","1","QA0184","Moses Babu, J.; Vyas, K.; Prabhakar, C.; Sreenivas Rao, D.; Om Reddy, G.","An omeprazole impurity","Acta Crystallographica Section C","1999","55","12","IUC9900162","","10.1107/S0108270199098194","","","1.5418","CuKα","","0.074","0.059","","0.104","","0.094","","","1.927","","","1.967","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009312","12.186","0.001","8.7763","0.0009","20.4128","0.0009","90","","104.593","0.004","90","","2112.7","0.3","298.2","","298.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[4-Acetyloxy-3,5,6-trimethyl-1-[4-nitrobenzoyl]oxy-2-yl]butan-2-one","","- C22 H23 N O7 -","- C22 H23 N O7 -","- C88 H92 N4 O28 -","4","1","QA0185","Prabhakar, C.; Vyas, K.; Moses Babu, J.; Sarma, M. R.; Om Reddy, G.","4-Acetoxy-3,5,6-trimethyl-2-(3-oxobutyl)phenyl 4-nitrobenzoate","Acta Crystallographica Section C","1999","55","12","IUC9900160","","10.1107/S0108270199098212","","","1.5418","CuKα","","0.0619","0.0482","","0.0836","","0.0797","","","1.799","","","1.931","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009313","10.136","0.005","16.778","0.006","5.066","0.006","97.62","0.07","100.65","0.06","95.95","0.04","831.9","1.1","293.2","","293.2","","","","","","","","","6","P -1","-P 1","2","Celecoxib","4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyazol-1-yl]benezenesulfonamide","","- C17 H14 F3 N3 O2 S -","- C17 H14 F3 N3 O2 S -","- C34 H28 F6 N6 O4 S2 -","2","1","QA0186","Vasu Dev, R.; Shashi Rekha, K.; Vyas, K.; Mohanti, S. B.; Rajender Kumar, P.; Om Reddy, G.","Celecoxib, a COX-II inhibitor","Acta Crystallographica Section C","1999","55","12","","","10.1107/S0108270199098200","","","1.5418","CuKα","","0.115","0.088","","0.096","","0.092","","","1.746","","","1.881","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009314","7.7633","0.0008","22.049","0.002","13.0223","0.0019","90","","90","","90","","2229.1","0.4","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,4-Dioxo-7-(D-arabino-1,2,3,4-tetraacetyloxibutyl)-1-methyl- 1,2,3,4-tetrahydropteridine","","- C19 H22 N4 O10 -","- C19 H22 N4 O10 -","- C76 H88 N16 O40 -","4","1","QA0188","Low, John Nicolson; Ferguson, George; Cobo, Justo; Nogueras, Manuel; Sánchez, Adolfo","7-(<small>D</small>-<i>arabino</i>-1,2,3,4-Tetraacetoxybutyl)-1-methyl-1,2,3,4-tetrahydropteridine-2,4-dione","Acta Crystallographica Section C","1999","55","12","IUC9900163","","10.1107/S0108270199098297","","","0.71073","MoKα","","0.122","0.06","","","","0.117","","","","","","0.939","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009315","14.3951","0.0011","8.9771","0.0009","19.052","0.002","90","","90","","90","","2462","0.4","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6-Amino-5-N-acetyl-N-(β-D-3,4,6-tri-O-acetylglucopyranosyl)amino- 2,4-dioxo-1,2,3,4-tetrahydro-3-methylpyrimidine, water solvent","","- C19 H28 N4 O12 -","- C19 H28 N4 O12 -","- C76 H112 N16 O48 -","4","1","QA0191","Low, John Nicolson; Cobo, Justo; Molina, Sebastián; Sánchez, Adolfo; Nogueras, Manuel; Ferguson, George","Two polyacetylated 6-amino-5-[<i>N</i>-(β-<small>D</small>-glucopyranosyl)amino]-3-methylpyrimidine-2,4(1<i>H</i>,3<i>H</i>)-diones","Acta Crystallographica Section C","1999","55","12","IUC9900164","","10.1107/S0108270199098285","","","0.71073","MoKα","","0.088","0.054","","","","0.148","","","","","","1.019","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009316","9.0315","0.0008","17.0918","0.0013","18.1487","0.0013","90","","90","","90","","2801.5","0.4","294","1","294","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6-Acetamido-5-N-acetyl-N-(β-D-2,3,4,6-tetra-O-acetylglucopyranosyl)amino- 2,4-dioxo-1,2,3,4-tetrahydro-3-methyl-pyrimidine","","- C23 H30 N4 O13 -","- C23 H30 N4 O13 -","- C92 H120 N16 O52 -","4","1","QA0191","Low, John Nicolson; Cobo, Justo; Molina, Sebastián; Sánchez, Adolfo; Nogueras, Manuel; Ferguson, George","Two polyacetylated 6-amino-5-[<i>N</i>-(β-<small>D</small>-glucopyranosyl)amino]-3-methylpyrimidine-2,4(1<i>H</i>,3<i>H</i>)-diones","Acta Crystallographica Section C","1999","55","12","IUC9900164","","10.1107/S0108270199098285","","","0.71073","MoKα","","0.074","0.039","","","","0.099","","","","","","0.986","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009317","10.055","0.002","10.405","0.002","12.138","0.002","100.89","0.03","98.99","0.03","96.72","0.03","1217.6","0.4","150","0.1","150","0.1","","","","","","","","4","P -1","-P 1","2","","Piperidinium 6-amino-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione","","- C10 H17 N5 O3 -","- C10 H17 N5 O3 -","- C40 H68 N20 O12 -","4","2","QB0126","Low, John Nicolson; Cobo, Justo; Melguizo, Manuel; Nogueras, Manuel; Sanchez, Adolfo","Piperidinium 6-amino-3-methyl-5-nitroso-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-ide","Acta Crystallographica Section C","1999","55","12","IUC9900153","","10.1107/S0108270199098303","","","0.71073","MoKα","","0.103","0.051","","","","0.135","","","","","","0.988","","","","has coordinates,has Fobs","198282","2020-10-21","18:00:00",""
"2009318","4.9241","0.0014","4.9241","","23.875","0.004","90","","90","","120","","501.33","0.17","293","2","293","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- La Mg2 Ni9 -","- La Mg2 Ni9 -","- La3 Mg6 Ni27 -","3","0.0833333","QB0128","Kadir, Karim; Yamamoto, Hitoshi; Sakai, Tetsuo; Uehara, Itsuki; Kanehisa, Noduko; Kai, Yasushi; Eriksson, Lars","LaMg~2~Ni~9~, an example of the new <i>AB</i>~2~<i>C</i>~9~ structure type","Acta Crystallographica Section C","1999","55","12","IUC9900152","","10.1107/S0108270199098418","","","0.71069","MoKα","","0.051","0.049","","","","0.145","","","","","","1.086","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009319","19.477","0.004","17.178","0.003","15.262","0.003","90","","107.23","0.03","90","","4877.1","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","O,O-two(β-trinitrideethyl)-α-p-toluenesulfonamido-α-m- nitrobenzalphospite","","- C18 H21 N8 O7 P S -","- C18 H21 N8 O7 P S -","- C144 H168 N64 O56 P8 S8 -","8","2","QB0129","Zhang, Jin-nan; Ye, Ling; Xi, Hong-wei; Li, Qi","Bis(2-azidoethyl) [(3-methylphenyl)(<i>p</i>-toluenesulfonamido)methyl]phosphonate","Acta Crystallographica Section C","1999","55","12","IUC9900157","","10.1107/S0108270199098224","","","0.71073","MoKα","","0.106","0.061","","0.232","0.161","","","","1.043","1.121","1.121","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009320","10.0695","0.0008","8.2112","0.0006","29.701","0.003","90","","90","","90","","2455.8","0.4","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","Phenylferrocene","Phenylferrocene","","- C16 H14 Fe -","- C16 H14 Fe -","- C128 H112 Fe8 -","8","1","QB0130","Fan, Hua-Jun; Carducci, Michael D.; Grittini, Carina; Mendoza, Alvaro; Lichtenberger, Dennis L.","Phenylferrocene","Acta Crystallographica Section C","1999","55","12","IUC9900154","","10.1107/S0108270199098406","","","0.71073","MoKα","","0.104","0.04","","","","0.092","","","","","","1.019","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009321","6.728","0.0008","6.728","0.0019","6.728","0.0013","90","","90","","90","","304.55","0.11","293","2","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","","","- B H4 K -","- B H4 K -","- B4 H16 K4 -","4","0.0208333","QB0131","Luck, Rudy L.; Schelter, Eric J.","Potassium borohydride","Acta Crystallographica Section C","1999","55","12","IUC9900151","","10.1107/S010827019909842X","","","0.71073","MoKα","","","0.005","","","","0.011","","","","","","1.239","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009322","9.139","0.001","13.522","0.002","17.737","0.002","90","","90","","90","","2191.9","0.5","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Bis(methylcyclopentadienyl)(piperidino-N)ytterbium piperidinate","","- C22 H35 N2 Yb -","- C22 H35 N2 Yb -","- C88 H140 N8 Yb4 -","4","1","QB0132","Wang, Yaorong; Yao, Yingming; Shen, Qi; Yu, Kaibei","Bis(η^5^-methylcyclopentadienyl)(piperidine-<i>N</i>)(piperidinido-<i>N</i>)ytterbium","Acta Crystallographica Section C","1999","55","12","IUC9900159","","10.1107/S0108270199098376","","","0.71073","MoKα","","0.029","0.024","","","","0.055","","","","","","0.96","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009323","10.4027","0.0002","11.5682","0.0002","14.9296","0.0003","77.0833","0.0013","72.0218","0.0012","85.2316","0.0011","1665.48","0.06","150","0.1","150","0.1","","","","","","","","6","P -1","-P 1","2","","Dimethyl-2-(6-benzyloxy-2-methylthio-4-pyrimidinyl)imino-3-(triphenyl- λ^5^-phosphanylidene)succinate","","- C36 H32 N3 O5 P S -","- C36 H32 N3 O5 P S -","- C72 H64 N6 O10 P2 S2 -","2","1","QB0133","Cobo, Justo; Molina, Sebastián; Sánchez, Adolfo; Nogueras, Manuel; Low, John Nicolson","Dimethyl 2-(6-benzyloxy-2-methylthiopyrimidin-4-yl)imino-3-(triphenyl-λ^5^-phosphanylidene)succinate","Acta Crystallographica Section C","1999","55","12","IUC9900150","","10.1107/S0108270199098315","","","0.71073","MoKα","","0.065","0.042","","","","0.128","","","","","","1.077","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009324","33.1828","0.0016","6.3349","0.0007","5.5592","0.0008","90","","92.406","0.007","90","","1167.6","0.2","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","","L-Alanyl-L-leucine hemihydrate","","- C9 H19 N2 O3.5 -","- C9 H19 N2 O3.5 -","- C36 H76 N8 O14 -","4","1","QB0134","Görbitz, Carl Henrik","<small>L</small>-Alanyl-<small>L</small>-leucine hemihydrate","Acta Crystallographica Section C","1999","55","12","IUC9900149","","10.1107/S0108270199098327","","","0.71073","MoKα","","0.0798","0.0752","","","","0.1978","","","","","","1.156","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009325","11.2104","0.0002","11.009","0.0002","30.5831","0.0006","90","","93.44","0.001","90","","3767.62","0.12","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","diazidobis(4,4'-di-tert-butyl-2,2'-bipyridine-N,N')manganese(II)","","- C36 H48 Mn N10 -","- C36 H48 Mn N10 -","- C144 H192 Mn4 N40 -","4","1","QB0135","Shen, Zhen; Shanmuga Sundara Raj, S.; Razak, Ibrahim Abdul; Fun, Hoong-Kun; Zuo, Jing-lin; You, Xiao-Zeng","Diazidobis(4,4'-di-<i>tert</i>-butyl-2,2'-bipyridine-<i>N</i>,<i>N</i>')manganese(II)","Acta Crystallographica Section C","1999","55","12","IUC9900167","","10.1107/S0108270199098352","","","0.71073","MoKα","","0.103","0.058","","","","0.155","","","","","","0.939","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009326","7.8759","0.0002","13.4002","0.0003","7.2779","0.0001","90","","110.632","0.001","90","","718.84","0.03","173","","173","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C6 H8 Cl N -","- C6 H8 Cl N -","- C24 H32 Cl4 N4 -","4","0.5","QB0137","Faber, Alexander; Lemke, Alexander; Spangenberg, Björn; Bolte, Michael","Three hydrohalogenides of organic nitrogen bases","Acta Crystallographica Section C","1999","55","12","IUC9900156","","10.1107/S0108270199098261","","","0.71073","MoKα","","0.0344","0.031","","0.083","0.0809","0.083","","","1.112","","","1.112","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009327","7.396","0.001","15.277","0.003","12.336","0.002","90","","91.23","0.02","90","","1393.5","0.4","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H8 Cl N -","- C6 H8 Cl N -","- C48 H64 Cl8 N8 -","8","2","QB0137","Faber, Alexander; Lemke, Alexander; Spangenberg, Björn; Bolte, Michael","Three hydrohalogenides of organic nitrogen bases","Acta Crystallographica Section C","1999","55","12","IUC9900156","","10.1107/S0108270199098261","","","0.71073","MoKα","","0.185","0.087","","","","0.151","","","","","","1.055","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009328","12.973","0.002","6.491","0.001","8.327","0.001","90","","90","","90","","701.2","0.17","173","2","173","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C6 H8 Br N -","- C6 H8 Br N -","- C24 H32 Br4 N4 -","4","0.5","QB0137","Faber, Alexander; Lemke, Alexander; Spangenberg, Björn; Bolte, Michael","Three hydrohalogenides of organic nitrogen bases","Acta Crystallographica Section C","1999","55","12","IUC9900156","","10.1107/S0108270199098261","","","0.71073","MoKα","","0.03","0.026","","","","0.058","","","","","","1.171","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009329","12.639","0.006","13.674","0.006","16.599","0.006","109.19","0.02","101.56","0.02","91.71","0.02","2640","2","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","Octabutyl 1-κ^2^C,2κ^2^C,3κ^2^C,4κ^2^C- tetrakis[μ-(2,3-diphenylquinoxalinyl-8-carboxylato)]- 1:2κ^2^O,O';2:3κ^2^O;3:4κ^2^O,O';1:4κ^2^O- bis-μ~3~-oxo-1:2:3κ^3^O-tetratin","","- C116 H124 N8 O10 Sn4 -","- C116 H124 N8 O10 Sn4 -","- C116 H124 N8 O10 Sn4 -","1","0.5","QB0138","Lo, Kong Mun; Ng, Seik Weng","Bis[1,1,3,3-tetrabutyl-1,3-bis(2,3-diphenylquinoxaline-6-carboxylato)-1,3-distannoxane]","Acta Crystallographica Section C","1999","55","12","IUC9900155","","10.1107/S010827019909839X","","","0.71073","MoKα","","0.139","0.07","","","","0.172","","","","","","1.01","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2009330","22.474","0.006","7.36","0.001","18.283","0.005","90","","122.85","0.01","90","","2540.6","1.1","293","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H8 Cu N4 O4 -","- C12 H8 Cu N4 O4 -","- C96 H64 Cu8 N32 O32 -","8","1","QB0139","Breneman, Gary L.; Howald, Carl W.; Parker, O. Jerry","Dinitrito(1,10-phenanthroline)copper(II)","Acta Crystallographica Section C","1999","55","12","IUC9900158","","10.1107/S0108270199098388","","","0.71073","MoKα","","","0.034","","","","0.051","","","","","","1.87","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009331","12.4124","0.0005","13.8275","0.0004","14.3744","0.0006","91.747","0.002","106.638","0.0017","99.61","0.002","2322.64","0.15","150","0.1","150","0.1","","","","","","","","5","P -1","-P 1","2","","4-(4-chlorophenyl)-5-cyano-3-(4-methylphenyl)-6-diphenyl-4,7-dihydro-2H-pyrazolo [3,4-b]pyridine:dimethylformamide (2/1)","","- C55 H45 Cl2 N9 O -","- C55 H45 Cl2 N9 O -","- C110 H90 Cl4 N18 O2 -","2","1","QB0140","Quiroga, Jairo; Cruz, Silvia; Insuasty, Braulio; Nogueras, Manuel; Sánchez, Adolfo; Cobo, Justo; Low, John Nicolson","Three 3-aryl-5-cyanopyrazolo[3,4-<i>b</i>]pyridines","Acta Crystallographica Section C","1999","55","12","IUC9900168","","10.1107/S0108270199098273","","","0.71073","MoKα","","0.16","0.062","","","","0.162","","","","","","0.934","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009332","15.6264","0.0003","12.4397","0.0002","21.1296","0.0004","90","","91.4371","0.0009","90","","4106.04","0.13","150","0.1","150","0.1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5-Cyano-4-(4-methoxyphenyl)-3,6-diphenyl-4,7-dihydro-2H-pyrazolo- [3,4-b]pyridine","","- C26 H20 N4 O -","- C26 H20 N4 O -","- C208 H160 N32 O8 -","8","1","QB0140","Quiroga, Jairo; Cruz, Silvia; Insuasty, Braulio; Nogueras, Manuel; Sánchez, Adolfo; Cobo, Justo; Low, John Nicolson","Three 3-aryl-5-cyanopyrazolo[3,4-<i>b</i>]pyridines","Acta Crystallographica Section C","1999","55","12","IUC9900168","","10.1107/S0108270199098273","","","0.71073","MoKα","","0.0561","0.0477","","","","0.1288","","","","","","1.057","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009333","6.6222","0.0005","11.0791","0.001","28.264","0.002","90","","96.248","0.005","90","","2061.4","0.3","150","0.1","150","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","3,4-Bis(4-chlorophenyl)-5-cyano-6-phenyl-1H-pyrazolo-[3,4-b]pyridine","","- C25 H14 Cl2 N4 -","- C25 H14 Cl2 N4 -","- C100 H56 Cl8 N16 -","4","1","QB0140","Quiroga, Jairo; Cruz, Silvia; Insuasty, Braulio; Nogueras, Manuel; Sánchez, Adolfo; Cobo, Justo; Low, John Nicolson","Three 3-aryl-5-cyanopyrazolo[3,4-<i>b</i>]pyridines","Acta Crystallographica Section C","1999","55","12","IUC9900168","","10.1107/S0108270199098273","","","0.71073","MoKα","","0.16","0.0576","","","","0.115","","","","","","0.935","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009334","15.758","0.003","15.306","0.002","14.496","0.002","90","","90","","90","","3496.3","0.9","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Perchlorato[(5RS,9SR)-1,5,9,13-tetraazatridecane]copper(II) perchlorate","","- C9 H24 Cl2 Cu N4 O8 -","- C9 H24 Cl2 Cu N4 O8 -","- C72 H192 Cl16 Cu8 N32 O64 -","8","1","QB0141","Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Tung, Shu-Fang; Chung, Chung-Sun","[(5<i>RS</i>,9<i>SR</i>)-4,8-Diazaundecane-1,11-diamine](perchlorato-<i>O</i>,<i>O</i>')copper(II) perchlorate","Acta Crystallographica Section C","1999","55","12","IUC9900172","","10.1107/S0108270199098339","","","0.71073","MoKα","","0.165","0.058","","","","0.164","","","","","","0.955","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009335","9.266","0.001","9.664","0.001","16.649","0.001","90","","98.47","0.01","90","","1474.6","0.2","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H14 N2 -","- C20 H14 N2 -","- C80 H56 N8 -","4","1","QB0143","Jerdioui, Badia; Zenkouar, Mohammed; El-Bali, Brahim; Bolte, Michael","<i>trans</i>-Bis(4-quinolyl)ethylene","Acta Crystallographica Section C","1999","55","12","IUC9900169","","10.1107/S0108270199098248","","","0.71073","MoKα","","0.0554","0.0386","","","","0.1046","","","","","","1.007","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009336","8.856","0.001","9.349","0.001","19.778","0.001","90","","90","","90","","1637.5","0.3","173","2","173","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","4-Phenyl-but-3-en-2-one","","- C10 H10 O -","- C10 H10 O -","- C80 H80 O8 -","8","1","QB0145","Degen, Alexander; Bolte, Michael","4-Phenylbut-3-en-2-one (benzalacetone)","Acta Crystallographica Section C","1999","55","12","IUC9900170","","10.1107/S0108270199098236","","","0.71073","MoKα","","0.0496","0.0411","","","","0.1218","","","","","","1.108","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009337","20.1188","0.0002","30.5945","0.0004","14.5526","0.0002","90","","107.048","0.001","90","","8563.89","0.19","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","/m-Oxo-/m-chloro-acetato-bis(dichlorotriphenylphosphinerhenium) chlorofrom solvate","","- C39 H34 Cl8 O3 P2 Re2 -","- C39 H34 Cl8 O3 P2 Re2 -","- C312 H272 Cl64 O24 P16 Re16 -","8","2","QB0147","Powell, Clem; Burrell, Anthony K.","μ-Acetato-μ-chloro-μ-oxo-bis[dichloro(triphenylphosphine)rhenium] chloroform solvate","Acta Crystallographica Section C","1999","55","12","IUC9900171","","10.1107/S0108270199098340","","","0.71073","MoKα","","0.052","0.037","","","","0.091","","","","","","1.199","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009338","11.333","0.002","16.949","0.003","13.344","0.002","90","","108.17","0.01","90","","2435.3","0.7","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H23 N3 O4 -","- C30 H23 N3 O4 -","- C120 H92 N12 O16 -","4","1","QB0148","Badri, Rahima; Kerbal, Abdelali; Najib, Bitit; El-Bali, Brahim; Escudie, Jean; Ranaivonjatovo, Henry; Bolte, Michael","3'-(<i>p</i>-Nitrophenyl)-2-phenyl-4'-(<i>p</i>-tolyl)spiro[isoquinoline-3(2<i>H</i>),5'(4'<i>H</i>)-isoxazolin]-4(1<i>H</i>)-one","Acta Crystallographica Section C","1999","55","12","IUC9900165","","10.1107/S010827019909825X","","","0.71073","MoKα","","0.093","0.052","","","","0.125","","","","","","1.032","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009339","13.919","0.004","9.211","0.004","14.856","0.004","90","","107.7","0.02","90","","1814.5","1.1","296.2","","","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","[1,3-dithiol-4,5-(3,4,5,6-tetramethylthio)-benzo-2-ylidnene, dichloro-Copper(II)]","","- C11 H12 Cl2 Cu S7 -","- C11 H12 Cl2 Cu S7 -","- C44 H48 Cl8 Cu4 S28 -","4","1","QB0149","Dai, Jie; Bian, Guo-qing; Zhou, Min-Yan; Maekawa, Masahiko; Munakata, Megumu","Dichloro(3,4,5,6-tetramethylthio-1,3-benzodithiazole-2-thione-<i>S</i>^5^,<i>S</i>^6^)copper(II)","Acta Crystallographica Section C","1999","55","12","IUC9900166","","10.1107/S0108270199098364","","","0.7107","MoKα","","","0.05","","","","0.1281","","","","","","1.011","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2009340","9.069","0.005","19.378","0.006","16.964","0.007","90","","105.15","0.05","90","","2878","2","301","2","","","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C29 H30 Cl2 N4 Ni O2 Zn -","- C29 H30 Cl2 N4 Ni O2 Zn -","- C116 H120 Cl8 N16 Ni4 O8 Zn4 -","4","1","SK1264","Atakol, Orhan; Ercan, Filiz; Arici, Cengiz; Fuess, Hartmut; Svoboda, Ingrid","{[μ-Bis(salicylidene)-1,3-propanediaminato]-bis(4-methylpyridine)nickel(II)}dichlorozinc(II)","Acta Crystallographica Section C","1999","55","12","2023","2026","10.1107/S0108270199010707","","","0.71073","MoKα","","","0.029","","","0.076","","","","","1.11","1.11","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009341","4.7651","0.0006","9.3404","0.0015","37.066","0.006","90","","90","","90","","1649.7","0.4","293","2","293","2","","","","","","","","4","P b c 21","P 2c -2b","29","Zinc heptanoate","Anhydrous Zinc(II) Heptanoate","","- C14 H26 O4 Zn -","- C14 H26 O4 Zn -","- C56 H104 O16 Zn4 -","4","1","SK1286","Jerôme Peultier; Michel Francois; Jean Steinmetz","Anhydrous polymeric zinc(II) heptanoate","Acta Crystallographica Section C","1999","55","12","2064","2065","10.1107/S0108270199008483","","","1.5418","CuKα","","0.112","0.055","","","","0.159","","","","","","0.908","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009342","10.336","0.004","11.65","0.004","5.846","0.003","97.45","0.04","96.11","0.04","83.5","0.03","690.5","0.5","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","2-chloro-4-benzoyl-6-phenyl pyrimidine","","- C17 H11 Cl N2 O -","- C17 H11 Cl N2 O -","- C34 H22 Cl2 N4 O2 -","2","1","SK1294","Mukherjee, Monika; Maiti, Susim; Khan, M. Wahab; Helliwell, Madeleine; Kundu, Nitya G.","4-Benzoyl-2-chloro-6-phenylpyrimidine","Acta Crystallographica Section C","1999","55","12","2186","2188","10.1107/S0108270199011865","","","0.71071","MoKα","","0.07","0.049","","0.134","","0.123","","","1.056","","","1.109","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009343","7.869","0.002","10.113","0.003","10.771","0.005","76.21","0.03","85.78","0.03","84.6","0.03","827.6","0.5","293","2","293","2","","","","","","","","3","P 1","P 1","1","","3α-Hydroxy-5α-androstane-4,17-dione","","- C19 H28 O3 -","- C19 H28 O3 -","- C38 H56 O6 -","2","2","SK1300","Andrade, L. C. R.; Paixão, J. A.; de Almeida, M. J.; Tavares da Silva, E. J.; Sá e Melo, M. L.; Campos Neves, A. S.","3α-Hydroxy-5α-androstane-4,17-dione","Acta Crystallographica Section C","1999","55","12","2149","2151","10.1107/S0108270199011877","","","0.71073","MoKα","","0.096","0.039","","","","0.113","","","","","","1.005","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009344","13.3506","0.0003","9.4397","0.0001","13.5106","0.0003","90","","109.566","0.001","90","","1604.36","0.05","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dioxo-bis(8-quinolinolato-N,O)tungsten(VI)","","- C18 H12 N2 O4 W -","- C18 H12 N2 O4 W -","- C72 H48 N8 O16 W4 -","4","0.5","SK1319","S.Shanmuga Sundara Raj; Hoong-Kun Fun; Zhen-Feng Chen; Jing Zhang; Xiang Xue; Ren-Gen Xiong; Xiao-Zeng You","Dioxobis(8-quinolinolato-<i>N</i>,<i>O</i>)tungsten(VI)","Acta Crystallographica Section C","1999","55","12","2037","2039","10.1107/S0108270199010719","","","0.71073","MoKα","","0.04","0.035","","","","0.089","","","","","","1.04","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009345","7.5803","0.0008","18.4838","0.0012","5.5653","0.0005","90","","90","","90","","779.77","0.12","293","2","293","2","","","","","","","","4","A m a 2","A 2 -2a","40","Potassiumdicoppervanadiumtetraselenide","Potassiumdicoppervanadiumtetraselenide","","- Cu2 K Se4 V -","- Cu2 K Se4 V -","- Cu8 K4 Se16 V4 -","4","0.5","SK1321","Tillinski, Ralf; Näther, Christian; Bensch, Wolfgang","KCu~2~VSe~4~","Acta Crystallographica Section C","1999","55","12","1959","1961","10.1107/S0108270199011427","","","0.71073","MoKα","","0.029","0.02","","0.047","0.045","","","","1.036","1.067","1.067","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009346","16.3","0.0008","5.455","0.001","34.976","0.002","90","","90.667","0.004","90","","3109.7","0.6","293","2","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3,5,5-triphenyl-(4H)-1,2,4-oxadiazoline","","- C20 H16 N2 O -","- C20 H16 N2 O -","- C160 H128 N16 O8 -","8","2","SK1322","Szczepankiewicz, Wojciech; Suwiński, Jerzy; Słowikowska, Joanna","3,5,5-Triphenyl-4,5-dihydro-1,2,4-oxadiazole","Acta Crystallographica Section C","1999","55","12","2156","2158","10.1107/S0108270199012482","","","1.54178","CuKα","","","0.0396","","","","0.1509","","","","","","0.937","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009347","8.574","0.001","8.7391","0.001","9.9027","0.0011","102.879","0.013","97.367","0.014","100.535","0.014","700","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H34 Br4 Ru2 -","- C26 H34 Br4 Ru2 -","- C26 H34 Br4 Ru2 -","1","0.5","SK1323","Antonia Neels; Helen Stoeckli-Evans; Laurent Plasseraud; Eva Garcia Fidalgo; Georg Süss-Fink","Di-μ-bromo-bis[bromo(η^6^-<i>para</i>-cymene)ruthenium(II)] benzene solvate and di-μ-iodo-bis[(η^6^-<i>para</i>-cymene)iodoruthenium(II)] toluene solvate","Acta Crystallographica Section C","1999","55","12","2030","2032","10.1107/S0108270199010410","","","0.71073","MoKα","","0.0615","0.0566","","","","0.1389","","","","","","1.029","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009348","8.755","0.001","9.09","0.001","10.42","0.001","103.71","0.01","96.18","0.01","100.12","0.01","783.37","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H36 I4 Ru2 -","- C27 H35 I4 Ru2 -","- C27 H35 I4 Ru2 -","1","0.5","SK1323","Antonia Neels; Helen Stoeckli-Evans; Laurent Plasseraud; Eva Garcia Fidalgo; Georg Süss-Fink","Di-μ-bromo-bis[bromo(η^6^-<i>para</i>-cymene)ruthenium(II)] benzene solvate and di-μ-iodo-bis[(η^6^-<i>para</i>-cymene)iodoruthenium(II)] toluene solvate","Acta Crystallographica Section C","1999","55","12","2030","2032","10.1107/S0108270199010410","","","0.71073","MoKα","","0.0426","0.0361","","","","0.1231","","","","","","1.294","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009349","10.1188","0.0004","11.5242","0.0004","15.7404","0.0005","92.957","0.002","97.931","0.002","105.392","0.002","1745.25","0.11","100","1","100","1","","","","","","","","4","P -1","-P 1","2","","4,4'-Biphenol–4,4'-bipyridyl (1/1)","","- C22 H18 N2 O2 -","- C22 H18 N2 O2 -","- C88 H72 N8 O8 -","4","2","SK1325","Glidewell, Christopher; Ferguson, George; Gregson, Richard M.; Lough, Alan J.","Two independent <i>C</i>^2^~2~(20) chains in the hydrogen-bonded structure of 4,4'-biphenol–4,4'-bipyridyl (1/1)","Acta Crystallographica Section C","1999","55","12","2133","2136","10.1107/S0108270199010434","","","0.71073","MoKα","","0.083","0.044","","","","0.115","","","","","","0.953","","","","has coordinates,has Fobs","301791","2025-08-18","23:15:34",""
"2009350","24.573","0.003","6.477","0.001","17.435","0.003","90","","128.72","0.01","90","","2165","0.6","125","","125","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-ethynyl-cyclohexylammonium acetate salt","","- C10 H17 N O2 -","- C10 H17 N O2 -","- C80 H136 N8 O16 -","8","1","SK1330","Steiner, Thomas; Schreurs, Antoine M. M.; Kroon, Jan","1-Ethynylcyclohexylammonium acetate","Acta Crystallographica Section C","1999","55","12","2131","2132","10.1107/S0108270199012469","","","0.71073","MoKα","","0.0605","0.0485","","","","0.1236","","","","","","1.095","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009351","27.9391","0.0008","27.9391","0.0008","12.7565","0.0004","90","","90","","90","","9957.6","0.5","100","1","100","1","","","","","","","","4","P -4","P -4","81","","2,2'-Biphenol—diazabicyclo[2.2.2]octane (2/1)","","- C30 H32 N2 O4 -","- C30 H32 N2 O4 -","- C480 H512 N32 O64 -","16","4","SK1331","Glidewell, Christopher; Ferguson, George; Gregson, Richard M.; Lough, Alan J.","2,2'-Biphenol‒1,4-diazabicyclo[2.2.2]octane (2/1), a three-dimensional framework built from O—H···O, O—H···N, N—H···O and C—H···π(arene) hydrogen bonds","Acta Crystallographica Section C","1999","55","12","2136","2140","10.1107/S0108270199011440","","","0.71073","MoKα","","0.1279","0.0572","","","","0.1619","","","","","","1.009","","","","has coordinates,has disorder","176759","2020-10-21","18:00:00",""
"2009352","9.602","0.005","7.636","0.006","16.661","0.005","90","","92.16","0.03","90","","1220.7","1.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","L-Argininium tris(acetato-O,O')dioxouranium(III)–acetic acid–water (1/1/1)","","- C14 H30 N4 O13 U -","- C14 H30 N4 O13 U -","- C28 H60 N8 O26 U2 -","2","1","SK1332","Ramos Silva, M.; Matos Beja, A.; Paixão, J. A.; Alte da Veiga, L.; Martin-Gil, J.","<small>L</small>-Argininium tris(acetato-<i>O</i>,<i>O</i>')dioxouranium(III)–acetic acid–water (1/1/1)","Acta Crystallographica Section C","1999","55","12","2039","2041","10.1107/S0108270199011907","","","0.71073","MoKα","","0.027","0.017","","","","0.043","","","","","","1.047","","","","has coordinates,has disorder,has Fobs","301791","2025-08-18","23:15:34",""
"2009353","8.5705","0.0017","13.657","0.003","14.895","0.003","84.26","0.03","81.95","0.03","87.11","0.03","1716.4","0.6","293","2","293","2","","","","","","","","5","P 1","P 1","1","Alprozolam dihydrate","8-chloro-1-methyl-6-phenyl-4H-1,2,4-triazolo[4,3-a][1,4]benzodiazepine dihydrate","","- C17 H17 Cl N4 O2 -","- C17 H14.75 Cl N4 O2 -","- C68 H59 Cl4 N16 O8 -","4","4","SX1085","Daniel R. Vega; Ricardo Baggio; Silvia Russi","8-Chloro-1-methyl-6-phenyl-4<i>H</i>-1,2,4-triazolo[4,3-<i>a</i>][1,4]benzodiazepine dihydrate","Acta Crystallographica Section C","1999","55","12","2094","2096","10.1107/S0108270199010446","","","0.71073","MoKα","","0.074","0.043","","","","0.133","","","","","","1.001","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2009354","11.2528","0.0016","25.346","0.002","13.0637","0.0015","90","","106.117","0.009","90","","3579.5","0.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","tris(1,10-phenanthroline)nickel(II) nitrate thiourea solvate","","- C37 H30 N10 Ni O7 S -","- C37 H30 N10 Ni O7 S -","- C148 H120 N40 Ni4 O28 S4 -","4","0.5","SX1088","Suescun, Leopoldo; Mombrú, Alvaro W.; Mariezcurrena, Raúl A.","Tris(1,10-phenanthroline)nickel(II) dinitrate thiourea monohydrate","Acta Crystallographica Section C","1999","55","12","1991","1993","10.1107/S0108270199011312","","","0.71069","MoKα","","0.0504","0.0395","","","","0.1162","","","","","","1.028","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009355","8.7543","0.0011","9.9307","0.0015","7.314","0.0016","108.537","0.014","106.347","0.014","85.225","0.012","578.48","0.18","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","catena-Di-μ-chloro(bis(2-pyridyl) ketone)copper(II)","","- C11 H8 Cl2 Cu N2 O -","- C11 H8 Cl2 Cu N2 O -","- C22 H16 Cl4 Cu2 N4 O2 -","2","1","SX1092","Mariezcurrena, Raúl A.; Mombrú, Alvaro W.; Suescun, Leopoldo; Kremer, Eduardo; González, Ricardo","<i>catena</i>-Poly[[[bis(2-pyridyl) ketone-<i>N</i>,<i>N</i>']copper(II)]-di-μ-chloro]","Acta Crystallographica Section C","1999","55","12","1989","1991","10.1107/S0108270199011750","","","0.71069","MoKα","","0.038","0.032","","","","0.096","","","","","","1.035","","","","has coordinates,has Fobs","176759","2020-10-21","18:00:00",""
"2009356","9.719","0.003","11.682","0.003","8.7504","0.0013","92.932","0.014","90.434","0.017","85.99","0.02","989.8","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","cis-dichloro(1,10-phenanthroline)tiourea-acuo-cobalt(II):tiourea","","- C14 H18 Cl2 Co N6 O S2 -","- C14 H18 Cl2 Co N6 O S2 -","- C28 H36 Cl4 Co2 N12 O2 S4 -","2","1","SX1094","Suescun, Leopoldo; Mariezcurrena, Raúl A.; Mombrú, Alvaro W.","[Co(phen)(thiourea)(H~2~ O)Cl~2~]^.^thiourea (phen is 1,10-phenanthroline)","Acta Crystallographica Section C","1999","55","12","2065","2068","10.1107/S0108270199011993","","","0.7107","MoKα","","0.0642","0.0409","","","","0.1223","","","","","","1.024","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009357","43.749","0.01","20.984","0.002","4.598","0.001","90","","90","","90","","4221.1","1.4","296","2","296","2","","","","","","","","4","F d d 2","F 2 -2d","43","","2-pyridylcarboxaldehyde isonicotinoyl hydrazone","","- C12 H10 N4 O -","- C12 H10 N4 O -","- C192 H160 N64 O16 -","16","1","TA1264","Richardson, Des R.; Becker, Erika; Bernhardt, Paul V.","The biologically active iron chelators 2-pyridylcarboxaldehyde isonicotinoylhydrazone, 2-pyridylcarboxaldehyde benzoylhydrazone monohydrate and 2-furaldehyde isonicotinoylhydrazone","Acta Crystallographica Section C","1999","55","12","2102","2105","10.1107/S0108270199011531","","","0.71073","MoKα","","0.108","0.05","","","","0.122","","","","","","1.034","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009358","7.1468","0.0006","11.994","0.007","29.493","0.005","90","","90","","90","","2528.1","1.6","296","2","296","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","2-pyridinecarboxaldehyde benzoyl hydrazone hydrate","","- C13 H13 N3 O2 -","- C13 H13 N3 O2 -","- C104 H104 N24 O16 -","8","1","TA1264","Richardson, Des R.; Becker, Erika; Bernhardt, Paul V.","The biologically active iron chelators 2-pyridylcarboxaldehyde isonicotinoylhydrazone, 2-pyridylcarboxaldehyde benzoylhydrazone monohydrate and 2-furaldehyde isonicotinoylhydrazone","Acta Crystallographica Section C","1999","55","12","2102","2105","10.1107/S0108270199011531","","","0.71073","MoKα","","0.058","0.034","","","","0.127","","","","","","1.059","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2009359","14.188","0.003","5.285","0.0003","26.954","0.006","90","","93.55","0.01","90","","2017.2","0.6","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2-furfuryl isonicotinoyl hydrazone","","- C11 H9 N3 O2 -","- C11 H9 N3 O2 -","- C88 H72 N24 O16 -","8","2","TA1264","Richardson, Des R.; Becker, Erika; Bernhardt, Paul V.","The biologically active iron chelators 2-pyridylcarboxaldehyde isonicotinoylhydrazone, 2-pyridylcarboxaldehyde benzoylhydrazone monohydrate and 2-furaldehyde isonicotinoylhydrazone","Acta Crystallographica Section C","1999","55","12","2102","2105","10.1107/S0108270199011531","","","0.71073","MoKα","","0.18","0.047","","","","0.143","","","","","","0.971","","","","has coordinates","301791","2025-08-18","23:15:34",""
"2019330","19.8165","0.0002","11.4468","0.0001","9.9208","0.0001","90","","109.185","0.0005","90","","2125.41","0.04","293","","293","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","barium titanate","","- Ba4 O27 Ti12 -","- Ba4 O27 Ti12 -","- Ba16 O108 Ti48 -","4","0.5","","Currao, A.","Ba4Ti12O27: Rietveld refinement using X-ray powder diffraction data","Acta Crystallographica Section C Crystal Structure Communications","1999","55","1","2","","10.1107/S0108270198010919","","","1.54056","CuKα~1~","","","","","","","","","","1.541","1.541","1.541","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2020372","12.889","","25.096","","16.189","","90","","94.812","","90","","5218.08","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Na6 H4 (Bi2 Ni1.62 W20.38 O70 (H2 O)6) (H2 O)36","","- Bi2 H88 Na6 Ni1.62 O112 W20.38 -","- Bi2 Na5.998 Ni1.62 O112 W20.38 -","- Bi4 Na11.996 Ni3.24 O224 W40.76 -","2","0.5","","Rosu, C.; Weakley, T.J.R.","Hexasodium tetrahydrogen (di(triaquanickelo)icosatungstodibismuthate(III)(10-)) 36-hydrate, Na6 H4 (Bi2 Ni2 W20 O70 (H2 O)6) . 36(H2 O)","Acta Crystallographica C (39,1983-)","1999","55","","1","1","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2021871","11.0232","0.0002","15.1645","0.0002","24.2826","0.0001","90","","90","","90","","4059.11","0.09","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Bis(dipropylthiocarbamoyl)disulfide","","- C14 H28 N2 S4 -","- C14 H28 N2 S4 -","- C112 H224 N16 S32 -","8","1","","Jian, F.; Jiang, L.; Fun, H.-K.; Chinnakali, K.; Razak, I. A.; You, X.","Bis(dipropylthiocarbamoyl) disulfide","Acta Crystallographica Section C Crystal Structure Communications","1999","55","4","573","","10.1107/S010827019801573X","","","0.71073","MoKα","","0.078","0.051","","","","0.143","","","","","","1.06","","","","has coordinates","246031","2020-10-21","18:00:00",""
"2021872","8.4341","0.0001","15.5112","0.0003","11.4293","0.0001","90","","90.397","0.001","90","","1495.18","0.04","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","(E)-2,4'-dihydroxy-3,3'-dimethoxy-5'-methylstilbene","","- C17 H18 O4 -","- C17 H18 O4 -","- C68 H72 O16 -","4","1","","Li, S.; Lundquist, K.; Stomberg, R.","An investigation of 2,4'-dihydroxy-3,3'-dimethoxy-5'-methylstilbene using X-ray crystallography and NMR spectroscopy","Acta Crystallographica Section C Crystal Structure Communications","1999","55","6","1012","","10.1107/S0108270199000670","","","0.71073","MoKα","","0.057","0.043","","","","0.127","","","","","","1.053","","","","has coordinates","246032","2020-10-21","18:00:00",""
"2021873","9.198","0.001","10.559","0.001","10.593","0.001","68.94","0.01","79.01","0.01","67.41","0.01","884.78","0.17","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","Diisopropylammonium-Diphenylmethylnitronate","","- C19 H26 N2 O2 -","- C19 H26 N2 O2 -","- C38 H52 N4 O4 -","2","1","","Sievert, M.; Nagel, N.; Bock, H.; Dienelt, R.","Diisopropylammonium diphenylmethylnitronate at 200K","Acta Crystallographica Section C Crystal Structure Communications","1999","55","7","1147","","10.1107/S0108270199003054","","","0.71073","MoKα","","0.0767","0.0448","","0.1142","0.0965","","","","1.022","1.068","1.068","","","","","has coordinates","246033","2020-10-21","18:00:00",""
"2105530","13.667","0.004","18.647","0.011","20.188","0.006","90","","90.72","0.02","90","","5144","4","243","2","243","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C58 H64 N2 O12 -","- C57.97 H44 N2 O11.99 -","- C231.88 H176 N8 O47.96 -","4","1","AN0547","Thuéry, Pierre; Nierlich, Martine; Calemczuk, Roberto; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques","Three conformational polymorphs and order‒disorder phase transition in a calix[4]arene bis(crown)","Acta Crystallographica Section B","1999","55","1","95","103","10.1107/S0108768198009252","","","0.71073","MoKα","","0.2004","0.1273","","0.385","0.3155","","","","1.105","1.363","1.363","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105531","20.341","0.006","11.709","0.003","23.875","0.008","90","","112.39","0.02","90","","5258","3","273","2","273","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C58 H64 N2 O12 -","- C58.06 H42 N2 O12.04 -","- C232.24 H168 N8 O48.16 -","4","1","AN0547","Thuéry, Pierre; Nierlich, Martine; Calemczuk, Roberto; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques","Three conformational polymorphs and order‒disorder phase transition in a calix[4]arene bis(crown)","Acta Crystallographica Section B","1999","55","1","95","103","10.1107/S0108768198009252","","","0.71073","MoKα","","0.1669","0.1074","","0.3669","0.28","","","","1.073","1.227","1.227","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105532","20.285","0.008","11.608","0.004","23.894","0.006","92.22","0.03","112.32","0.02","87.81","0.03","5199","3","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C58 H64 N2 O12 -","- C58.11 H48 N2 O12.054 -","- C232.44 H192 N8 O48.216 -","4","2","AN0547","Thuéry, Pierre; Nierlich, Martine; Calemczuk, Roberto; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques","Three conformational polymorphs and order‒disorder phase transition in a calix[4]arene bis(crown)","Acta Crystallographica Section B","1999","55","1","95","103","10.1107/S0108768198009252","","","0.71073","MoKα","","0.1141","0.0797","","0.2451","0.2086","","","","0.965","1.015","1.015","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105533","6.5533","0.001","4.8848","0.001","10.148","0.002","90","","107.99","0.011","90","","308.97","0.1","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Tetrafluorohydroquinone","2,3,5,6-Tetrafluorohydroquinone","","- C6 H2 F4 O2 -","- C6 H2 F4 O2 -","- C12 H4 F8 O4 -","2","0.5","AN0560","Thalladi, Venkat R.; Weiss, Hans-Christoph; Boese, Roland; Nangia, Ashwini; Desiraju, Gautam R.","A comparative study of the crystal structures of tetrahalogenated hydroquinones and γ-hydroquinone","Acta Crystallographica Section B","1999","55","6","1005","1013","10.1107/S0108768199005911","","","0.71073","MoKα","","0.0559","0.0405","","0.1308","0.1143","","","","1.05","1.08","1.08","","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105534","8.8907","0.0002","4.7316","0.0001","11.0612","0.0003","90","","92.167","0.001","90","","464.981","0.019","303","2","303","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Tetrabromohydroquinone","2,3,5,6-Tetrabromohydroquinone","","- C6 H2 Br4 O2 -","- C6 H2 Br4 O2 -","- C12 H4 Br8 O4 -","2","0.5","AN0560","Thalladi, Venkat R.; Weiss, Hans-Christoph; Boese, Roland; Nangia, Ashwini; Desiraju, Gautam R.","A comparative study of the crystal structures of tetrahalogenated hydroquinones and γ-hydroquinone","Acta Crystallographica Section B","1999","55","6","1005","1013","10.1107/S0108768199005911","","","0.71073","MoKα","","0.0843","0.0665","","0.1462","0.1431","","","","0.929","1.16","1.16","","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105550","7.1633","0.0007","15.94","0.003","11.137","0.002","90","","98.44","0.01","90","","1257.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","1,5-pentanediammonium tetrachlorocobaltate","","- C5 H16 Cl4 Co N2 -","- C5 H16 Cl4 Co N2 -","- C20 H64 Cl16 Co4 N8 -","4","1","BM0020","Criado, J. J.; Jiménez-Sánchez, A.; Cano, F. H.; Sáez-Puche, R.; Rodríguez-Fernández, E.","Preparation and characterization of tetrachlorocobaltates(II) of α,ω-alkylenediammonium. Magnetic and thermal properties. Crystal structure of [NH~3~(CH~2~)~5~NH~3~]CoCl~4~","Acta Crystallographica Section B","1999","55","6","947","952","10.1107/S0108768199005698","","","1.5418","CuKα","","0.0795","0.0633","","0.1779","0.1674","","","","1.011","1.117","1.117","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105553","8.9311","0.0011","17.127","0.002","6.627","0.0008","90","","111.61","0.002","90","","942.4","0.2","295","","295","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","bis-ethylenediamine nickel hexavanadium tetradecaoxide","","- C4 H16 N4 Ni O14 V6 -","- C4 H16 N4 Ni O14 V6 -","- C8 H32 N8 Ni2 O28 V12 -","2","0.5","BR0079","Zavalij, Peter Y.; Zhang, Fan; Whittingham, M. Stanley","Crystal structure of layered bis(ethylenediamine)nickel hexavanadate as a new representative of the V~6~O~14~ series","Acta Crystallographica Section B","1999","55","6","953","962","10.1107/S0108768199005467","","","0.71073","MoKα","","","0.06","","","0.0637","","","","","1.29","1.29","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105554","17.862","0.002","17.127","0.002","6.627","0.0008","90","","111.61","0.002","90","","1884.9","0.4","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","bis-ethylenediamine nickel hexavanadium tetradecaoxide","","- C4 H16 N4 Ni O14 V6 -","- C4 H16 N4 Ni O14 V6 -","- C16 H64 N16 Ni4 O56 V24 -","4","1","BR0079","Zavalij, Peter Y.; Zhang, Fan; Whittingham, M. Stanley","Crystal structure of layered bis(ethylenediamine)nickel hexavanadate as a new representative of the V~6~O~14~ series","Acta Crystallographica Section B","1999","55","6","953","962","10.1107/S0108768199005467","","","","","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105555","8.368","0.0007","8.368","0.0007","19.13687","0.00004","90","","90","","120","","1160.5","0.14","18","","18","","","","","","","","","3","P 63/m m c","-P 6c 2c","","","lanthanum molybdenum oxide","","- La Mo2 O5 -","- La Mo2 O5 -","- La12 Mo24 O60 -","12","0.5","BR0083","Hibble, Simon J.; Cooper, Steven P.; Patat, Saban; Hannon, Alex C.","Total neutron diffraction: a route to the correct local structure of disordered LaMo~2~O~5~ and its application to the model compound Zn~2~Mo~3~O~8~","Acta Crystallographica Section B","1999","55","5","683","697","10.1107/S0108768199004103","","neutron","","neutron","","0.056","","","0.048","","","","","","","","","","","","has coordinates","281832","2023-03-13","07:47:31",""
"2105556","5.77322","0.00001","5.77322","0.00001","9.91231","0.00004","90","","90","","120","","286.116","0.0014","18","","18","","","","","","","","","3","P 63 m c","P 6c -2c","186","","zinc molybdate","","- Mo3 O8 Zn2 -","- Mo0.5 O1.33333 Zn0.333333 -","- Mo6 O16 Zn4 -","12","1","BR0083","Hibble, Simon J.; Cooper, Steven P.; Patat, Saban; Hannon, Alex. C.","Total neutron diffraction: a route to the correct local structure of disordered LaMo~2~O~5~ and its application to the model compound Zn~2~Mo~3~O~8~","Acta Crystallographica Section B","1999","55","5","683","697","10.1107/S0108768199004103","","neutron","","neutron","","0.058","","","0.047","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105557","8.5194","0.0002","4.7448","0.0001","10.397","0.0003","90","","90.013","0.006","90","","420.276","0.018","298","","298","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","phosphorus oxynitride","","- N O P -","- N O P -","- N12 O12 P12 -","12","1.5","BR0087","Haines, J.; Chateau, C.; Léger, J. M.; Le Sauze, A.; Diot, N.; Marchand, R.; Hull, S.","Crystal structure of moganite-type phosphorus oxynitride: relationship to other twinned-quartz-based structures","Acta Crystallographica Section B","1999","55","5","677","682","10.1107/S010876819900347X","","neutron","","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105559","7.856","0.008","7.732","0.007","7.827","0.007","90","","99.92","0.04","90","","468.3","0.8","296","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- Cs2 H3 O8 P S -","- Cs2 H3 O8 P S -","- Cs4 H6 O16 P2 S2 -","2","0.5","BS0007","Chisholm, Calum R. I.; Haile, Sossina M.","Structure and thermal behavior of the new superprotonic conductor Cs~2~(HSO~4~)(H~2~PO~4~)","Acta Crystallographica Section B","1999","55","6","937","946","10.1107/S0108768199009921","","","0.7107","MoKα","","0.0399","0.0348","","0.089","","0.0855","","","1.042","","","1.042","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105579","8.771","0.002","13.344","0.005","11.036","0.002","90","","108.314","0.008","90","","1226.2","0.6","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-amino-2-thiazolinium indole-2-carboxylate","","- C12 H13 N3 O2 S -","- C12 H13 N3 O2 S -","- C48 H52 N12 O8 S4 -","4","1","HA0177","Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.","Molecular co-crystals of 2-aminothiazole derivatives","Acta Crystallographica Section B","1999","55","5","758","766","10.1107/S0108768199003146","","","0.71073","MoKα","","0.0739","0.0357","","","","0.1011","","","","","","1.002","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105580","11.9723","0.0008","12.5938","0.001","15.063","0.002","90","","90","","90","","2271.2","0.4","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","2-amino-2-thiazolinium N-methylpyrrole-2-carboxylate","","- C9 H13 N3 O2 S -","- C9 H13 N3 O2 S -","- C72 H104 N24 O16 S8 -","8","1","HA0177","Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.","Molecular co-crystals of 2-aminothiazole derivatives","Acta Crystallographica Section B","1999","55","5","758","766","10.1107/S0108768199003146","","","0.71073","MoKα","","0.0854","0.0366","","","","0.1172","","","","","","0.997","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105581","10.182","0.004","11.923","0.002","12.284","0.006","90","","107.23","0.02","90","","1424.4","0.9","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-Aminobenzothiazolium indole-2-carboxylate","","- C16 H13 N3 O2 S -","- C16 H13 N3 O2 S -","- C64 H52 N12 O8 S4 -","4","1","HA0177","Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.","Molecular co-crystals of 2-aminothiazole derivatives","Acta Crystallographica Section B","1999","55","5","758","766","10.1107/S0108768199003146","","","0.71073","MoKα","","0.1015","0.0511","","","","0.162","","","","","","0.936","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105582","5.5561","0.0009","19.701","0.003","12.143","0.002","90","","100.263","0.008","90","","1307.9","0.4","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-aminobenzothiazolium N-methylpyrrole-2-carboxylate","","- C13 H13 N3 O2 S -","- C13 H13 N3 O2 S -","- C52 H52 N12 O8 S4 -","4","1","HA0177","Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.","Molecular co-crystals of 2-aminothiazole derivatives","Acta Crystallographica Section B","1999","55","5","758","766","10.1107/S0108768199003146","","","0.71073","MoKα","","0.0903","0.0381","","","","0.1078","","","","","","0.991","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105583","9.162","0.002","11.121","0.003","12.033","0.002","90","","104.388","0.009","90","","1187.6","0.5","293","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-aminobenzothiazolium thiophene-2-carboxylate","","- C12 H10 N2 O2 S2 -","- C12 H10 N2 O2 S2 -","- C48 H40 N8 O8 S8 -","4","1","HA0177","Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.","Molecular co-crystals of 2-aminothiazole derivatives","Acta Crystallographica Section B","1999","55","5","758","766","10.1107/S0108768199003146","","","0.71073","MoKα","","0.0801","0.0489","","","","0.156","","","","","","1.051","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105584","6.848","0.003","7.54","0.004","11.111","0.005","90","","106.01","0.005","90","","551.5","0.5","100","2","100","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C5 H6 O S -","- C5 H6 O S -","- C20 H24 O4 S4 -","4","1","HA0185","Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.","Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents","Acta Crystallographica Section B","1999","55","6","963","974","10.1107/S0108768199003547","","","0.71073","MoKα","","0.0506","0.0433","","","","0.123","","","","","","1.15","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105585","6.641","0.004","7.109","0.004","11.594","0.005","90","","90","","90","","547.4","0.5","100","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C5 H6 O S -","- C5 H6 O S -","- C20 H24 O4 S4 -","4","1","HA0185","Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.","Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents","Acta Crystallographica Section B","1999","55","6","963","974","10.1107/S0108768199003547","","","0.71073","MoKα","","0.0568","0.0487","","","","0.1425","","","","","","1.07","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105586","7.5941","0.0009","7.8219","0.001","7.9811","0.0009","63.112","0.005","64.66","0.005","89.636","0.005","371.7","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H8 O2 S -","- C7 H8 O2 S -","- C14 H16 O4 S2 -","2","1","HA0185","Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.","Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents","Acta Crystallographica Section B","1999","55","6","963","974","10.1107/S0108768199003547","","","0.71073","MoKα","","0.0446","0.0321","","","","0.0878","","","","","","1.06","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105587","7.516","0.002","8.332","0.002","9.059","0.002","90","","100.19","0.03","90","","558.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C5 H3 N O S -","- C5 H3 N O S -","- C20 H12 N4 O4 S4 -","4","1","HA0185","Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.","Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents","Acta Crystallographica Section B","1999","55","6","963","974","10.1107/S0108768199003547","","","0.71073","MoKα","","0.0284","0.0243","","0.0703","0.0651","","","","1.08","1.09","1.09","","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105588","19.513","0.006","8.083","0.002","4.046","0.002","90","","90","","90","","638.1","0.4","223","0.2","223","0.2","","","","","","","","4","P n 21 a","P -2ac -2n","33","","","","- C5 H6 O S2 -","- C5 H6 O S2 -","- C20 H24 O4 S8 -","4","1","HA0185","Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.","Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents","Acta Crystallographica Section B","1999","55","6","963","974","10.1107/S0108768199003547","","","0.71073","MoKα","","0.0432","0.0424","","0.0906","0.0901","","","","1.191","1.21","1.21","","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105589","10.826","0.002","17.065","0.002","19.19","0.003","90","","91.011","0.012","90","","3544.7","1","223","0.2","223","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H12 O S -","- C9 H12 O S -","- C144 H192 O16 S16 -","16","4","HA0185","Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.","Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents","Acta Crystallographica Section B","1999","55","6","963","974","10.1107/S0108768199003547","","","0.71073","MoKα","","0.0793","0.0374","","0.1029","0.0935","","","","0.98","1.14","1.14","","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105590","24.527","0.006","6.064","0.001","7.457","0.004","90","","100.1","0.02","90","","1091.9","0.7","164","2","164","2","","","","","","","","4","I 1 2/c 1","-I 2yc","15","4,4'-dichlorobenzophenone","4,4'-dichlorobenzophenone","","- C13 H8 Cl2 O -","- C13 H8 Cl2 O -","- C52 H32 Cl8 O4 -","4","0.5","HR0042","Mitkevich, V. V.; Lirtsman, V. G.; Strzhemechny, M. A.; Avdeenko, A. A.; Eremenko, V. V.","Investigation of the structural phase transitions near 190K in 4,4'-dichlorobenzophenone","Acta Crystallographica Section B","1999","55","5","799","806","10.1107/S0108768199005480","","","0.71073","MoKα","","0.0521","0.0399","","0.1449","0.1101","","","","1.194","1.185","1.185","","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105592","13.706","0.003","22.8","0.005","30.674","0.006","90","","97.15","0.03","90","","9511","4","133","2","133","2","","","","","","","","4","P 1 21 1","P 2yb","4","","N-tert-butyloxycarbonyl-L-phenylalanyl-L-leucine benzyl ester","","- C27 H36 N2 O5 -","- C27 H36 N2 O5 -","- C378 H504 N28 O70 -","14","7","KA0045","Antolić, S.; Teichert, M.; Sheldrick, G.; Kojić-Prodić, B.; Čudić, M.; Horvat, Š.","Structure and molecular modelling of protected dipeptide fragment (Boc–Phe–Leu–OBzl) of enkephalin","Acta Crystallographica Section B","1999","55","6","975","984","10.1107/S0108768199004656","","","0.71073","MoKα","","0.0569","0.0455","","","","0.1035","","","","","","1.129","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105614","13.667","0.001","16.414","0.002","9.409","0.001","90","","94.54","0.01","90","","2104.1","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","N-Methyl-2,4-diphenyl-7-tertiary butyl 3-azabicyclo[3.3.1]nonane","","- C25 H33 N -","- C25 H33 N -","- C100 H132 N4 -","4","1","NA0088","Kumaran, D.; Ponnuswamy, M. N.; Shanmugam, G.; Ponnuswamy, S.; Jeyaraman, R.; Shivakumar, K.; Fun, H.-K.","Molecular structures and conformations of three 3-azabicyclononanes","Acta Crystallographica Section B","1999","55","5","793","798","10.1107/S0108768199005273","","","0.71073","MoKα","","0.094","0.0592","","0.1848","0.1537","","","","0.93","1.076","1.076","","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105615","14.687","0.001","12.931","0.001","18.564","0.001","90","","90","","90","","3525.6","0.4","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","N-Acetyl-2,4-diphenyl-3-azabicyclo[3.3.1]nonane","","- C22 H25 N O -","- C22 H25 N O -","- C176 H200 N8 O8 -","8","1","NA0088","Kumaran, D.; Ponnuswamy, M. N.; Shanmugam, G.; Ponnuswamy, S.; Jeyaraman, R.; Shivakumar, K.; Fun, H.-K.","Molecular structures and conformations of three 3-azabicyclononanes","Acta Crystallographica Section B","1999","55","5","793","798","10.1107/S0108768199005273","","","0.71073","MoKα","","0.0783","0.0431","","0.1114","0.0994","","","","0.885","1.035","1.035","","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105616","7.638","0.001","13.188","0.001","18.865","0.002","90","","97.94","0.01","90","","1882.1","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-Methyl-2,4-diorthomethyl phenyl-9-hydroxy 3-azabicyclo[3.3.1]nonane","","- C23 H29 N O -","- C23 H29 N O -","- C92 H116 N4 O4 -","4","1","NA0088","Kumaran, D.; Ponnuswamy, M. N.; Shanmugam, G.; Ponnuswamy, S.; Jeyaraman, R.; Shivakumar, K.; Fun, H.-K.","Molecular structures and conformations of three 3-azabicyclononanes","Acta Crystallographica Section B","1999","55","5","793","798","10.1107/S0108768199005273","","","0.71073","MoKα","","0.0603","0.0426","","0.135","0.122","","","","1.061","1.207","1.207","","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105617","8.19","0.001","14.463","0.002","18.115","0.003","90","","96.2","0.01","90","","2133.2","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4,5-dihydronaphto[1,2-d]-1H,3-methylpyrazole hemihydrochloride","","- C24 H25 Cl N4 -","- C24 H25 Cl N4 -","- C96 H100 Cl4 N16 -","4","1","NA0091","Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Fernàndez-Castaño, Cristina","Self-assembly of N<i>H</i>-pyrazoles <i>via</i> intermolecular N—H···N hydrogen bonds","Acta Crystallographica Section B","1999","55","6","985","993","10.1107/S0108768199004966","","","0.71073","MoKα","","0.1537","0.0562","","","","0.1257","","","","","","0.971","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105618","16.409","0.003","7.619","0.001","13.544","0.006","90","","90","","90","","1693.3","0.8","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","3-hydroxy-5-methyl-4-(3'-methylpyrazol-5'-yl)pyrazole","","- C8 H10 N4 O -","- C8 H10 N4 O -","- C64 H80 N32 O8 -","8","1","NA0091","Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Fernàndez-Castaño, Cristina","Self-assembly of N<i>H</i>-pyrazoles <i>via</i> intermolecular N—H···N hydrogen bonds","Acta Crystallographica Section B","1999","55","6","985","993","10.1107/S0108768199004966","","","0.71073","MoKα","","0.1142","0.0696","","","","0.1863","","","","","","1.046","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105619","7.196","0.003","14.125","0.002","10.862","0.002","90","","97.34","0.03","90","","1095","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","E,2-(4-cyanophenylhydrazono)-3-oxobutanenitrile","","- C11 H8 N4 O -","- C11 H8 N4 O -","- C44 H32 N16 O4 -","4","1","NA0097","Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.","Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones","Acta Crystallographica Section B","1999","55","6","994","1004","10.1107/S0108768199008435","","","0.71073","MoKα","","0.1536","0.0626","","","","0.169","","","","","","0.945","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105620","7.052","0.002","13.211","0.002","11.996","0.002","90","","104.96","0.02","90","","1079.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","E,2-(4-methylphenylhydrazono)-3-oxobutanenitrile","","- C11 H11 N3 O -","- C11 H11 N3 O -","- C44 H44 N12 O4 -","4","1","NA0097","Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.","Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones","Acta Crystallographica Section B","1999","55","6","994","1004","10.1107/S0108768199008435","","","0.71073","MoKα","","0.0694","0.0451","","","","0.14","","","","","","1.057","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105621","8.638","0.003","10.841","0.002","12.208","0.002","90","","94.69","0.02","90","","1139.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","E,2-(4-acetylphenylhydrazono)-3-oxobutanenitrile","","- C12 H11 N3 O2 -","- C12 H11 N3 O2 -","- C48 H44 N12 O8 -","4","1","NA0097","Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.","Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones","Acta Crystallographica Section B","1999","55","6","994","1004","10.1107/S0108768199008435","","","0.71073","MoKα","","0.0941","0.0532","","","","0.1548","","","","","","1.046","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105622","15.236","0.002","6.618","0.001","11.379","0.001","90","","90","","90","","1147.4","0.3","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","E,2-(2-methylphenylhydrazono)-3-oxobutanenitrile","","- C11 H11 N3 O2 -","- C11 H11 N3 O2 -","- C44 H44 N12 O8 -","4","0.5","NA0097","Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.","Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones","Acta Crystallographica Section B","1999","55","6","994","1004","10.1107/S0108768199008435","","","0.71073","MoKα","","0.0896","0.0501","","","","0.1458","","","","","","1.025","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105623","6.878","0.002","8.241","0.001","11.395","0.001","105.21","0.01","96.62","0.02","102.92","0.02","597","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","E,2-(2-acetylphenylhydrazono)-3-oxobutanenitrile","","- C12 H11 N3 O2 -","- C12 H11 N3 O2 -","- C24 H22 N6 O4 -","2","1","NA0097","Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.","Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones","Acta Crystallographica Section B","1999","55","6","994","1004","10.1107/S0108768199008435","","","0.71073","MoKα","","0.0743","0.0487","","","","0.1495","","","","","","1.065","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105624","7.184","0.001","19.491","0.002","8.084","0.001","90","","109.27","0.01","90","","1068.5","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","E, 2-(2-nitrophenylhydrazono)-3-oxobutanenitrile","","- C10 H8 N4 O3 -","- C10 H8 N4 O3 -","- C40 H32 N16 O12 -","4","1","NA0097","Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.","Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones","Acta Crystallographica Section B","1999","55","6","994","1004","10.1107/S0108768199008435","","","0.71073","MoKα","","0.0561","0.0401","","","","0.1173","","","","","","1.085","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105625","12.684","0.007","11.74","0.002","11.024","0.003","90","","111.4","0.04","90","","1528.4","1.1","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ph-TEMPO","4-benzylideneamino-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C16 H23 N2 O -","- C16 H23 N2 O -","- C64 H92 N8 O4 -","4","1","OA0021","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds","Acta Crystallographica Section B","1999","55","6","1057","1067","10.1107/S0108768199007326","","","0.71073","MoKα","","0.0987","0.0498","","","","0.147","","","","","","1.012","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105626","12.5774","0.0014","11.6228","0.0016","10.8229","0.0017","90","","110.853","0.009","90","","1478.5","0.4","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ph-TEMPO","4-benzylideneamino-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C16 H23 N2 O -","- C16 H23 N2 O -","- C64 H92 N8 O4 -","4","1","OA0021","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds","Acta Crystallographica Section B","1999","55","6","1057","1067","10.1107/S0108768199007326","","","0.71073","MoKα","","0.049","0.0358","","","","0.0991","","","","","","1.016","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105627","13.5737","0.0018","11.8796","0.0018","11.1628","0.0016","90","","98.76","0.011","90","","1779","0.4","296","","296","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","MeS-Ph-TEMPO","4-(4-methylthiophenylmethyleneamino)-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C17 H25 N2 O S -","- C17 H25 N2 O S -","- C68 H100 N8 O4 S4 -","4","1","OA0021","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds","Acta Crystallographica Section B","1999","55","6","1057","1067","10.1107/S0108768199007326","","","0.71073","MoKα","","0.0609","0.0401","","","","0.1217","","","","","","1.015","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105628","12.425","0.005","11.598","0.004","11.038","0.005","90","","109.53","0.04","90","","1499.1","1.1","297","","297","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3-Py-TEMPO","4-(3-pyridylmethyleneamino)-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C15 H22 N3 O -","- C15 H22 N3 O -","- C60 H88 N12 O4 -","4","1","OA0021","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds","Acta Crystallographica Section B","1999","55","6","1057","1067","10.1107/S0108768199007326","","","0.71073","MoKα","","0.0955","0.0488","","","","0.1347","","","","","","0.981","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105629","12.49","0.003","11.597","0.005","11.28","0.006","90","","97.12","0.03","90","","1621.3","1.2","294","","294","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-Me-Ph-TEMPO","4-(4-methylphenylmethyleneamino)-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C17 H25 N2 O -","- C17 H25 N2 O -","- C68 H100 N8 O4 -","4","1","OA0021","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds","Acta Crystallographica Section B","1999","55","6","1057","1067","10.1107/S0108768199007326","","","0.71073","MoKα","","0.0745","0.0496","","","","0.1617","","","","","","1.036","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105630","12.4422","0.0019","11.495","0.003","11.094","0.002","90","","97.381","0.013","90","","1573.6","0.6","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","4-Me-Ph-TEMPO","4-(4-methylphenylmethyleneamino)-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C17 H25 N2 O -","- C17 H25 N2 O -","- C68 H100 N8 O4 -","4","1","OA0021","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds","Acta Crystallographica Section B","1999","55","6","1057","1067","10.1107/S0108768199007326","","","0.71073","MoKα","","0.0689","0.0551","","","","0.1653","","","","","","1.13","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105631","20.0837","0.0019","5.6969","0.0007","15.106","0.002","90","","90","","90","","1728.4","0.4","295","","295","","","","","","","","","4","P n a 21","P 2c -2n","33","Naph-TEMPO","4-(2-naphthylmethyleneamino)-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C20 H25 N2 O -","- C20 H25 N2 O -","- C80 H100 N8 O4 -","4","1","OA0021","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds","Acta Crystallographica Section B","1999","55","6","1057","1067","10.1107/S0108768199007326","","","0.71073","MoKα","","0.0772","0.0433","","","","0.1101","","","","","","1.072","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105632","30.565","0.009","5.993","0.002","22.032","0.005","90","","90","","90","","4036","2","297","","297","","","","","","","","","4","P c a 21","P 2c -2ac","29","PhO-Ph-TEMPO","4-(4-phenoxyphenylmethyleneamino)-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C22 H27 N2 O2 -","- C22 H27 N2 O2 -","- C176 H216 N16 O16 -","8","2","OA0021","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds","Acta Crystallographica Section B","1999","55","6","1057","1067","10.1107/S0108768199007326","","","0.71073","MoKα","","0.155","0.0588","","","","0.1242","","","","","","0.966","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105633","11.1835","0.0018","15.487","0.002","11.566","0.0018","90","","114.539","0.011","90","","1822.3","0.5","294","","294","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","4-MeSO2-Ph-TEMPO","4-(4-mesylphenylmethyleneamino)-2,2,6,6-tetramethylpiperidin-1-oxyl","","- C17 H25 N2 O3 S -","- C17 H25 N2 O3 S -","- C68 H100 N8 O12 S4 -","4","1","OA0021","Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi","TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds","Acta Crystallographica Section B","1999","55","6","1057","1067","10.1107/S0108768199007326","","","0.71073","MoKα","","0.0581","0.0409","","","","0.1235","","","","","","1.007","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105634","12.3717","0.0007","5.6744","0.0003","7.4805","0.0004","90","","107.816","0.002","90","","499.96","0.05","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Pentathulium dirhenium dodecaoxide","","- O12 Re2 Tm5 -","- O12 Re2 Tm5 -","- O24 Re4 Tm10 -","2","0.25","OS0018","Ehrenberg, H.; Hartmann, T.; Wltschek, G.; Fuess, H.; Morgenroth, W.; Krane, H.-G.","The crystal structure of Tm~5~Re~2~O~12~","Acta Crystallographica Section B","1999","55","6","849","852","10.1107/S0108768199005194","","","0.4275","synchrotron","","0.0849","0.0682","","","","0.1518","","","","","","1.246","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105635","5.985","0.003","9.291","0.005","10.931","0.006","90","","100.32","0.03","90","","598","0.6","295","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Cl2 H8 Ni O4 -","- Cl2 H8 Ni O4 -","- Cl8 H32 Ni4 O16 -","4","1","OS0021","Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.","Charge density in NiCl~2~.4H~2~O at 295 and 30K","Acta Crystallographica Section B","1999","55","6","830","840","10.1107/S0108768199005741","","","0.71073","MoKα","","","0.0284","","","0.0341","","","","","","","1.312","","","","has coordinates","206183","2020-10-21","18:00:00",""
"2105636","6.006","0.003","9.338","0.005","10.986","0.005","90","","100.45","0.03","90","","605.9","0.5","295","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Cl2 H8 Ni O4 -","- Cl2 H8 Ni O4 -","- Cl8 H32 Ni4 O16 -","4","1","OS0021","Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.","Charge density in NiCl~2~.4H~2~O at 295 and 30K","Acta Crystallographica Section B","1999","55","6","830","840","10.1107/S0108768199005741","","neutron","0.8405","neutron","","","0.18","","","0.17","","","","","","","2.34","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105637","5.961","0.003","9.273","0.005","10.891","0.007","90","","100.02","0.05","90","","592.8","0.6","30","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Cl2 H8 Ni O4 -","- Cl2 H8 Ni O4 -","- Cl8 H32 Ni4 O16 -","4","1","OS0021","Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.","Charge density in NiCl~2~.4H~2~O at 295 and 30K","Acta Crystallographica Section B","1999","55","6","830","840","10.1107/S0108768199005741","","","0.71073","MoKα","","","0.0215","","","0.0327","","","","","","","1.421","","","","has coordinates","206183","2020-10-21","18:00:00",""
"2105638","5.968","0.002","9.283","0.003","10.897","0.003","90","","100.08","0.02","90","","594.4","0.3","30","1","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- Cl2 H8 Ni O4 -","- Cl2 H8 Ni O4 -","- Cl8 H32 Ni4 O16 -","4","1","OS0021","Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.","Charge density in NiCl~2~.4H~2~O at 295 and 30K","Acta Crystallographica Section B","1999","55","6","830","840","10.1107/S0108768199005741","","neutron","0.8405","neutron","","","0.126","","","0.142","","","","","","","2.99","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105639","8.5313","0.0002","11.4382","0.0002","13.307","0.0001","90","","90.038","0.001","90","","1298.53","0.04","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dimethylammonium tetrachlorocobaltate(II)","","- C4 H16 Cl4 Co N2 -","- C4 H16 Cl4 Co N2 -","- C16 H64 Cl16 Co4 N8 -","4","1","OS0024","Mahmoudkhani, Amir H.; Langer, Vratislav","Structure of [(CH~3~)~2~NH~2~]~2~CoCl~4~ at elevated temperatures","Acta Crystallographica Section B","1999","55","5","752","757","10.1107/S0108768199004012","","","0.71073","MoKα","","0.053","0.0336","","","","0.0816","","","","","","1.003","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105640","8.5513","0.0005","11.4527","0.0007","13.3364","0.0008","90","","90.01","0.001","90","","1306.11","0.14","320","2","320","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dimethylammonium tetrachlorocobaltate(II)","","- C4 H16 Cl4 Co N2 -","- C4 H16 Cl4 Co N2 -","- C16 H64 Cl16 Co4 N8 -","4","1","OS0024","Mahmoudkhani, Amir H.; Langer, Vratislav","Structure of [(CH~3~)~2~NH~2~]~2~CoCl~4~ at elevated temperatures","Acta Crystallographica Section B","1999","55","5","752","757","10.1107/S0108768199004012","","","0.71073","MoKα","","0.0617","0.0341","","","","0.0841","","","","","","0.989","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105641","8.564","0.0002","11.4573","0.0003","13.359","0.0003","90","","90.037","0.001","90","","1310.79","0.05","343","2","343","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dimethylammonium tetrachlorocobaltate(II)","","- C4 H16 Cl4 Co N2 -","- C4 H16 Cl4 Co N2 -","- C16 H64 Cl16 Co4 N8 -","4","1","OS0024","Mahmoudkhani, Amir H.; Langer, Vratislav","Structure of [(CH~3~)~2~NH~2~]~2~CoCl~4~ at elevated temperatures","Acta Crystallographica Section B","1999","55","5","752","757","10.1107/S0108768199004012","","","0.71073","MoKα","","0.0677","0.0357","","","","0.0846","","","","","","0.998","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105642","8.5775","0.0005","11.4679","0.0006","13.3855","0.0006","90","","90.021","0.001","90","","1316.68","0.12","366","2","366","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Dimethylammonium Tetrachlorocobaltate(II)","","- C4 H16 Cl4 Co N2 -","- C4 H16 Cl4 Co N2 -","- C16 H64 Cl16 Co4 N8 -","4","1","OS0024","Mahmoudkhani, Amir H.; Langer, Vratislav","Structure of [(CH~3~)~2~NH~2~]~2~CoCl~4~ at elevated temperatures","Acta Crystallographica Section B","1999","55","5","752","757","10.1107/S0108768199004012","","","0.71073","MoKα","","0.0653","0.0371","","","","0.0922","","","","","","1.006","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105643","13.218","0.001","6.65","0.0009","10.761","0.001","90","0.003","90","0.003","90","0.003","945.89","0.17","9.6","0.3","9.6","0.3","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- As O5 Rb Ti -","- As O5 Rb Ti -","- As8 O40 Rb8 Ti8 -","8","2","OS0025","Almgren, Jenni; Streltsov, Victor A.; Sobolev, Alexander N.; Figgis, Brian N.; Albertsson, Jörgen","Structure of and electron density in RbTiOAsO~4~ at 9.6K","Acta Crystallographica Section B","1999","55","5","712","720","10.1107/S010876819900395X","","","0.71069","MoKα","","0.034","0.032","","0.026","0.026","","","","4.596","","","4.56","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105644","13.261","0.002","6.6791","0.0008","10.769","0.001","90","0.01","90","0.01","90","0.01","953.8","0.2","295","2","295","1","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- As O5 Rb Ti -","- As O5 Rb Ti -","- As8 O40 Rb8 Ti8 -","8","2","OS0025","Almgren, Jenni; Streltsov, Victor A.; Sobolev, Alexander N.; Figgis, Brian N.; Albertsson, Jörgen","Structure of and electron density in RbTiOAsO~4~ at 9.6K","Acta Crystallographica Section B","1999","55","5","712","720","10.1107/S010876819900395X","","","0.71069","MoKα","","0.064","0.055","","0.043","0.042","","","","4.763","","","4.845","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105645","7.275","0.002","9.097","0.003","10.507","0.003","90","","90","","90","","695.4","0.4","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Glycyl-L-serine","","- C5 H10 N2 O4 -","- C5 H10 N2 O4 -","- C20 H40 N8 O16 -","4","1","OS0029","Görbitz, Carl Henrik","What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal","Acta Crystallographica Section B","1999","55","6","1090","1098","10.1107/S0108768199008721","","","0.71073","MoKα","","0.0471","0.0425","","","","0.1194","","","","","","1.133","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105646","7.275","0.002","9.097","0.003","10.507","0.003","90","","90","","90","","695.4","0.4","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Glycyl-L-serine","","- C5 H10 N2 O4 -","- C5 H10 N2 O4 -","- C20 H40 N8 O16 -","4","1","OS0029","Görbitz, Carl Henrik","What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal","Acta Crystallographica Section B","1999","55","6","1090","1098","10.1107/S0108768199008721","","","0.71073","MoKα","","0.0364","0.0315","","","","0.0848","","","","","","1.19","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105647","7.275","0.002","9.097","0.003","10.507","0.003","90","","90","","90","","695.4","0.4","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Glycyl-L-serine","","- C5 H10 N2 O4 -","- C5 H10 N2 O4 -","- C20 H40 N8 O16 -","4","1","OS0029","Görbitz, Carl Henrik","What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal","Acta Crystallographica Section B","1999","55","6","1090","1098","10.1107/S0108768199008721","","","0.71073","MoKα","","0.087","0.0618","","","","0.1446","","","","","","1.31","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105648","7.275","0.002","9.097","0.003","10.507","0.003","90","","90","","90","","695.4","0.4","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Glycyl-L-serine","","- C5 H10 N2 O4 -","- C5 H10 N2 O4 -","- C20 H40 N8 O16 -","4","1","OS0029","Görbitz, Carl Henrik","What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal","Acta Crystallographica Section B","1999","55","6","1090","1098","10.1107/S0108768199008721","","","0.71073","MoKα","","0.0487","0.035","","","","0.0878","","","","","","1.069","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105649","7.275","0.002","9.097","0.003","10.507","0.003","90","","90","","90","","695.4","0.4","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Glycyl-L-serine","","- C5 H10 N2 O4 -","- C5 H10 N2 O4 -","- C20 H40 N8 O16 -","4","1","OS0029","Görbitz, Carl Henrik","What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal","Acta Crystallographica Section B","1999","55","6","1090","1098","10.1107/S0108768199008721","","","0.71073","MoKα","","0.0798","0.0533","","","","0.115","","","","","","1.212","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105650","7.275","0.002","9.097","0.003","10.507","0.003","90","","90","","90","","695.4","0.4","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Glycyl-L-serine","","- C5 H10 N2 O4 -","- C5 H10 N2 O4 -","- C20 H40 N8 O16 -","4","1","OS0029","Görbitz, Carl Henrik","What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal","Acta Crystallographica Section B","1999","55","6","1090","1098","10.1107/S0108768199008721","","","0.71073","MoKα","","0.0802","0.0539","","","","0.1184","","","","","","1.213","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105651","7.275","0.002","9.097","0.003","10.507","0.003","90","","90","","90","","695.4","0.4","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Glycyl-L-serine","","- C5 H10 N2 O4 -","- C5 H10 N2 O4 -","- C20 H40 N8 O16 -","4","1","OS0029","Görbitz, Carl Henrik","What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal","Acta Crystallographica Section B","1999","55","6","1090","1098","10.1107/S0108768199008721","","","0.71073","MoKα","","0.0328","0.0277","","","","0.0736","","","","","","1.161","","","","has coordinates","301802","2025-08-19","10:18:51",""
"2105669","11.306","0.001","10.025","0.001","9.254","0.001","90","","90","","90","","1048.87","0.18","293","","","","","","","","","","","4","Cmca(00\g)s00","","","","","","- Eu0.976 Mo7.1 O14 V1.13 -","- Eu0.976 Mo7.1 O14 V1.132 -","- Eu3.904 Mo28.4 O56 V4.528 -","4","","LC0010","Leligny, H.; Grebille, D.; Roussel, P.; Labbé, Ph.; Hervieu, M.; Raveau, B.; Tortelier, J.; Gougeon, P.","Cluster configurations in modulated EuV~<i>x~</i>Mo~8{±~<i>y</i>}O~14~ crystals","Acta Crystallographica Section B","1999","55","4","467","483","10.1107/S0108768199000452","","","0.71073","MoKα","","","0.0411","","","0.0481","","","","","","","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"2105670","11.325","0.001","10.024","0.001","9.24","0.001","90","","90","","90","","1048.94","0.18","293","","","","","","","","","","","4","Cmca(00\g)s00","","","","","","- Eu0.986 Mo7.3 O14 V1.1 -","- Eu0.986 Mo7.3 O14 V1.096 -","- Eu3.944 Mo29.2 O56 V4.384 -","4","","LC0010","Leligny, H.; Grebille, D.; Roussel, P.; Labbé, Ph.; Hervieu, M.; Raveau, B.; Tortelier, J.; Gougeon, P.","Cluster configurations in modulated EuV~<i>x~</i>Mo~8{±~<i>y</i>}O~14~ crystals","Acta Crystallographica Section B","1999","55","4","467","483","10.1107/S0108768199000452","","","0.71073","MoKα","","","0.0411","","","0.0449","","","","","","","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"2105671","11.315","0.001","10.035","0.001","9.265","0.001","90","","90","","90","","1052","0.18","293","","","","","","","","","","","3","Cmca(00\g)s00","","","","","","- Eu Mo7.96 O14 -","- Eu Mo7.956 O14 -","- Eu4 Mo31.824 O56 -","4","","LC0010","Leligny, H.; Grebille, D.; Roussel, P.; Labbé, Ph.; Hervieu, M.; Raveau, B.; Tortelier, J.; Gougeon, P.","Cluster configurations in modulated EuV~<i>x~</i>Mo~8{±~<i>y</i>}O~14~ crystals","Acta Crystallographica Section B","1999","55","4","467","483","10.1107/S0108768199000452","","","0.71073","MoKα","","","0.0478","","","0.0553","","","","","","","","","","","has coordinates","278158","2022-09-26","15:28:11",""
"2105672","9.9073","0.0003","9.9073","","9.8703","0.0004","90","","90","","90.642","0.004","968.75","0.05","293","","293","","","","","","","","","3","P m n 21","P 2ac -2","","","","","- Cu8 Ge S6 -","- Cu8 Ge S6 -","- Cu32 Ge4 S24 -","4","1","OH0067","Onoda, Mitsuko; Chen, Xue-An; Kato, Katsuo; Sato, Akira; Wada, Hiroaki","Structure refinement of Cu~8~GeS~6~ using X-ray diffraction data from a multiple-twinned crystal","Acta Crystallographica Section B","1999","55","5","721","725","10.1107/S0108768199004541","","","0.7093","MoKα","","","0.087","","","0.094","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105673","9.789","0.003","7.541","0.003","13.418","0.003","90","","90","","90","","990.5","0.5","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Cl4 Cs2 Hg -","- Cl4 Cs2 Hg -","- Cl16 Cs8 Hg4 -","4","0.5","SE0279","Bagautdinov, Bagautdin; Pilz, Katrin; Ludecke, Jens; van Smaalen, Sander","Modulated structures of Cs~2~HgCl~4~: the 5<i>a</i> superstructure at 185 K and the 3<i>c</i> superstructure at 176 K","Acta Crystallographica Section B","1999","55","6","886","895","10.1107/S0108768199008071","","","0.71073","multicolumn","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2105674","9.7729","0.0001","7.5276","0.0004","13.3727","0.0007","90","","90","","90","","983.78","0.07","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Cl4 Cs2 Hg -","- Cl4 Cs2 Hg -","- Cl16 Cs8 Hg4 -","4","0.5","SE0279","Bagautdinov, Bagautdin; Pilz, Katrin; Ludecke, Jens; van Smaalen, Sander","Modulated structures of Cs~2~HgCl~4~: the 5<i>a</i> superstructure at 185 K and the 3<i>c</i> superstructure at 176 K","Acta Crystallographica Section B","1999","55","6","886","895","10.1107/S0108768199008071","","","0.7","Synchrotron","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2105675","8.006","0.003","5.482","0.003","19.444","0.008","90","","110.46","0.03","90","","799.5","0.6","20","1","8.4","0.4","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C10 H10 O2 -","- C10 H10 O2 -","- C40 H40 O8 -","4","1","SH0126","Herbstein, Frank H.; Iversen, Bo Brummerstedt; Kapon, Moshe; Larsen, Finn Krebs; Madsen, Georg Kent Hellerup; Reisner, George M.","X-ray and neutron diffraction study of benzoylacetone in the temperature range 8–300 K: comparison with other <i>cis</i>-enol molecules","Acta Crystallographica Section B","1999","55","5","767","787","10.1107/S0108768199004279","","","0.5616","AgKα","","","0.0256","","","0.0231","","","","","0.9","0.9","","","","","has coordinates,has Fobs","281832","2023-03-13","07:49:04",""
"2105676","8.027","0.007","5.483","0.002","19.478","0.013","90","","110.42","0.05","90","","803.4","1","20","1","20","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C10 H10 O2 -","- C10 H10 O2 -","- C40 H40 O8 -","4","1","SH0126","Herbstein, Frank H.; Iversen, Bo Brummerstedt; Kapon, Moshe; Larsen, Finn Krebs; Madsen, Georg Kent Hellerup; Reisner, George M.","X-ray and neutron diffraction study of benzoylacetone in the temperature range 8–300 K: comparison with other <i>cis</i>-enol molecules","Acta Crystallographica Section B","1999","55","5","767","787","10.1107/S0108768199004279","","neutron","1.012","neutron","","","0.0516","","","0.05","","","","","2.25","2.25","","","","","has coordinates,has Fobs","281832","2023-03-13","07:50:12",""
"2105677","9.3882","0.0009","4.8452","0.0004","9.0119","0.0007","90","","94.33","0.005","90","","408.76","0.06","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","lithium chloroacetate","chloroacetic acid, lithium salt","","- C2 H2 Cl Li O2 -","- C2 Cl Li O2 -","- C8 Cl4 Li4 O8 -","4","1","HR0041","Ehrenberg, H.; Hasse, B.; Schwarz, K.; Epple, M.","Structure determination of lithium chloroacetate, lithium bromoacetate and lithium iodoacetate by powder diffraction","Acta Crystallographica Section B","1999","55","4","517","524","10.1107/S0108768199003614","","","1.2841","synchrotron","","","","","","","","","","2.24","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105678","9.7165","0.0011","4.861","0.0006","9.0228","0.0011","90","","93.946","0.005","90","","425.15","0.09","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","lithium bromoacetat","bromoacetic acid, lithium salt","","- C2 H2 Br Li O2 -","- C2 Br Li O2 -","- C8 Br4 Li4 O8 -","4","1","HR0041","Ehrenberg, H.; Hasse, B.; Schwarz, K.; Epple, M.","Structure determination of lithium chloroacetate, lithium bromoacetate and lithium iodoacetate by powder diffraction","Acta Crystallographica Section B","1999","55","4","517","524","10.1107/S0108768199003614","","","1.2841","synchrotron","","","","","","","","","","2.24","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2105679","10.1812","0.001","4.8922","0.0008","9.0468","0.001","90","","93.251","0.005","90","","449.88","0.1","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","lithium iodoacetate","iodoacetic acid, lithium salt","","- C2 H2 I Li O2 -","- C2 I Li O2 -","- C8 I4 Li4 O8 -","4","1","HR0041","Ehrenberg, H.; Hasse, B.; Schwarz, K.; Epple, M.","Structure determination of lithium chloroacetate, lithium bromoacetate and lithium iodoacetate by powder diffraction","Acta Crystallographica Section B","1999","55","4","517","524","10.1107/S0108768199003614","","","1.2006","synchrotron","","","","","","","","","","2.03","","","","","","","has coordinates","190398","2020-10-21","18:00:00",""
"2105681","5.15463","0.00005","5.15463","0.00005","5.15463","0.00005","90","","90","","90","","136.96","0.002","293","","293","","","","","","","","","3","F m -3 m","-F 4 2 3","225","Yttria-stabilized cubic zirconia","Yttrium Zirconium Oxide","","- O1.879 Y0.242 Zr0.758 -","- O14 Y Zr8 -","- O56 Y4 Zr32 -","4","0.0208333","OH0066","Ishizawa, N.; Matsushima, Y.; Hayashi, M.; Ueki, M.","Synchrotron radiation study of yttria-stabilized zirconia, Zr~0.758~Y~0.242~O~1.879~","Acta Crystallographica Section B","1999","55","5","726","735","10.1107/S0108768199005108","","","0.7502","Synchrotronradiations","","0.005","0.005","","0.009","0.009","","","","6.184","6.184","6.184","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105682","5.15463","0.00005","5.15463","0.00005","5.15463","0.00005","90","","90","","90","","136.96","0.002","293","","293","","","","","","","","","3","F m -3 m","-F 4 2 3","225","Yttria-stabilized cubic zirconia","Yttrium Zirconium Oxide","","- O1.879 Y0.242 Zr0.758 -","- O14 Y Zr8 -","- O56 Y4 Zr32 -","4","0.0208333","OH0066","Ishizawa, N.; Matsushima, Y.; Hayashi, M.; Ueki, M.","Synchrotron radiation study of yttria-stabilized zirconia, Zr~0.758~Y~0.242~O~1.879~","Acta Crystallographica Section B","1999","55","5","726","735","10.1107/S0108768199005108","","","0.7281","Synchrotronradiation","","0.009","0.009","","0.013","0.013","","","","5.876","5.876","5.876","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2107334","5.15463","","5.15463","","5.15463","","90","","90","","90","","136.96","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Zr0.758 Y0.242 O1.879","","- O1.7096 Y0.242 Zr0.7576 -","- O1.7096 Y0.242 Zr0.7576 -","- O6.8384 Y0.968 Zr3.0304 -","4","0.0208333","","Ishizawa, N.; Hayashi, M.; Matsushima, Y.; Ueki, M.","Synchrotron radiation study of yttria-stabilized zirconia, Zr0.758 Y0.242 O1.879","Acta Crystallographica B (39,1983-)","1999","55","","726","735","","","","","","","","","","","","","","","","","","","","","","has coordinates","172770","2020-10-21","18:00:00",""
"2107359","17.779","","18.015","","3.9209","","90","","90","","90","","1255.82","","","","","","","","","","","","","4","C m 2 m","C -2 -2","38","","Pb3.65 K2.35 (Nb5 O15)","","- K2.35 Nb5 O15 Pb3.65 -","- K2.35 Nb5 O15 Pb3.65 -","- K9.4 Nb20 O60 Pb14.6 -","4","0.5","","Sciau, P.; Calvarin, G.; Ravez, J.","Structures des phases paraelectriques et ferroelectriques de Pb2 K Nb5 O15","Acta Crystallographica B (39,1983-)","1999","55","","459","466","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2107401","7.0445","","6.9661","","9.8699","","90","","90","","90","","484.343","","","","","","","","","","","","","3","P m n 21","P 2ac -2","31","","","","- Cu8 Ge S6 -","- Cu8 Ge S6 -","- Cu16 Ge2 S12 -","2","0.5","","Onoda, M.; Sato, A.; Chen, X.-A.; Wada, H.; Kato, K.","Structure refinement of Cu8 GeS 6 using x-ray diffraction data from a multiple-twinned crystal","Acta Crystallographica B (39,1983-)","1999","55","","721","725","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2311623","13.23","0.002","18.197","0.004","16.126","0.004","90","","108.65","0.02","90","","3678.4","1.4","297","","297","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H44 N8 O14 Ru S -","- C26 H24 N8 O14 Ru S -","- C104 H96 N32 O56 Ru4 S4 -","4","1","","Faham, S.; Day, M. W.; Connick, W. B.; Crane, B. R.; Di Bilio, A. J.; Schaefer, W. P.; Rees, D. C.; Gray, H. B.","Structures of ruthenium-modified Pseudomonas aeruginosa azurin and [Ru(2,2'-bipyridine)2(imidazole)2]SO4 x 10H2O.","Acta crystallographica. Section D, Biological crystallography","1999","55","Pt 2","379","385","10.1107/s0907444998010464","","","0.7107","MoKα","","0.0907","0.0907","","0.17","0.17","","","","3.53","3.53","3.53","","","","","has coordinates","246037","2020-10-21","18:00:00",""
"4001641","3.8127","0.0004","15.551","0.001","7.039","0.0005","90","","90","","90","","417.35","0.06","295","2","295","2","","","","","","","","3","C m c m","-C 2c 2","63","zirconium palladium silicide","","","- Pd3 Si3 Zr -","- Pd3 Si3 Zr -","- Pd12 Si12 Zr4 -","4","0.25","","Wang, Meitian; Mar, Arthur","The Ternary Silicide ZrPd3Si3, a Stacking Variant of the α-FeSi2and Re3B Structure Types","Chemistry of Materials","1999","11","11","3232","","10.1021/cm990296b","","","0.71073","MoKα","","0.0256","0.0227","","","0.046","0.047","","","","","","1.189","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001719","10.3388","","10.3388","","10.3388","","90","","90","","90","","1105.12","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Silver antimony oxide (0.63/2.5/6.1)","","- Ag0.63 O6.1 Sb2.5 -","- Ag0.63 O6.1 Sb2.5 -","- Ag5.04 O48.8 Sb20 -","8","0.0416667","","Zarbin, A.J.G.; Rojo, J.M.; Rojas, R.M.; Alves, O.L.; Amarilla, J.M.","Silver antimonates with pyrochlore-like structure prepared by thermal treatment of silver proton-exchanged antimonic acid: formation process and structural characterization","Chemistry of Materials (1,1989-)","1999","11","","1652","1658","","","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001721","5.51664","","5.51664","","7.8134","","90","","90","","90","","237.788","","","","","","","","","","","","","4","I b a m","-I 2 2c","72","","Bismuth silver titanate (0.5/0.5/1)","","- Ag0.456 Bi0.544 O3 Ti -","- Ag0.456 Bi0.544 O3 Ti -","- Ag1.824 Bi2.176 O12 Ti4 -","4","0.25","","Woodward, P.M.; Park, J.-H.; Parise, J.B.; Stafsudd, O.; Reeder, R.J.; Lubomirsky, I.","Synthesis, structure, and dielectric properties of (Bi0.5 Ag0.5) Ti O3","Chemistry of Materials (1,1989-)","1999","11","","177","183","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001722","5.47309","","5.5098","","7.7563","","90","","90","","90","","233.896","","","","","","","","","","","","","4","I b a m","-I 2 2c","72","","Bismuth silver titanate (0.5/0.5/1)","","- Ag0.5 Bi0.5 O3 Ti -","- Ag0.5 Bi0.5 O3 Ti -","- Ag2 Bi2 O12 Ti4 -","4","0.25","","Park, J.-H.; Lubomirsky, I.; Reeder, R.J.; Parise, J.B.; Stafsudd, O.; Woodward, P.M.","Synthesis, structure, and dielectric properties of (Bi0.5 Ag0.5) Ti O3","Chemistry of Materials (1,1989-)","1999","11","","177","183","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001723","3.90607","","3.90607","","3.90607","","90","","90","","90","","59.596","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Bismuth silver titanate (0.5/0.5/1)","","- Ag0.5 Bi0.5 O3 Ti -","- Ag0.5 Bi0.5 O3 Ti -","- Ag0.5 Bi0.5 O3 Ti -","1","0.0208333","","Park, J.-H.; Parise, J.B.; Reeder, R.J.; Stafsudd, O.; Woodward, P.M.; Lubomirsky, I.","Synthesis, structure, and dielectric properties of (Bi0.5 Ag0.5) Ti O3","Chemistry of Materials (1,1989-)","1999","11","","177","183","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001725","10.282","","10.282","","10.282","","90","","90","","90","","1087.01","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","(Ag1.77 Sb0.07) (Sb2 O6)","","- Ag1.77 O6 Sb2.07 -","- Ag1.77 O6 Sb2.07 -","- Ag14.16 O48 Sb16.56 -","8","0.0416667","","Rojo, J.M.; Zarbin, A.J.G.; Alves, O.L.; Amarilla, J.M.; Rojas, R.M.","Silver antimonates with pyrochlore-like structure prepared by thermal treatment of silver proton-exchanged antimonic acid: formation process and structural characterization","Chemistry of Materials (1,1989-)","1999","11","","1652","1658","","","","","","","","","","","","","","","","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4001741","6.6357","","6.6357","","26.706","","90","","90","","120","","1018.39","","","","","","","","","","","","","3","R 3 2 :H","R 3 2""","155","","Gd (B O3)","","- B Gd O3 -","- B Gd O3 -","- B18 Gd18 O54 -","18","1","","Ren, M.; Su, M.Z.; Dong, Y.; You, L.P.; Yang, L.Q.; Lin, J.-H.","Structure and phase transformation of Gd B O3","Chemistry of Materials (1,1989-)","1999","11","","1576","1580","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001742","4.1154","","4.1154","","8.592","","90","","90","","120","","126.023","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Gd (B O3)","","- B Gd O3 -","- B Gd O3 -","- B2 Gd2 O6 -","2","0.0833333","","Dong, Y.; Yang, L.Q.; Su, M.Z.; Ren, M.; Lin, J.-H.; You, L.P.","Structure and phase transformation of Gd B O3","Chemistry of Materials (1,1989-)","1999","11","","1576","1580","","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001894","17.51709","0.0009","17.51709","0.0009","8.198","0.0005","90","","90","","90","","2515.5","0.2","","","","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","Lithium Manganese(III) Manganese(IV) Oxide","","- Li Mn2 O4 -","- Li Mn2 O4 -","- Li36 Mn72 O144 -","36","1.125","","Wills, A. S.; Raju, N. P.; Greedan, J. E.","Low-temperature structure and magnetic properties of the spinel LiMn~2~O~4~: a frustrated antiferromagnet and cathode material","Chemistry of Materials","1999","11","6","1510","1518","10.1021/cm981041l","","","","","","0.094","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4001895","17.54019","0.0005","17.54019","0.0005","8.20515","0.00028","90","","90","","90","","2524.38","0.13","","","","","","","","","","","","3","I 41/a m d :2","-I 4bd 2","141","","Lithium Manganese(III) Manganese(IV) Oxide","","- Li Mn2 O4 -","- Li Mn2 O4 -","- Li36 Mn72 O144 -","36","1.125","","Wills, A. S.; Raju, N. P.; Greedan, J. E.","Low-temperature structure and magnetic properties of the spinel LiMn~2~O~4~: a frustrated antiferromagnet and cathode material","Chemistry of Materials","1999","11","6","1510","1518","10.1021/cm981041l","","","","","","0.072","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4002827","8.2706","0.0003","6.1998","0.0003","10.525","0.001","90","","103.38","0.01","90","","525.03","0.06","","","293","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C5 H6 Al3 F10 N -","- C4.998 H6 Al3 F10 N1.002 -","- C9.996 H12 Al6 F20 N2.004 -","2","0.25","","Harlow, Richard L.; Herron, Norman; Li, Zhigang; Vogt, Thomas; Solovyov, Leonid; Kirik, Sergei","The DuPont Powder Challenge: the crystal structure of [C5NH6][Al3F10] - A cautionary tale","Chemistry of Materials","1999","11","","2562","2567","","powder diffraction","x-ray","0.43788","","","","","","","","","","0.048","","","","","","","","has coordinates","198511","2020-10-21","18:00:00",""
"4027821","4.559","","10.764","","7.552","","90","","90","","90","","370.6","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Yb Au In2","","- Au In2 Yb -","- Au In2 Yb -","- Au4 In8 Yb4 -","4","0.25","","Kotzyba, G.; Poettgen, R.; Hoffmann, R.D.; Galadzhun, Ya.V.; Kuennen, B.","EuPdIn2, YbPdIn2, and YbAuIn2: Syntheses, Structures and Properties of New Intermetallic Compounds with Ordered Re3B Type Structure","European Journal of Inorganic Chemistry","1999","1999","","975","979","10.1002/(SICI)1099-0682(199906)1999:6<975::AID-EJIC975>3.0.CO;2-6","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4031160","4.01395","","4.01395","","9.5423","","90","","90","","120","","133.146","","","","","","","","","","","","","4","P -3","-P 3","147","","Bi2.34 U0.33 La0.33 O5","","- Bi2.34 La0.33 O5 U0.33 -","- Bi2.333 La0.334 O5.04 U0.333 -","- Bi2.333 La0.334 O5.04 U0.333 -","1","0.166667","","Amarilla, J.M.; Alonso, J.A.; Rojas, R.M.","Structural study of the trigonal Bi2.34 U0.33 La0.33 O5 oxide ion conductor: Rietveld refinement of X-ray and neutron powder diffraction data","Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-)","1999","1999","","1137","1141","","","","","","","","","","","","","","","","","","","","","","has coordinates","140321","2020-10-21","18:00:00",""
"4031163","23.642","","19.577","","6.958","","90","","90","","90","","3220.44","","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","K3 Cu11 ((Te2)5 (Te3)2)","","- Cu11 K3 Te16 -","- Cu11 K3 Te16 -","- Cu44 K12 Te64 -","4","0.25","","Emirdag, M.; Schimek, G.L.; Kolis, J.W.","Synthesis and characterisation of K3 Cu11 Te16 from supercritical ethylenediamine","Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-)","1999","1999","","1531","1532","","","","","","","","","","","","","","","","","","","","","","has coordinates","140587","2020-10-21","18:00:00",""
"4031164","8.9912","","11.6988","","17.246","","90","","90","","90","","1814.04","","","","","","","","","","","","","3","P c c n","-P 2ab 2ac","56","","Co4 (C O)12","","- C12 Co4 O12 -","- C12 Co4.01 O12 -","- C48 Co16.04 O48 -","4","0.5","","Farrugia, L.J.; Braga, D.; Grepioni, F.","A structural redetermination of Co4 (C O)12: evidence for dynamic disorder and the pathway of metal atom migration in the crystalline phase","Journal of Organometallic Chemistry","1999","573","","60","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","140596","2020-10-21","18:00:00",""
"4031166","16.4719","","7.486","","16.427","","90","","90","","90","","2025.59","","","","","","","","","","","","","6","P n a 21","P 2c -2n","33","","((Ru (C O)3)2 Cl H (Ir (C O)3)2)","","- C12 H Cl Ir2 O12 Ru2 -","- C12 Cl Ir2 O12 Ru2 -","- C48 Cl4 Ir8 O48 Ru8 -","4","1","","Harkonen, A.U.; Ahlgren, M.; Pakkanen, T.A.; Pursiainen, J.","Reaction of ruthenium carbonyl chloride with iridium tetracarbonyl anion. Synthesis, crystal structure and characterisation of (Ru2 Ir2 H (C O)12 Cl): a heterometallic tetranuclear butterfly cluster with chloride bridge","Journal of Organometallic Chemistry","1999","573","","225","231","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031174","7.1729","","7.9827","","8.871","","110.643","","98.101","","104.97","","443.824","","","","","","","","","","","","","4","P -1","-P 1","2","","Ce (H2 P O2)3 (H2 O)","","- Ce H8 O7 P3 -","- Ce H8 O7 P3 -","- Ce2 H16 O14 P6 -","2","1","","Seddon, J.A.; Jackson, A.R.W.; Kresinski, R.A.; Platt, A.W.G.","Complexes of the lanthanide metals (La - Nd, Sm - Lu) with hypophosphite and phosphite ligands: crystal structures of [Ce (H2 P O2)3 (H2 O)], [Dy (H2 P O2)3] and [Pr (H2 P O2) (H P O3) (H2 O)] . (H2 O)","Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-)","1999","1999","","2189","2196","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031175","14.368","","5.734","","12.123","","90","","122.33","","90","","843.94","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Dy (H2 P O2)3","","- Dy H6 O6 P3 -","- Dy H6 O6 P3 -","- Dy4 H24 O24 P12 -","4","0.5","","Seddon, J.A.; Platt, A.W.G.; Kresinski, R.A.; Jackson, A.R.W.","Complexes of the lanthanide metals (La - Nd, Sm - Lu) with hypophosphite and phosphite ligands: crystal structures of (Ce (H2 P O2)3 (H2 O)), (Dy (H2 P O2)3) and (Pr (H2 P O2) (H P O3) (H2 O)) . (H2 O)","Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-)","1999","1999","","2189","2196","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031176","6.6558","","7.1539","","16.5506","","90","","90","","90","","788.056","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(Pr (H2 P O2) (H P O3) (H2 O)) (H2 O)","","- H7 O7 P2 Pr -","- H7 O7 P2 Pr -","- H28 O28 P8 Pr4 -","4","1","","Seddon, J.A.; Platt, A.W.G.; Jackson, A.R.W.; Kresinski, R.A.","Complexes of the lanthanide metals (La - Nd, Sm - Lu) with hypophosphite and phosphite ligands: crystal structures of (Ce (H2 P O2)3 (H2 O)), (Dy (H2 P O2)3) and (Pr (H2 P O2) (H P O3) (H2 O)) . (H2 O)","Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-)","1999","1999","","2189","2196","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4063211","16.8228","0.0012","16.2206","0.0011","19.6787","0.0015","90","","107.566","0.007","90","","5119.4","0.7","100","","100","","","","","","","","see text","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H76 Li4 N4 Si4 -","- C48 H76 Li4 N4 Si4 -","- C192 H304 Li16 N16 Si16 -","4","0.5","","Arjan W. Kleij; Henk Kleijn; Johann T. B. H. Jastrzebski; Wilberth J. J. Smeets; Anthony L. Spek; Gerard van Koten","Dendritic Carbosilanes Containing Silicon-Bonded 1-[C6H2(CH2NMe2)2-3,5-Li-4] or 1-[C6H3(CH2NMe2)-4-Li-3] Mono- and Bis(amino)aryllithium End Groups: Structure of {[CH2SiMe2C6H3(CH2NMe2)-4-Li-3]2}2","Organometallics","1999","18","","268","276","10.1021/om980627e","","","0.71073","MoKα","","0.1953","0.0754","","","0.0887","0.1121","","","","","","0.892","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063216","46.3269","0.0006","17.0101","0.0003","20.4152","0.0001","90","","112.334","0.001","90","","14880.9","0.3","193","2","193","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Pt(dippe)(neopentyl)(SH)","","","- C35 H68 O P2 Pt S -","- C35 H68 O P2 Pt S -","- C560 H1088 O16 P32 Pt16 S16 -","16","2","","Michael S. Morton; Rene J. Lachicotte; David A. Vicic; William D. Jones","Insertion of Elemental Sulfur and SO2 into the Metal-Hydride and Metal-Carbon Bonds of Platinum Compounds","Organometallics","1999","18","","227","234","10.1021/om980772s","","","0.71073","MoKα","","0.0466","0.0332","","0.0739","0.0694","","","","1.037","1.081","1.081","","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063217","10.7275","0.0002","22.1317","0.0004","15.3769","0.0002","90","","102.33","0.001","90","","3566.54","0.1","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Pt(dippe)(Ph)(SH)","","","- C35 H60 O P2 Pt S -","- C35 H54 O P2 Pt S -","- C140 H216 O4 P8 Pt4 S4 -","4","1","","Michael S. Morton; Rene J. Lachicotte; David A. Vicic; William D. Jones","Insertion of Elemental Sulfur and SO2 into the Metal-Hydride and Metal-Carbon Bonds of Platinum Compounds","Organometallics","1999","18","","227","234","10.1021/om980772s","","","0.71073","MoKα","","0.0765","0.0546","","0.0878","0.0821","","","","1.178","1.23","1.23","","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063218","18.4637","0.0002","10.6432","0.0001","17.2377","0.0001","90","","90","","90","","3387.43","0.05","193","2","193","2","","","","","","","","7","P c a 21","P 2c -2ac","29","Pt(dippe)(SO2Me)(Me)","","","- C29 H56 Cl2 O2 P2 Pt S -","- C29 H56 Cl2 O2 P2 Pt S -","- C116 H224 Cl8 O8 P8 Pt4 S4 -","4","1","","Michael S. Morton; Rene J. Lachicotte; David A. Vicic; William D. Jones","Insertion of Elemental Sulfur and SO2 into the Metal-Hydride and Metal-Carbon Bonds of Platinum Compounds","Organometallics","1999","18","","227","234","10.1021/om980772s","","","0.71073","MoKα","","0.0886","0.0607","","0.0924","0.0845","","","","1.086","1.137","1.137","","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063220","12.9054","0.0012","17.315","0.002","32.573","0.003","90","","101.215","0.006","90","","7139.6","1.2","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C78.25 H66.5 Cl0.5 Ir2 O3 P6 Pt -","- C78.25 H66.5 Cl0.5 Ir2 O3 P6 Pt -","- C313 H266 Cl2 Ir8 O12 P24 Pt4 -","4","1","","Brian T. Sterenberg; Hilary A. Jenkins; Richard J. Puddephatt","Complexes with Platinum-Iridium Bonds: Stepwise Formation of a PtIr2 Cluster Complex","Organometallics","1999","18","","219","226","10.1021/om980665y","","","0.71073","MoKα","","0.2179","0.0692","","0.2144","0.133","","","","0.935","1.134","1.134","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4063221","20.1924","0.0003","44.8906","0.0014","23.3886","0.0008","90","","90","","90","","21200.6","1","294","2","294","2","","","","","","","","7","C c c a :2","-C 2a 2ac","68","","","","- C53 H44 F6 Ir O3.5 P5 Pt -","- C53 H44 F6 Ir O3.5 P5 Pt -","- C848 H704 F96 Ir16 O56 P80 Pt16 -","16","1","","Brian T. Sterenberg; Hilary A. Jenkins; Richard J. Puddephatt","Complexes with Platinum-Iridium Bonds: Stepwise Formation of a PtIr2 Cluster Complex","Organometallics","1999","18","","219","226","10.1021/om980665y","","","0.71073","MoKα","","0.0949","0.0414","","0.1328","0.0798","","","","1.011","1.218","1.218","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4063222","13.1864","0.0003","13.5273","0.0006","17.0829","0.0006","76.184","0.002","77.205","0.002","67.111","0.002","2697.7","0.2","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H46 Cl2 Ir2 O5 P4 Pt -","- C56 H46 Cl2 Ir2 O5 P4 Pt -","- C112 H92 Cl4 Ir4 O10 P8 Pt2 -","2","1","","Brian T. Sterenberg; Hilary A. Jenkins; Richard J. Puddephatt","Complexes with Platinum-Iridium Bonds: Stepwise Formation of a PtIr2 Cluster Complex","Organometallics","1999","18","","219","226","10.1021/om980665y","","","0.71073","MoKα","","0.0641","0.0335","","0.0763","0.0616","","","","0.998","0.997","0.997","","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063228","10.8636","0.0003","14.1074","0.0004","16.6979","0.0004","90","","100.142","0.001","90","","2519.09","0.12","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Cp*2Ir2(SC3H2Me2)","","","- C25 H38 Ir2 S -","- C25 H38 Ir2 S -","- C100 H152 Ir8 S4 -","4","1","","David A. Vicic; William D. Jones","Activation of Sulfur- and Nitrogen-Containing Heterocycles by a Dinuclear Iridium Complex","Organometallics","1999","18","","134","138","10.1021/om9808007","","","0.71073","MoKα","","0.0541","0.0448","","0.1163","0.1119","","","","1.081","1.128","1.128","","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4063229","16.4804","0.0003","15.3201","0.0003","9.8855","0.0001","90","","98.69","","90","","2467.23","0.07","223","2","223","2","","","","","","","","4","C 1 c 1","C -2yc","9","Cp*2Ir2H3(C4H3NMe)","","","- C25 H39 Ir2 N -","- C25 H36 Ir2 N -","- C100 H144 Ir8 N4 -","4","1","","David A. Vicic; William D. Jones","Activation of Sulfur- and Nitrogen-Containing Heterocycles by a Dinuclear Iridium Complex","Organometallics","1999","18","","134","138","10.1021/om9808007","","","0.71073","MoKα","","0.0501","0.041","","0.0985","0.0939","","","","0.974","1.007","1.007","","","","","has coordinates,has disorder","178527","2020-10-21","18:00:00",""
"4063230","8.4912","0.0005","14.1404","0.0008","10.301","0.0006","90","","104.93","0.001","90","","1195.08","0.12","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","Cp*2Ir2H(C4H3NMe)","","","- C25 H37 Ir2 N -","- C25 H37 Ir2 N -","- C50 H74 Ir4 N2 -","2","1","","David A. Vicic; William D. Jones","Activation of Sulfur- and Nitrogen-Containing Heterocycles by a Dinuclear Iridium Complex","Organometallics","1999","18","","134","138","10.1021/om9808007","","","0.71073","MoKα","","0.0456","0.0398","","0.092","0.0898","","","","1.011","1.096","1.096","","","","","has coordinates","178527","2020-10-21","18:00:00",""
"4077729","12.567","0.003","17.637","0.006","17.016","0.004","90","0.02","97.88","0.02","90","0.02","3735.9","1.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H37 F15 N2 Pd -","- C34 H37 F15 N2 Pd -","- C136 H148 F60 N8 Pd4 -","4","1","","Ruiz, José; Rodríguez, Venancio; López, Gregorio; Casabó, Jaume; Molins, Elies; Miravitlles, Carles","Reactivity of [{M(C6F5)2(μ-OH)}2]2-(M = Pd or Pt) toward Aromatic Amines and Malononitrile","Organometallics","1999","18","7","1177","","10.1021/om980508z","","","0.71069","MoKα","","0.1934","0.0642","","0.2425","0.1751","","","","1.048","1.234","1.234","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077730","10.652","0.004","22.162","0.007","30.109","0.01","74.74","0.03","80.27","0.03","89.91","0.03","6752","4","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C62 H74 F20 N6 Pd2 -","- C62 H74 F20 N6 Pd2 -","- C248 H296 F80 N24 Pd8 -","4","2","","Ruiz, José; Rodríguez, Venancio; López, Gregorio; Casabó, Jaume; Molins, Elies; Miravitlles, Carles","Reactivity of [{M(C6F5)2(μ-OH)}2]2-(M = Pd or Pt) toward Aromatic Amines and Malononitrile","Organometallics","1999","18","7","1177","","10.1021/om980508z","","","0.71069","MoKα","","0.1663","0.0529","","0.1851","0.1362","","","","1.042","1.101","1.101","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077731","12.5279","0.0009","6.7169","0.0005","15.4844","0.0012","90","","96.677","0.002","90","","1294.15","0.17","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 Cl N O2 Ti -","- C12 H16 Cl N O2 Ti -","- C48 H64 Cl4 N4 O8 Ti4 -","4","1","","Doherty, Simon; Errington, R. John; Housley, Neil; Ridland, John; Clegg, William; Elsegood, Mark R. J.","N-Alkoxy-β-ketoiminate Complexes of Groups 4 and 5: Synthesis and Characterization of the Complexes [(η5-C5H4R)M{CH3C(O)CHC(NCH2CHR‘O)CH3}Cln] (M = Ti,n= 1; M = Nb,n= 2; R = H, Me; R‘ = H, Me), [Ti{CH3C(O)CHC(NCH2CHR‘O)CH3}Cl2(thf)], and [Ti{CH3C(O)CHC(NCH2CHR‘O)CH3}2]","Organometallics","1999","18","6","1018","","10.1021/om980510q","","","0.71073","MoKα","","0.0655","0.0585","","","0.1504","0.1546","","","","","","1.062","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077732","8.7435","0.0005","11.6855","0.0008","14.3168","0.0009","90","","91.346","0.002","90","","1462.37","0.16","160","2","160","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C11 H19 Cl2 N O3 Ti -","- C11 H19 Cl2 N O3 Ti -","- C44 H76 Cl8 N4 O12 Ti4 -","4","1","","Doherty, Simon; Errington, R. John; Housley, Neil; Ridland, John; Clegg, William; Elsegood, Mark R. J.","N-Alkoxy-β-ketoiminate Complexes of Groups 4 and 5: Synthesis and Characterization of the Complexes [(η5-C5H4R)M{CH3C(O)CHC(NCH2CHR‘O)CH3}Cln] (M = Ti,n= 1; M = Nb,n= 2; R = H, Me; R‘ = H, Me), [Ti{CH3C(O)CHC(NCH2CHR‘O)CH3}Cl2(thf)], and [Ti{CH3C(O)CHC(NCH2CHR‘O)CH3}2]","Organometallics","1999","18","6","1018","","10.1021/om980510q","","","0.71073","MoKα","","0.0526","0.0383","","","0.0888","0.0954","","","","","","1.055","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077733","14.4022","0.0009","14.6208","0.0009","14.8973","0.0009","90","","90","","90","","3136.9","0.3","160","2","160","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H21 Cl2 N O3 Ti -","- C12 H21 Cl2 N O3 Ti -","- C96 H168 Cl16 N8 O24 Ti8 -","8","1","","Doherty, Simon; Errington, R. John; Housley, Neil; Ridland, John; Clegg, William; Elsegood, Mark R. J.","N-Alkoxy-β-ketoiminate Complexes of Groups 4 and 5: Synthesis and Characterization of the Complexes [(η5-C5H4R)M{CH3C(O)CHC(NCH2CHR‘O)CH3}Cln] (M = Ti,n= 1; M = Nb,n= 2; R = H, Me; R‘ = H, Me), [Ti{CH3C(O)CHC(NCH2CHR‘O)CH3}Cl2(thf)], and [Ti{CH3C(O)CHC(NCH2CHR‘O)CH3}2]","Organometallics","1999","18","6","1018","","10.1021/om980510q","","","0.71073","MoKα","","0.0641","0.0457","","","0.0949","0.1037","","","","","","1.07","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077734","7.995","0.003","11.264","0.005","11.58","0.005","79.44","0.03","72.29","0.019","74.96","0.02","953.2","0.7","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H24 Cl2 N2 O4 Ti -","- C15.001 H24 Cl2 N2 O4 Ti -","- C30.002 H48 Cl4 N4 O8 Ti2 -","2","1","","Doherty, Simon; Errington, R. John; Housley, Neil; Ridland, John; Clegg, William; Elsegood, Mark R. J.","N-Alkoxy-β-ketoiminate Complexes of Groups 4 and 5: Synthesis and Characterization of the Complexes [(η5-C5H4R)M{CH3C(O)CHC(NCH2CHR‘O)CH3}Cln] (M = Ti,n= 1; M = Nb,n= 2; R = H, Me; R‘ = H, Me), [Ti{CH3C(O)CHC(NCH2CHR‘O)CH3}Cl2(thf)], and [Ti{CH3C(O)CHC(NCH2CHR‘O)CH3}2]","Organometallics","1999","18","6","1018","","10.1021/om980510q","","","1.54184","CuKα","","0.0396","0.039","","","0.0965","0.0972","","","","","","1.039","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077735","7.8414","0.0005","13.0378","0.0008","14.4708","0.0009","104.134","0.002","94.292","0.002","98.097","0.002","1411.11","0.15","190","2","190","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H16 Cl2 N Nb O2 -","- C12 H16 Cl2 N Nb O2 -","- C48 H64 Cl8 N4 Nb4 O8 -","4","2","","Doherty, Simon; Errington, R. John; Housley, Neil; Ridland, John; Clegg, William; Elsegood, Mark R. J.","N-Alkoxy-β-ketoiminate Complexes of Groups 4 and 5: Synthesis and Characterization of the Complexes [(η5-C5H4R)M{CH3C(O)CHC(NCH2CHR‘O)CH3}Cln] (M = Ti,n= 1; M = Nb,n= 2; R = H, Me; R‘ = H, Me), [Ti{CH3C(O)CHC(NCH2CHR‘O)CH3}Cl2(thf)], and [Ti{CH3C(O)CHC(NCH2CHR‘O)CH3}2]","Organometallics","1999","18","6","1018","","10.1021/om980510q","","","0.71073","MoKα","","0.0303","0.0267","","","0.0688","0.0714","","","","","","1.073","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077736","6.147","0.001","43.404","0.009","8.187","0.002","90","","106.6","0.03","90","","2093.3","0.8","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 Fe O4 Os -","- C22 H24 Fe O4 Os -","- C88 H96 Fe4 O16 Os4 -","4","1","","Lindner, Ekkehard; Krebs, Ilmari; Fawzi, Riad; Steimann, Manfred; Speiser, Bernd","Synthesis, Structure, and Electrochemistry of Osmametallocenophanes with Different Ring Size†,1","Organometallics","1999","18","4","480","","10.1021/om980713e","","","0.71073","MoKα","","0.1604","0.0835","","0.6942","0.2228","","","","2.467","2.324","2.324","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077737","5.901","0.003","49.915","0.011","9.112","0.002","90","","108.64","0.03","90","","2543.1","1.6","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H32 O4 Os Ru -","- C26 H32 O4 Os Ru -","- C104 H128 O16 Os4 Ru4 -","4","1","","Lindner, Ekkehard; Krebs, Ilmari; Fawzi, Riad; Steimann, Manfred; Speiser, Bernd","Synthesis, Structure, and Electrochemistry of Osmametallocenophanes with Different Ring Size†,1","Organometallics","1999","18","4","480","","10.1021/om980713e","","","0.71073","MoKα","","0.166","0.0904","","0.2935","0.2061","","","","2.231","2.088","2.088","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077738","7.877","0.001","8.793","0.001","13.087","0.002","93.309","0.013","105.005","0.012","108.641","0.012","819.8","0.2","298","2","298","2","","","","","","","","6","P 1","P 1","1","(S,S)-1,1'-Bis(2-methoxyphenyl(phenyl)- phosphino)ferrocene borane'","","","- C36 H38 B2 Fe O2 P2 -","- C36 H38 B2 Fe O2 P2 -","- C36 H38 B2 Fe O2 P2 -","1","1","","Maienza, Francesca; Wörle, Michael; Steffanut, Pascal; Mezzetti, Antonio; Spindler, Felix","Ferrocenyl Diphosphines Containing Stereogenic Phosphorus Atoms. Synthesis and Application in the Rhodium-Catalyzed Asymmetric Hydrogenation","Organometallics","1999","18","6","1041","","10.1021/om980754a","","","0.71073","MoKα","","0.0428","0.0372","","0.092","0.0863","","","","1.065","1.048","1.048","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077739","14.0951","0.0005","16.8149","0.0006","29.3881","0.0011","90","","90","","90","","6965.2","0.4","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","[PtCl2((S,S)-2a)] (5a)","","","- C73 H66 Cl6 Fe2 O4 P4 Pt2 -","- C73 H66 Cl6 Fe2 O4 P4 Pt2 -","- C292 H264 Cl24 Fe8 O16 P16 Pt8 -","4","1","","Maienza, Francesca; Wörle, Michael; Steffanut, Pascal; Mezzetti, Antonio; Spindler, Felix","Ferrocenyl Diphosphines Containing Stereogenic Phosphorus Atoms. Synthesis and Application in the Rhodium-Catalyzed Asymmetric Hydrogenation","Organometallics","1999","18","6","1041","","10.1021/om980754a","","","0.71073","MoKα","","0.0676","0.0462","","0.1029","0.0947","","","","0.985","1.029","1.029","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077740","11.8666","0.0012","16.5989","0.0017","15.8624","0.0016","90","","103.901","0.003","90","","3032.9","0.5","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H31 Fe2 N3 O6 P2 -","- C27 H31 Fe2 N3 O6 P2 -","- C108 H124 Fe8 N12 O24 P8 -","4","1","","Doherty, Simon; Waugh, Mark; Scanlan, Tom H.; Elsegood, Mark R. J.; Clegg, William","Regioselective Addition of Tris(dialkylamino) Phosphines to [Fe2(CO)6(μ-PPh2){μ-η1:η2-(H)CCCH2}]: Novel P−C Coupling Reactions and Unusual Hydrocarbyl Rearrangements","Organometallics","1999","18","4","679","","10.1021/om980757n","","","0.71073","MoKα","","0.0761","0.0458","","","0.1012","0.1129","","","","","","0.992","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077741","9.0206","0.0015","16.567","0.003","10.5544","0.0017","90","","105.853","0.004","90","","1517.3","0.4","160","2","160","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C27 H31 Fe2 N3 O6 P2 -","- C27 H31 Fe2 N3 O6 P2 -","- C54 H62 Fe4 N6 O12 P4 -","2","1","","Doherty, Simon; Waugh, Mark; Scanlan, Tom H.; Elsegood, Mark R. J.; Clegg, William","Regioselective Addition of Tris(dialkylamino) Phosphines to [Fe2(CO)6(μ-PPh2){μ-η1:η2-(H)CCCH2}]: Novel P−C Coupling Reactions and Unusual Hydrocarbyl Rearrangements","Organometallics","1999","18","4","679","","10.1021/om980757n","","","0.71073","MoKα","","0.0664","0.0522","","","0.1183","0.1269","","","","","","1.015","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077742","18.0652","0.0017","11.6135","0.0011","16.2378","0.0014","90","","90.638","0.002","90","","3406.5","0.5","160","2","160","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H43 Fe2 N3 O5 P2 -","- C32 H43 Fe2 N3 O5 P2 -","- C128 H172 Fe8 N12 O20 P8 -","4","1","","Doherty, Simon; Waugh, Mark; Scanlan, Tom H.; Elsegood, Mark R. J.; Clegg, William","Regioselective Addition of Tris(dialkylamino) Phosphines to [Fe2(CO)6(μ-PPh2){μ-η1:η2-(H)CCCH2}]: Novel P−C Coupling Reactions and Unusual Hydrocarbyl Rearrangements","Organometallics","1999","18","4","679","","10.1021/om980757n","","","0.71073","MoKα","","0.041","0.0267","","","0.0622","0.066","","","","","","1.035","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077743","16.136","0.004","14.227","0.003","31.614","0.007","90","","95.183","0.006","90","","7228","3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C33 H43 Fe2 N3 O6 P2 -","- C33 H43 Fe2 N3 O6 P2 -","- C264 H344 Fe16 N24 O48 P16 -","8","1","","Doherty, Simon; Waugh, Mark; Scanlan, Tom H.; Elsegood, Mark R. J.; Clegg, William","Regioselective Addition of Tris(dialkylamino) Phosphines to [Fe2(CO)6(μ-PPh2){μ-η1:η2-(H)CCCH2}]: Novel P−C Coupling Reactions and Unusual Hydrocarbyl Rearrangements","Organometallics","1999","18","4","679","","10.1021/om980757n","","","0.71073","MoKα","","0.0655","0.0392","","","0.0871","0.0963","","","","","","1.012","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077744","10.5273","0.0013","11.3159","0.0014","17.517","0.002","72.776","0.003","83.932","0.003","75.915","0.003","1931.9","0.4","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H30 Cl2 Fe2 O6 P2 -","- C40 H30 Cl2 Fe2 O6 P2 -","- C80 H60 Cl4 Fe4 O12 P4 -","2","1","","Doherty, Simon; Waugh, Mark; Scanlan, Tom H.; Elsegood, Mark R. J.; Clegg, William","Regioselective Addition of Tris(dialkylamino) Phosphines to [Fe2(CO)6(μ-PPh2){μ-η1:η2-(H)CCCH2}]: Novel P−C Coupling Reactions and Unusual Hydrocarbyl Rearrangements","Organometallics","1999","18","4","679","","10.1021/om980757n","","","0.71073","MoKα","","0.1389","0.1097","","","0.293","0.3014","","","","","","1.161","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077745","16.7155","0.0008","25.7634","0.0012","17.0192","0.0008","90","","99.635","0.002","90","","7225.9","0.6","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39.5 H29 Cl Fe2 O6 P2 -","- C39.5 H29 Cl Fe2 O6 P2 -","- C316 H232 Cl8 Fe16 O48 P16 -","8","2","","Doherty, Simon; Waugh, Mark; Scanlan, Tom H.; Elsegood, Mark R. J.; Clegg, William","Regioselective Addition of Tris(dialkylamino) Phosphines to [Fe2(CO)6(μ-PPh2){μ-η1:η2-(H)CCCH2}]: Novel P−C Coupling Reactions and Unusual Hydrocarbyl Rearrangements","Organometallics","1999","18","4","679","","10.1021/om980757n","","","0.71073","MoKα","","0.1174","0.0558","","","0.104","0.1247","","","","","","1.014","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077746","11.856","0.006","15.22","0.006","17.399","0.006","90","","90","","90","","3140","2","153","","153","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C35 H46 Eu2 -","- C35 H46 Eu2 -","- C140 H184 Eu8 -","4","1","","Evans, William J.; Johnston, Matthew A.; Greci, Michael A.; Ziller, Joseph W.","Synthesis, Structure, and Reactivity of Unsolvated Triple-Decked Bent Metallocenes of Divalent Europium and Ytterbium","Organometallics","1999","18","8","1460","","10.1021/om980762r","","","0.71073","MoKα","","0.076","0.0526","","0.1665","0.1519","","","","1.255","1.315","1.315","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077747","13.338","0.002","13.549","0.002","15.815","0.002","114.772","0.007","93.948","0.011","90.803","0.014","2586","0.7","163","","163","","","","","","","","","3","P -1","-P 1","2","","","","- C28 H38 Yb2 -","- C28 H38 Yb2 -","- C112 H152 Yb8 -","4","2","","Evans, William J.; Johnston, Matthew A.; Greci, Michael A.; Ziller, Joseph W.","Synthesis, Structure, and Reactivity of Unsolvated Triple-Decked Bent Metallocenes of Divalent Europium and Ytterbium","Organometallics","1999","18","8","1460","","10.1021/om980762r","","","0.71073","MoKα","","0.0798","0.0604","","0.1777","0.1607","","","","1.032","1.061","1.061","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077748","13.6333","0.0017","18.674","0.003","18.33","0.003","90","","97.998","0.012","90","","4621.2","1.2","150","","150","","","","","","","","see text","6","P 1 21/c 1","-P 2ybc","14","","","","- C70 H90 Cl26 N2 P2 Pd2 -","- C70 H90 Cl26 N2 P2 Pd2 -","- C140 H180 Cl52 N4 P4 Pd4 -","2","0.5","","van der Sluis, Marcel; Beverwijk, Vincent; Termaten, Arjan; Bickelhaupt, Friedrich; Kooijman, Huub; Spek, Anthony L.","Synthesis of Novel Phosphaalkene-Based Bidentate Ligands Mes*PCH(3-R-Ar) (R = Pyridyl, Carbaldimino) and Formation of Three-Membered Palladacycles Mes*(Me)P−CH(3-R-Ar)−PdCl by Carbapalladation of the PC Double Bond†","Organometallics","1999","18","8","1402","","10.1021/om980913q","","","0.71073","MoKα","","0.1519","0.0655","","","0.117","0.145","","","","","","1.016","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077749","12.788","0.003","9.086","0.002","14.702","0.003","90","","104.84","0.02","90","","1651.3","0.6","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H48 Ga2 N2 -","- C36 H48 Ga2 N2 -","- C72 H96 Ga4 N4 -","2","0.5","","Jutzi, Peter; Neumann, Beate; Reumann, Guido; Stammler, Hans-Georg","Novel Ga2N2Ring Systems by Reaction of Pentamethylcyclopentadienylgallium with Organic Azides","Organometallics","1999","18","10","2037","","10.1021/om980944l","","","0.71073","MoKα","","0.0708","0.041","","","0.0823","0.0916","","","","","","1.033","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077750","9.4749","0.0006","9.7282","0.0007","13.8581","0.0009","88.476","0.001","70.042","0.001","64.883","0.001","1076.56","0.13","163","2","163","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H66 Ga2 N8 Si4 -","- C32 H66 Ga2 N8 Si4 -","- C32 H66 Ga2 N8 Si4 -","1","0.5","","Jutzi, Peter; Neumann, Beate; Reumann, Guido; Stammler, Hans-Georg","Novel Ga2N2Ring Systems by Reaction of Pentamethylcyclopentadienylgallium with Organic Azides","Organometallics","1999","18","10","2037","","10.1021/om980944l","","","0.71073","MoKα","","0.0752","0.042","","","0.0796","0.0912","","","","","","1.013","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077751","21.625","0.0015","19.226","0.0015","15.125","0.001","90","","90","","90","","6288.4","0.8","293","2","293","2","","","","","","","","7","A b a 2","A 2 -2ab","41","","","","- C56 H77 Cl2 Gd4 N5 O3 Si4 -","- C56 H64 Cl2 Gd4 N5 O3 Si4 -","- C224 H256 Cl8 Gd16 N20 O12 Si16 -","4","","","Xie, Zuowei; Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.","Synthesis and Structure of the First Tetranuclear Organolanthanide Cluster Containing aμ4-Imido Group","Organometallics","1999","18","9","1578","","10.1021/om981002j","","","0.71073","MoKα","","0.0642","0.0631","","0.1597","0.1583","","","","1.058","1.059","1.059","","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077752","21.528","0.0012","19.101","0.0011","15.104","0.001","90","","90","","90","","6210.9","0.6","293","2","293","2","","","","","","","","7","A b a 2","A 2 -2ab","41","","","","- C56 H77 Cl2 Er4 N5 O3 Si4 -","- C56 H77 Cl2 Er4 N5 O3 Si4 -","- C224 H308 Cl8 Er16 N20 O12 Si16 -","4","","","Xie, Zuowei; Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.","Synthesis and Structure of the First Tetranuclear Organolanthanide Cluster Containing aμ4-Imido Group","Organometallics","1999","18","9","1578","","10.1021/om981002j","","","0.71073","MoKα","","0.0632","0.0518","","0.1182","0.1124","","","","1.137","1.154","1.154","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077753","10.141","0.001","10.96","0.001","31.183","0.004","90","","90","","90","","3465.8","0.6","200","1","200","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C34 H57 O3 P W -","- C34 H57 O3 P W -","- C136 H228 O12 P4 W4 -","4","1","","Scheer, Manfred; Kramkowski, Peter; Schuster, Kay","An Approach to Novel Complexes with a Tungsten−Phosphorus Triple Bond†","Organometallics","1999","18","15","2874","","10.1021/om990019e","","","0.71069","MoKα","","0.0595","0.0504","","0.1259","0.1167","","","","1.107","1.081","1.081","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077754","10.878","0.002","16.796","0.003","11.577","0.002","90","","114.83","0.03","90","","1919.7","0.8","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H36 O14 P2 W4 -","- C26 H36 O14 P2 W4 -","- C52 H72 O28 P4 W8 -","2","0.5","","Scheer, Manfred; Kramkowski, Peter; Schuster, Kay","An Approach to Novel Complexes with a Tungsten−Phosphorus Triple Bond†","Organometallics","1999","18","15","2874","","10.1021/om990019e","","","0.71073","MoKα","","0.033","0.0264","","","0.0642","0.0683","","","","","","1.107","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077755","12.201","0.002","10.034","0.002","20.883","0.004","90","","94.85","0.03","90","","2547.4","0.8","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H27 O8 P W2 -","- C17 H27 O8 P W2 -","- C68 H108 O32 P4 W8 -","4","1","","Scheer, Manfred; Kramkowski, Peter; Schuster, Kay","An Approach to Novel Complexes with a Tungsten−Phosphorus Triple Bond†","Organometallics","1999","18","15","2874","","10.1021/om990019e","","","0.71073","MoKα","","0.0976","0.0482","","0.0988","0.0853","","","","1.008","1.132","1.132","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077756","9.623","0.001","18.272","0.001","30.565","0.008","90","","90","","90","","5374.3","1.5","200","1","200","1","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C22 H45 O3 P W -","- C22 H45 O3 P W -","- C176 H360 O24 P8 W8 -","8","1","","Scheer, Manfred; Kramkowski, Peter; Schuster, Kay","An Approach to Novel Complexes with a Tungsten−Phosphorus Triple Bond†","Organometallics","1999","18","15","2874","","10.1021/om990019e","","","0.71069","MoKα","","0.0561","0.0301","","0.0798","0.07","","","","1.02","1.066","1.066","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077757","10.6961","0.0008","12.5573","0.0008","19.3285","0.001","105.931","0.005","98.744","0.005","91.686","0.007","2460.4","0.3","200","1","200","1","","","","","","","","5","P -1","-P 1","2","","","","- C47 H58 Cr2 O9 P2 -","- C47 H58 Cr2 O9 P2 -","- C94 H116 Cr4 O18 P4 -","2","1","","Scheer, Manfred; Kramkowski, Peter; Schuster, Kay","An Approach to Novel Complexes with a Tungsten−Phosphorus Triple Bond†","Organometallics","1999","18","15","2874","","10.1021/om990019e","","","0.71073","MoKa","","0.0807","0.0406","","0.1198","0.1036","","","","1.017","1.073","1.073","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077758","9.647","0.0019","10.9","0.002","16.267","0.003","107.96","0.03","90.27","0.03","99.53","0.03","1601.9","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Compound 2c.(MeOH)0.5","","","- C25.5 H24 Mo3 O6.5 S5 W -","- C25.5 H22 Mo3 O6.5 S5 W -","- C51 H44 Mo6 O13 S10 W2 -","2","1","","Rink, Barbara; Brorson, Michael; Scowen, Ian J.","New Heterometallic Cubane-Like Clusters [{(η5-Cp)Mo}3S4{M‘(CO)3}](pts) (M‘ = Cr, Mo, W; pts =p-Toluenesulfonate) Obtained by Ligand Substitution Reactions and Insertion of {M‘(CO)3} Fragments","Organometallics","1999","18","12","2309","","10.1021/om990029f","","","0.71073","MoKα","","0.057","0.0506","","","0.1816","0.1871","","","","","","0.998","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4077759","12.444","0.003","16.842","0.003","23.757","0.005","90","","96.18","0.03","90","","4950.1","1.8","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H44 O6 P4 Pt Ru2 -","- C56 H44 O6 P4 Pt Ru2 -","- C224 H176 O24 P16 Pt4 Ru8 -","4","1","","Sterenberg, Brian T.; Jennings, Michael C.; Puddephatt, Richard J.","Complexes with Platinum−Ruthenium Bonds: The Stepwise Formation of Complexes Containing PtRu and PtRu2Units","Organometallics","1999","18","11","2162","","10.1021/om990032z","","","0.71073","MoKα","","0.0429","0.0288","","0.0667","0.0621","","","","1.059","1.101","1.101","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077760","19.788","0.004","16.897","0.003","17.302","0.004","90","","106.37","0.03","90","","5551","2","292","2","292","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C55.5 H52 Cl4 O2 P4 Pt Ru -","- C55.5 H52 Cl4 O2 P4 Pt Ru -","- C222 H208 Cl16 O8 P16 Pt4 Ru4 -","4","1","","Sterenberg, Brian T.; Jennings, Michael C.; Puddephatt, Richard J.","Complexes with Platinum−Ruthenium Bonds: The Stepwise Formation of Complexes Containing PtRu and PtRu2Units","Organometallics","1999","18","11","2162","","10.1021/om990032z","","","0.71073","MoKα","","0.0526","0.0497","","","0.1384","0.1426","","","","","","1.047","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077761","17.678","0.005","11.559","0.001","20.474","0.001","90","","103.63","0.009","90","","4065.8","1.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H63 O4 Rh4 Ta -","- C42 H63 O4 Rh4 Ta -","- C168 H252 O16 Rh16 Ta4 -","4","1","","Fandos, Rosa; Hernández, Carolina; Otero, Antonio; Rodríguez, Ana; Ruiz, Maria José; García Fierro, José Luis; Terreros, Pilar","Rhodium and Iridium Hydroxide Complexes [M(μ-OH)(COD)]2(M = Rh, Ir) as Versatile Precursors of Homo and Early−Late Heterobimetallic Compounds. X-ray Crystal Structures of Cp*Ta(μ3-O)4[Rh(COD)]4(Cp* = η5-C5Me5) and [Ir(2-O-3-CN-4,6-Me2-C5HN)(COD)]2","Organometallics","1999","18","14","2718","","10.1021/om990065e","","","0.7107","MoKα","","0.149","0.0548","","","0.0873","0.1407","","","","","","0.971","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077762","10.561","0.004","10.988","0.003","15.45","0.01","80.76","0.05","70.11","0.04","61.37","0.02","1479.8","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H38 Ir2 N4 O2 -","- C32 H38 Ir2 N4 O2 -","- C64 H76 Ir4 N8 O4 -","2","1","","Fandos, Rosa; Hernández, Carolina; Otero, Antonio; Rodríguez, Ana; Ruiz, Maria José; García Fierro, José Luis; Terreros, Pilar","Rhodium and Iridium Hydroxide Complexes [M(μ-OH)(COD)]2(M = Rh, Ir) as Versatile Precursors of Homo and Early−Late Heterobimetallic Compounds. X-ray Crystal Structures of Cp*Ta(μ3-O)4[Rh(COD)]4(Cp* = η5-C5Me5) and [Ir(2-O-3-CN-4,6-Me2-C5HN)(COD)]2","Organometallics","1999","18","14","2718","","10.1021/om990065e","","","0.7107","MoKα","","0.0663","0.0417","","","0.0962","0.1221","","","","","","1.025","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077763","13.693","0.001","6.292","0.001","14.12","0.001","90","","105.41","0.01","90","","1172.8","0.2","203","2","203","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C8 H6 Cl F5 Hg O S -","- C8 H6 Cl F5 Hg O S -","- C32 H24 Cl4 F20 Hg4 O4 S4 -","4","1","","Tschinkl, Martin; Schier, Annette; Riede, Jürgen; Gabbaï, François P.","Complexation of DMF and DMSO by a Monodentate Organomercurial Lewis Acid","Organometallics","1999","18","10","2040","","10.1021/om990081b","","","0.71073","MoKα","","0.037","0.0318","","0.0906","0.0833","","","","1.042","1.072","1.072","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077764","10.445","0.001","12.962","0.003","15.404","0.003","101.37","0.01","95.97","0.01","92.78","0.01","2028.4","0.6","176","2","176","2","","","","","","","","7","P -1","-P 1","2","","","","- C7.5 H3.5 Cl F5 Hg N0.5 O0.5 -","- C7.5 H3.5 Cl F5 Hg N0.5 O0.5 -","- C60 H28 Cl8 F40 Hg8 N4 O4 -","8","4","","Tschinkl, Martin; Schier, Annette; Riede, Jürgen; Gabbaï, François P.","Complexation of DMF and DMSO by a Monodentate Organomercurial Lewis Acid","Organometallics","1999","18","10","2040","","10.1021/om990081b","","","0.71073","MoKα","","0.0637","0.0356","","0.1014","0.0874","","","","0.986","1.035","1.035","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077765","7.2512","0.0004","14.4243","0.0018","28.001","0.004","90","","97.4","0.01","90","","2904.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","C5Me5Ir(CO)B3H7","","- C11 H22 B3 Ir O -","- C11 H22 B3 Ir O -","- C88 H176 B24 Ir8 O8 -","8","2","","Lei, Xinjian; Bandyopadhyay, Ananda K.; Shang, Maoyu; Fehlner, Thomas P.","Novel Iridaboranes from the Reactions of Cp*2Ir2HxCl4-x,x= 0−2, with LiBH4. Existence of a Concurrent Reaction Channel in the Conversion of Metal Chlorides to Metal Hydrides","Organometallics","1999","18","12","2294","","10.1021/om990091c","","","0.71073","MoKα","","0.0822","0.0475","","","0.1067","0.1324","","","","","","1.042","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077766","8.551","0.002","10.306","0.002","14.884","0.002","107.113","0.013","92.554","0.012","111.67","0.02","1147.5","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","{(C5Me5Ir)2H3B2H5","","- C20 H38 B2 Ir2 -","- C20 H38 B2 Ir2 -","- C40 H76 B4 Ir4 -","2","1","","Lei, Xinjian; Bandyopadhyay, Ananda K.; Shang, Maoyu; Fehlner, Thomas P.","Novel Iridaboranes from the Reactions of Cp*2Ir2HxCl4-x,x= 0−2, with LiBH4. Existence of a Concurrent Reaction Channel in the Conversion of Metal Chlorides to Metal Hydrides","Organometallics","1999","18","12","2294","","10.1021/om990091c","","","0.71073","MoKα","","0.0503","0.0389","","0.1013","0.0963","","","","1.058","1.134","1.134","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077767","7.252","0.0015","16.144","0.003","12.733","0.003","90","","90","","90","","1490.7","0.5","200","2","200","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C14 H13 Cr2 O4 P -","- C14 H13 Cr2 O4 P -","- C56 H52 Cr8 O16 P4 -","4","0.5","","Sekar, Perumal; Scheer, Manfred; Voigt, Andreas; Kirmse, Reinhard","Unusual Reactivity of a Cr2P2Tetrahedral Complex toward Superhydride; Formation of [{CpCr(CO)2}2(μ-PH2)x(μ-H)2-x] (x= 1 and 2) and [\λangle {CpCr(CO)2}2(μ-PH)〉{(CpCr)2(μ,η1:η1:η5:η5-P5)}]†","Organometallics","1999","18","15","2833","","10.1021/om990098u","","","0.71073","MoKα","","0.03","0.0246","","0.0694","0.064","","","","1.102","1.092","1.092","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077768","14.156","0.003","23.05","0.005","15.818","0.003","90","","109.54","0.03","90","","4864","2","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H14 Cr2 O4 P2 -","- C14 H14 Cr2 O4 P2 -","- C168 H168 Cr24 O48 P24 -","12","3","","Sekar, Perumal; Scheer, Manfred; Voigt, Andreas; Kirmse, Reinhard","Unusual Reactivity of a Cr2P2Tetrahedral Complex toward Superhydride; Formation of [{CpCr(CO)2}2(μ-PH2)x(μ-H)2-x] (x= 1 and 2) and [\λangle {CpCr(CO)2}2(μ-PH)〉{(CpCr)2(μ,η1:η1:η5:η5-P5)}]†","Organometallics","1999","18","15","2833","","10.1021/om990098u","","","0.71073","MoKα","","0.0873","0.0536","","","0.1294","0.15","","","","","","1.033","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077769","10.077","0.002","14.895","0.003","22.571","0.005","90","","97.68","0.03","90","","3357.4","1.2","200","1","200","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H29 Cr4 O4 P6 -","- C31 H29 Cr4 O4 P6 -","- C124 H116 Cr16 O16 P24 -","4","1","","Sekar, Perumal; Scheer, Manfred; Voigt, Andreas; Kirmse, Reinhard","Unusual Reactivity of a Cr2P2Tetrahedral Complex toward Superhydride; Formation of [{CpCr(CO)2}2(μ-PH2)x(μ-H)2-x] (x= 1 and 2) and [\λangle {CpCr(CO)2}2(μ-PH)〉{(CpCr)2(μ,η1:η1:η5:η5-P5)}]†","Organometallics","1999","18","15","2833","","10.1021/om990098u","","","0.71073","MoKα","","0.1397","0.0524","","","0.0685","0.0879","","","","","","0.853","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077770","17.7921","0.0013","18.3983","0.0015","25.016","0.002","90","","90","","90","","8188.8","1.1","173","2","173","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C32 H31 Cl11 D3 O2 P Pt -","- C32 H34 Cl11 O2 P Pt -","- C256 H272 Cl88 O16 P8 Pt8 -","8","1","","Vicente, José; Chicote, María-Teresa; MacBeath, Calum; Fernández-Baeza, Juan; Bautista, Delia","Nucleophilic Attack of Carbonyl-Stabilized Phosphorus Ylides on 1,5-Cyclooctadiene Complexes of Palladium and Platinum","Organometallics","1999","18","14","2677","","10.1021/om9901022","","","0.71073","MoKα","","0.0998","0.0613","","0.1509","0.1321","","","","1.036","1.116","1.116","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077771","15.8478","0.0012","12.6315","0.0008","21.8574","0.0012","90","","102.98","0.004","90","","4263.6","0.5","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C41 H41 F6 N2 O8 P Pt S2 -","- C41 H41 F6 N2 O8 P Pt S2 -","- C164 H164 F24 N8 O32 P4 Pt4 S8 -","4","1","","Vicente, José; Chicote, María-Teresa; MacBeath, Calum; Fernández-Baeza, Juan; Bautista, Delia","Nucleophilic Attack of Carbonyl-Stabilized Phosphorus Ylides on 1,5-Cyclooctadiene Complexes of Palladium and Platinum","Organometallics","1999","18","14","2677","","10.1021/om9901022","","","0.71073","MoKα","","0.0647","0.0437","","0.1087","0.0987","","","","0.982","1.026","1.026","","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077772","10.6985","0.0008","11.8973","0.0008","17.5225","0.0014","103.495","0.006","92.797","0.006","114.671","0.008","1943.6","0.3","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C23.85 H21.57 Cl0.14 N2 O Pd -","- C23.8555 H21.5665 Cl0.1445 N2 O Pd -","- C95.422 H86.266 Cl0.578 N8 O4 Pd4 -","4","2","","Hovestad, Neldes J.; Hoare, Jason L.; Jastrzebski, Johann T. B. H.; Canty, Allan J.; Smeets, Wilberth J. J.; Spek, Anthony L.; van Koten, Gerard","Periphery-Palladated Carbosilane Dendrimers: Synthesis and Reactivity of Organopalladium(II) and -(IV) Dendritic Complexes. Crystal Structure of [PdMe(C6H4(OCH2Ph)-4)(bpy)] (bpy = 2,2‘-Bipyridine)","Organometallics","1999","18","16","2970","","10.1021/om9901269","","","0.71073","MoKα","","0.1257","0.0592","","0.1356","0.1115","","","","0.998","1.095","1.095","","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077773","8.7492","0.0008","10.6231","0.0011","13.6351","0.001","73.608","0.001","77.941","0.001","72.72","","1150.03","0.18","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H37 Cl N Zr -","- C24 H37 Cl N Zr -","- C48 H74 Cl2 N2 Zr2 -","2","1","","Segerer, Ulrike; Blaurock, Steffen; Sieler, Joachim; Hey-Hawkins, Evamarie","Insertion of Acetonitrile into the Zr−P Bond of [Cp°2ZrCl(PHCy)] (Cy = Cyclohexyl, Cp° = η5-C5EtMe4) Followed by PHCy Elimination To Give [Cp°2(Cl)Zr(μ-NCMe−CMeN)Zr(Cl)Cp°2]†","Organometallics","1999","18","15","2838","","10.1021/om9901271","","","0.71073","MoKα","","0.0561","0.0474","","","0.1044","0.1114","","","","","","1.093","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077774","10.5957","0.0001","18.5879","0.0001","15.5533","0.0001","90","","98.457","0.001","90","","3029.94","0.04","220","2","220","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H49 Cl N P Zr -","- C30 H49 Cl N P Zr -","- C120 H196 Cl4 N4 P4 Zr4 -","4","1","","Segerer, Ulrike; Blaurock, Steffen; Sieler, Joachim; Hey-Hawkins, Evamarie","Insertion of Acetonitrile into the Zr−P Bond of [Cp°2ZrCl(PHCy)] (Cy = Cyclohexyl, Cp° = η5-C5EtMe4) Followed by PHCy Elimination To Give [Cp°2(Cl)Zr(μ-NCMe−CMeN)Zr(Cl)Cp°2]†","Organometallics","1999","18","15","2838","","10.1021/om9901271","","","0.71073","MoKα","","0.0498","0.0352","","0.0861","0.0782","","","","1.076","1.081","1.081","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077775","10.701","0.003","18.295","0.004","12.974","0.003","90","","102.62","0.02","90","","2478.6","1.1","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 B10 Cl2 O8 Ru3 -","- C10 H14 B10 Cl2 O8 Ru3 -","- C40 H56 B40 Cl8 O32 Ru12 -","4","1","","Ellis, Dianne D.; Franken, Andreas; Stone, F. Gordon A.","Synthesis and Reactions of the Triruthenamonocarboncarborane Cluster Complex [NHMe3][Ru3(CO)8(η5-7-CB10H11)]†","Organometallics","1999","18","12","2362","","10.1021/om990133x","","","0.71073","MoKα","","0.0385","0.0305","","0.0758","0.0695","","","","1.107","1.133","1.133","","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077776","12.913","0.003","14.336","0.003","15.879","0.003","102.307","0.012","106.77","0.02","100.54","0.02","2654.3","1.1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C45 H43 B10 Cl2 Cu O7 P2 Ru3 -","- C45 H43 B10 Cl2 Cu O7 P2 Ru3 -","- C90 H86 B20 Cl4 Cu2 O14 P4 Ru6 -","2","1","","Ellis, Dianne D.; Franken, Andreas; Stone, F. Gordon A.","Synthesis and Reactions of the Triruthenamonocarboncarborane Cluster Complex [NHMe3][Ru3(CO)8(η5-7-CB10H11)]†","Organometallics","1999","18","12","2362","","10.1021/om990133x","","","0.71073","MoKα","","0.0983","0.0508","","0.0996","0.0839","","","","1.017","1.09","1.09","","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077777","12.222","0.004","13.027","0.003","13.317","0.003","80.48","0.02","82.25","0.02","62.98","0.02","1858.5","0.9","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H26 Au B10 O8 P Ru3 -","- C27 H26 Au B10 O8 P Ru3 -","- C54 H52 Au2 B20 O16 P2 Ru6 -","2","1","","Ellis, Dianne D.; Franken, Andreas; Stone, F. Gordon A.","Synthesis and Reactions of the Triruthenamonocarboncarborane Cluster Complex [NHMe3][Ru3(CO)8(η5-7-CB10H11)]†","Organometallics","1999","18","12","2362","","10.1021/om990133x","","","0.71073","MoKα","","0.0863","0.0503","","0.1193","0.1076","","","","0.989","1.09","1.09","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077778","13.515","0.001","21.974","0.002","27.244","0.003","90","","94.716","0.009","90","","8063.5","1.3","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C82 H28 Au4 F40 Fe P2 S2 -","- C82 H28 Au4 F40 Fe P2 S2 -","- C328 H112 Au16 F160 Fe4 P8 S8 -","4","0.5","","Crespo, Olga; Canales, Fernando; Gimeno, M. Concepción; Jones, Peter G.; Laguna, Antonio","Synthesis of [Au2(SC6F5)2(μ-dppf)] and [Au2(μ-SC6F5)(μ-dppf)] (dppf = 1,1‘-Bis(diphenylphosphino)ferrocene). Reactivity toward Various Metallic Fragments","Organometallics","1999","18","16","3142","","10.1021/om9901372","","","0.71073","MoKα","","0.0652","0.0331","","0.063","0.0567","","","","0.872","0.985","0.985","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077779","14.953","0.005","30.587","0.008","21.606","0.005","90","","107.01","0.02","90","","9450","5","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C42.5 H32 Au2 Cl6 F5 Fe O4 P2 S -","- C42 H31 Au2 Cl6 F5 Fe O4 P2 S -","- C336 H248 Au16 Cl48 F40 Fe8 O32 P16 S8 -","8","2","","Crespo, Olga; Canales, Fernando; Gimeno, M. Concepción; Jones, Peter G.; Laguna, Antonio","Synthesis of [Au2(SC6F5)2(μ-dppf)] and [Au2(μ-SC6F5)(μ-dppf)] (dppf = 1,1‘-Bis(diphenylphosphino)ferrocene). Reactivity toward Various Metallic Fragments","Organometallics","1999","18","16","3142","","10.1021/om9901372","","","0.71073","MoKα","","0.1418","0.0703","","","0.15","0.1714","","","","","","0.911","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077780","10.99","0.02","9.93","0.01","7.462","0.008","90","","120.48","0.01","90","","701.8","1.6","223","2","223","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C12 H10 Co F6 O4 P -","- C12 H8 Co F6 O4 P -","- C24 H16 Co2 F12 O8 P2 -","2","0.25","","Braga, Dario; Maini, Lucia; Polito, Marco; Grepioni, Fabrizia","Hydrogen Bonds within an Ionic Environment: The Remarkable Behavior of the Zwitterion [CoIII(η5-C5H4COOH)(η5-C5H4COO)]","Organometallics","1999","18","14","2577","","10.1021/om990141d","","","0.71069","MoKα","","0.208","0.0782","","","0.1819","0.2535","","","","","","0.832","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077781","6.953","0.002","11.856","0.009","14.862","0.005","86.98","0.05","80.55","0.02","82.69","0.04","1198.1","1.1","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H19 Co2 F6 O8 P -","- C24 H18 Co2 F6 O8 P -","- C48 H36 Co4 F12 O16 P2 -","2","1","","Braga, Dario; Maini, Lucia; Polito, Marco; Grepioni, Fabrizia","Hydrogen Bonds within an Ionic Environment: The Remarkable Behavior of the Zwitterion [CoIII(η5-C5H4COOH)(η5-C5H4COO)]","Organometallics","1999","18","14","2577","","10.1021/om990141d","","","0.71069","MoKα","","0.1341","0.0472","","","0.1207","0.1607","","","","","","0.983","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077782","5.951","0.002","7.864","0.001","14.298","0.008","74.4","0.03","78.22","0.03","74.45","0.02","614.6","0.4","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C12 H9 Co F3 K0.5 O4 P0.5 -","- C12 H8 Co F3 K0.5 O4 P0.5 -","- C24 H16 Co2 F6 K O8 P -","2","1","","Braga, Dario; Maini, Lucia; Polito, Marco; Grepioni, Fabrizia","Hydrogen Bonds within an Ionic Environment: The Remarkable Behavior of the Zwitterion [CoIII(η5-C5H4COOH)(η5-C5H4COO)]","Organometallics","1999","18","14","2577","","10.1021/om990141d","","","0.71069","MoKα","","0.1837","0.0688","","","0.1561","0.1999","","","","","","0.891","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4077783","10.18","0.001","25.012","0.004","26.11","0.005","90","","95.51","0.01","90","","6617.5","1.8","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H32 Ir3 O13 P3 S3 Ti -","- C18 H32 Ir3 O13 P3 S3 Ti -","- C144 H256 Ir24 O104 P24 S24 Ti8 -","8","2","","Casado, Miguel A.; Ciriano, Miguel A.; Edwards, Andrew J.; Lahoz, Fernando J.; Oro, Luis A.; Pérez-Torrente, Jesús J.","Sulfido-Bridged Tetranuclear Titanium−Iridium Complexes with an Unconventional Tetrahedral Iridium Center","Organometallics","1999","18","16","3025","","10.1021/om990154r","","","0.71073","MoKα","","0.1476","0.0655","","","0.1271","0.1578","","","","","","0.981","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077784","28.981","0.002","13.2742","0.0011","15.5704","0.0014","90","","115.623","0.002","90","","5400.9","0.8","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H22 Fe2 N O6 P -","- C26 H22 Fe2 N O6 P -","- C208 H176 Fe16 N8 O48 P8 -","8","1","","Doherty, Simon; Hogarth, Graeme; Waugh, Mark; Scanlan, Tom H.; Clegg, William; Elsegood, Mark R. J.","Regioselective Addition oftert-BuN⋮C to the α Carbon Atom of the Allenyl Ligand in [Fe2(CO)6(μ-PPh2){μ-η1:η2α,β-(H)CαCβCγH2}]: Formation of [Fe2(CO)6(μ-PPh2){μ-η1:η1-(tert-BuN⋮C)CCCH3}] and [Fe2(CO)6(μ-PPh2)(μ-η1:η2-{tert-BuNHC(O)CH2}CCH2)] via Competitive 1,3-Hydrogen Migration and Hydrolysis of the Reactive Allene-Bridged Intermediate [Fe2(CO)6(μ-PPh2){μ-η1:η1-(tert-BuNC)HCCCH2}]","Organometallics","1999","18","16","3178","","10.1021/om9901630","","","0.71073","MoKα","","0.0732","0.0404","","","0.0881","0.0983","","","","","","1.009","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077785","9.4537","0.0006","19.1346","0.0011","17.1325","0.001","90","","102.218","0.002","90","","3028.9","0.3","160","2","160","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H31 Fe2 N2 O6 P -","- C29 H31 Fe2 N2 O6 P -","- C116 H124 Fe8 N8 O24 P4 -","4","1","","Doherty, Simon; Hogarth, Graeme; Waugh, Mark; Scanlan, Tom H.; Clegg, William; Elsegood, Mark R. J.","Regioselective Addition oftert-BuN⋮C to the α Carbon Atom of the Allenyl Ligand in [Fe2(CO)6(μ-PPh2){μ-η1:η2α,β-(H)CαCβCγH2}]: Formation of [Fe2(CO)6(μ-PPh2){μ-η1:η1-(tert-BuN⋮C)CCCH3}] and [Fe2(CO)6(μ-PPh2)(μ-η1:η2-{tert-BuNHC(O)CH2}CCH2)] via Competitive 1,3-Hydrogen Migration and Hydrolysis of the Reactive Allene-Bridged Intermediate [Fe2(CO)6(μ-PPh2){μ-η1:η1-(tert-BuNC)HCCCH2}]","Organometallics","1999","18","16","3178","","10.1021/om9901630","","","0.71073","MoKα","","0.0463","0.0321","","","0.0754","0.0784","","","","","","1.007","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077786","8.5433","0.0005","11.6773","0.0007","13.413","0.0007","91.276","0.002","99.797","0.002","103.431","0.002","1279.87","0.13","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H24 Fe2 N O6 P -","- C25 H24 Fe2 N O6 P -","- C50 H48 Fe4 N2 O12 P2 -","2","1","","Doherty, Simon; Hogarth, Graeme; Waugh, Mark; Scanlan, Tom H.; Clegg, William; Elsegood, Mark R. J.","Regioselective Addition oftert-BuN⋮C to the α Carbon Atom of the Allenyl Ligand in [Fe2(CO)6(μ-PPh2){μ-η1:η2α,β-(H)CαCβCγH2}]: Formation of [Fe2(CO)6(μ-PPh2){μ-η1:η1-(tert-BuN⋮C)CCCH3}] and [Fe2(CO)6(μ-PPh2)(μ-η1:η2-{tert-BuNHC(O)CH2}CCH2)] via Competitive 1,3-Hydrogen Migration and Hydrolysis of the Reactive Allene-Bridged Intermediate [Fe2(CO)6(μ-PPh2){μ-η1:η1-(tert-BuNC)HCCCH2}]","Organometallics","1999","18","16","3178","","10.1021/om9901630","","","0.71073","MoKα","","0.033","0.0298","","","0.0775","0.0804","","","","","","1.055","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077787","6.667","0.002","12.774","0.002","12.848","0.002","66.04","0.01","75","0.02","74.88","0.02","950.7","0.4","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","N,N-Dimethylaminomethyl-trimethylstannane","","- C6 H17 N Sn -","- C6 H17 N Sn -","- C24 H68 N4 Sn4 -","4","2","","Mitzel, Norbert W.; Kiener, Christoph; Rankin, David W. H.","Are There Structurally Relevant Attractive Interactions between Nitrogen Atoms and Group 14 Elements in Their Aminomethyl Compounds?","Organometallics","1999","18","17","3437","","10.1021/om990166c","","","0.71073","MoKα","","0.03","0.0259","","0.0824","0.0694","","","","1.199","1.23","1.23","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077788","8.279","0.001","8.79","0.004","9.874","0.003","70.26","0.03","73.05","0.03","85.65","0.04","646.7","0.4","213","2","213","2","","","","","","","synthesized","5","P -1","-P 1","2","","catena-Poly{[tetrakis(μ-trifluoroacetato-κO,κO')dirhodium(II,II)]- -μ-η2-hexamethylbenzene}","","- C20 H18 F12 O8 Rh2 -","- C20 H18 F11.994 O8 Rh2 -","- C20 H18 F11.994 O8 Rh2 -","1","0.5","","Cotton, F. Albert; Dikarev, Evgeny V.; Stiriba, Salah-Eddine","Studies of Tetrakis(trifluoroacetate) Dirhodium. 2.†A Pi Complex of Hexamethylbenzene with Tetrakis(trifluoroacetate) Dirhodium(II,II)","Organometallics","1999","18","14","2724","","10.1021/om9901933","","","0.71073","MoKα","","0.0411","0.038","","0.0999","0.0957","","","","1.123","1.118","1.118","","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077789","15.0938","0.0013","12.068","0.0009","9.0823","0.0007","90","","95.89","0.02","90","","1645.6","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H20 Mo O3 Si2 -","- C12 H20 Mo O3 Si2 -","- C48 H80 Mo4 O12 Si8 -","4","1","","Ueno, Keiji; Masuko, Akira; Ogino, Hiroshi","Synthesis, Crystal Structures, and Fluxional Behavior of Donor-Bridged Bis(silylene)molybdenum and -chromium Complexes","Organometallics","1999","18","14","2694","","10.1021/om990201f","","","0.71073","MoKα","","0.0605","0.0356","","0.094","0.0835","","","","1.052","1.079","1.079","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077790","16.6668","0.0015","8.8103","0.0007","12.9121","0.0012","90","","94.59","0.02","90","","1889.9","0.3","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C15 H27 Mo N O2 Si2 -","- C15 H27 Mo N O2 Si2 -","- C60 H108 Mo4 N4 O8 Si8 -","4","1","","Ueno, Keiji; Masuko, Akira; Ogino, Hiroshi","Synthesis, Crystal Structures, and Fluxional Behavior of Donor-Bridged Bis(silylene)molybdenum and -chromium Complexes","Organometallics","1999","18","14","2694","","10.1021/om990201f","","","0.71073","MoKα","","0.0725","0.0362","","0.0908","0.0786","","","","1.034","1.077","1.077","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077791","12.9","0.002","14.456","0.002","8.5349","0.0008","90","","90","","90","","1591.6","0.4","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C12 H20 Cr O3 Si -","- C12 H20 Cr O3 Si2 -","- C48 H80 Cr4 O12 Si8 -","4","0.5","","Ueno, Keiji; Masuko, Akira; Ogino, Hiroshi","Synthesis, Crystal Structures, and Fluxional Behavior of Donor-Bridged Bis(silylene)molybdenum and -chromium Complexes","Organometallics","1999","18","14","2694","","10.1021/om990201f","","","0.71073","MoKα","","0.1959","0.0654","","0.2056","0.1427","","","","1.023","1.151","1.151","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077792","16.1431","0.0019","16.1431","0.0019","32.538","0.003","90","","90","","90","","8479.4","1.6","173","2","173","2","","","","","","","","5","P 4/n n c :2","-P 4a 2bc","126","","","","- C194 H120 Cl4 Cu12 Pt6 -","- C194.08 H120 Cl4 Cu12 Pt6 -","- C388.16 H240 Cl8 Cu24 Pt12 -","2","0.125","","Charmant, Jonathan P. H.; Forniés, Juan; Gómez, Julio; Lalinde, Elena; Merino, Rosa I.; Moreno, M. Teresa; Orpen, A. Guy","Unprecedented Pt−Pt Bonded Trimer {[Pt2Cu4(C⋮CPh)8]}3Showing Unusual Near-Infrared Luminescence","Organometallics","1999","18","17","3353","","10.1021/om9902030","","","0.71073","MoKα","","0.0777","0.0503","","","0.1342","0.1414","","","","","","1.662","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077793","10.0462","0.0002","15.8421","0.0006","10.5005","0.0004","90","","95.245","0.001","90","","1664.19","0.1","294","2","294","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C9 H22 F3 N3 O3 Pt S -","- C9 H22 F3 N3 O3 Pt S -","- C36 H88 F12 N12 O12 Pt4 S4 -","4","1","","Prokopchuk, Ernest M.; Jenkins, Hilary A.; Puddephatt, Richard J.","Stable Cationic Dimethyl(hydrido)platinum(IV) Complex","Organometallics","1999","18","15","2861","","10.1021/om990205k","","","0.71073","MoKα","","0.0559","0.0496","","0.1318","0.1222","","","","1.095","1.105","1.105","","","","","has coordinates,has disorder","178666","2020-10-21","18:00:00",""
"4077794","15.4869","0.0018","15.7118","0.0045","16.8257","0.0011","94.928","0.012","115.609","0.008","110.508","0.015","3318.7","1.2","293","","293","","","","","","","","?","5","P -1","-P 1","2","","","","- C65 H38 Mo3 O15.5 P3 -","- C65 H38 Mo3 O15.5 P3 -","- C130 H76 Mo6 O31 P6 -","2","1","","Constable, Edwin C.; Housecroft, Catherine E.; Krattinger, Bénédicte; Neuburger, Markus; Zehnder, Margareta","Annular Heterometallic Stars†","Organometallics","1999","18","14","2565","","10.1021/om990226e","","","1.5418","CuKα","","","0.0465","","","0.0591","","","","","0.9908","0.9908","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077795","8.776","0.002","17.577","0.004","15.875","0.004","90","","96.1","0.02","90","","2434.9","1","143.2","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H21 Bi Cl3 N O4 -","- C23 H21 Bi Cl3 N O4 -","- C92 H84 Bi4 Cl12 N4 O16 -","4","1","","Matano, Yoshihiro; Nomura, Hazumi; Shiro, Motoo; Suzuki, Hitomi","First Synthesis, Structure, and Reactivity of (Acylimino)triaryl-λ5-bismuthanes Stabilized byortho-Substituted Aryl Ligands","Organometallics","1999","18","14","2580","","10.1021/om990252c","","","0.7107","MoKα","","","0.0251","","","","0.0342","","","","","","1.11","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4077796","12.997","0.005","14.39","0.003","16.705","0.008","90","","91.064","0.002","90","","3124","2","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","compound 1","","","- C36 H30 Fe2 O4 -","- C36 H30 Fe2 O4 -","- C144 H120 Fe8 O16 -","4","1","","Sakurai, Aizoh; Akita, Munetaka; Moro-oka, Yoshihiko","Synthesis and Characterization of the Dodecahexaynediyldiiron Complex, Fp*−(C⋮C)6−Fp* [Fp*= Fe(η5-C5Me5)(CO)2], the Longest Structurally Characterized Polyynediyl Complex","Organometallics","1999","18","16","3241","","10.1021/om990266i","","","0.7107","MoKα","","0.1323","0.0857","","0.1965","0.1712","","","","1.004","1.019","1.019","","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077797","9.9165","0.0004","17.7521","0.0008","15.86","0.0007","90","","92.514","0.001","90","","2789.3","0.2","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H42 K N2 P Si2 -","- C25 H42 K N2 P Si2 -","- C100 H168 K4 N8 P4 Si8 -","4","1","","Clegg, William; Izod, Keith; O'Shaughnessy, Paul","First Structurally Authenticated Heavier Alkali Metal Phosphinomethanide","Organometallics","1999","18","16","2939","","10.1021/om990276j","","","0.71073","MoKα","","0.0448","0.0324","","","0.0814","0.0838","","","","","","1.043","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077798","18.807","0.002","18.927","0.002","21.214","0.002","90","","97.18","0.016","90","","7492.1","1.4","293","2","293","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","[η^2^-bis(trimethylsilyl)ethyne]-bis[η^5^(1-trimethylsilyl-2,3,4,5- tetramethyl-cyclopentadienyl)]-titanium(II)","","- C32 H60 Si4 Ti -","- C32 H60 Si4 Ti -","- C256 H480 Si32 Ti8 -","8","1","","Horáček, Michal; Kupfer, Volkmar; Thewalt, Ulf; Štěpnička, Petr; Polášek, Miroslav; Mach, Karel","Bis[η5-tetramethyl(trimethylsilyl)cyclopentadienyl]titanium(II) and Its π-Complexes with Bis(trimethylsilyl)acetylene and Ethylene","Organometallics","1999","18","18","3572","","10.1021/om990286k","","","0.71073","MoKα","","0.1143","0.0472","","","0.0924","0.1063","","","","","","0.73","","","","has coordinates","178666","2020-10-21","18:00:00",""
"4077799","14.087","0.003","11.5738","0.0017","16.137","0.003","90","","90","","90","","2631","0.8","293","2","293","2","","","","","","","","4","C m c e","-C 2ac 2","64","","[η^5^(1-trimethylsilyl-2,3,4,5-tetramethyl-cyclopentadienyl)]-titanium(II)","","- C24 H42 Si2 Ti -","- C24 H42 Si2 Ti -","- C96 H168 Si8 Ti4 -","4","0.25","","Horáček, Michal; Kupfer, Volkmar; Thewalt, Ulf; Štěpnička, Petr; Polášek, Miroslav; Mach, Karel","Bis[η5-tetramethyl(trimethylsilyl)cyclopentadienyl]titanium(II) and Its π-Complexes with Bis(trimethylsilyl)acetylene and Ethylene","Organometallics","1999","18","18","3572","","10.1021/om990286k","","","0.71073","MoKα","","0.0562","0.0491","","","0.147","0.1523","","","","","","1.084","","","","has coordinates","264764","2021-05-03","08:11:05",""
"4077800","17.241","0.005","8.309","0.002","18.878","0.005","90","","98.65","0.02","90","","2673.6","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","[η^2^-ethene]-bis[η^5^(1-trimethylsilyl-2,3,4,5-tetramethyl- cyclopentadienyl)]-titanium(II)","","- C26 H46 Si2 Ti -","- C26 H46 Si2 Ti -","- C104 H184 Si8 Ti4 -","4","0.5","","Horáček, Michal; Kupfer, Volkmar; Thewalt, Ulf; Štěpnička, Petr; Polášek, Miroslav; Mach, Karel","Bis[η5-tetramethyl(trimethylsilyl)cyclopentadienyl]titanium(II) and Its π-Complexes with Bis(trimethylsilyl)acetylene and Ethylene","Organometallics","1999","18","18","3572","","10.1021/om990286k","","","0.71073","MoKα","","0.0776","0.0539","","","0.1206","0.1296","","","","","","1.047","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077801","12.6881","0.0003","26.5007","0.0004","23.6364","0.0005","90","","98.0317","0.0008","90","","7869.6","0.3","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C80 H69 Cl2 F6 O4 P7 Pt3 Ru -","- C80 H69 Cl2 F6 O4 P7 Pt3 Ru -","- C320 H276 Cl8 F24 O16 P28 Pt12 Ru4 -","4","1","","Sterenberg, Brian T.; Jennings, Michael C.; Puddephatt, Richard J.","Complexes with Platinum−Ruthenium Bonds: Synthesis, Structure, and Fluxionality of Pt3Ru Cluster Complexes","Organometallics","1999","18","18","3737","","10.1021/om990325s","","","0.71073","MoKα","","0.0578","0.0397","","","0.093","0.1035","","","","","","1.034","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077802","12.0082","0.0015","18.663","0.003","18.131","0.003","90","","108.883","0.005","90","","3844.6","1","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H64 N4 Si3 Zr -","- C31 H64 N4 Si3 Zr -","- C124 H256 N16 Si12 Zr4 -","4","1","","Morton, Colin; Munslow, Ian J.; Sanders, Christopher J.; Alcock, Nathaniel W.; Scott, Peter","Triamidoamine Chemistry of Zirconium","Organometallics","1999","18","22","4608","","10.1021/om990347e","","","0.71073","MoKα","","0.0482","0.0316","","","0.0784","0.0846","","","","","","1.021","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077803","9.6998","0.0001","13.1685","0.0003","15.2304","0.0004","106.48","","103.554","0.001","95.821","0.001","1783.87","0.07","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H63 N5 Si3 Zr -","- C26 H63 N5 Si3 Zr -","- C52 H126 N10 Si6 Zr2 -","2","1","","Morton, Colin; Munslow, Ian J.; Sanders, Christopher J.; Alcock, Nathaniel W.; Scott, Peter","Triamidoamine Chemistry of Zirconium","Organometallics","1999","18","22","4608","","10.1021/om990347e","","","0.71073","MoKα","","0.0798","0.045","","0.1082","0.0929","","","","0.907","0.945","0.945","","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077804","12.4097","0.0002","15.6621","0.0001","18.2802","0.0002","90","","92.74","","90","","3548.91","0.07","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H57 Cl N4 Si3 Zr -","- C24 H57 Cl N4 Si3 Zr -","- C96 H228 Cl4 N16 Si12 Zr4 -","4","1","","Morton, Colin; Munslow, Ian J.; Sanders, Christopher J.; Alcock, Nathaniel W.; Scott, Peter","Triamidoamine Chemistry of Zirconium","Organometallics","1999","18","22","4608","","10.1021/om990347e","","","0.71073","MoKα","","0.1065","0.0595","","","0.0935","0.1112","","","","","","1.153","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077805","12.8111","0.0002","13.2448","0.0002","13.2748","0.0002","60.326","0.001","67.912","0.001","86.095","0.001","1793.84","0.05","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C26.5 H56 N4 Si3 Zr -","- C26.5 H56 N4 Si3 Zr -","- C53 H112 N8 Si6 Zr2 -","2","1","","Morton, Colin; Munslow, Ian J.; Sanders, Christopher J.; Alcock, Nathaniel W.; Scott, Peter","Triamidoamine Chemistry of Zirconium","Organometallics","1999","18","22","4608","","10.1021/om990347e","","","0.71073","MoKα","","0.067","0.0527","","","0.1225","0.1377","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077806","18.239","0.006","15.971","0.005","23.062","0.007","90","","90","","90","","6718","4","294","2","294","2","","","","","","","see text","6","P b c a","-P 2ac 2ab","61","","1,1,1-tricarbonyl-1-[2,6-(dimethylphenyl)isocyanide]-2-[2,6-(dimethylphenyl) imino]-3-(p-chlorobenzyl)-4-[2,6-(dimethylphenyl)]-4-azamangancylobut-3-ene","","- C37 H33 Cl Mn N3 O3 -","- C37 H33 Cl Mn N3 O3 -","- C296 H264 Cl8 Mn8 N24 O24 -","8","1","","Becker, Thomas M.; Alexander, John J.; Krause Bauer, Jeanette A.; Nauss, Jeffrey L.; Wireko, Fred C.","CNR and CO Insertion Reactions of 2,6-Xylyl Isocyanide withp-Chlorobenzylpentacarbonylmanganese","Organometallics","1999","18","26","5594","","10.1021/om9903644","","","1.54178","CuKα","","0.2871","0.0882","","","0.1925","0.2975","","","","","","1.198","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077807","10.3169","0.0005","19.6021","0.0008","17.1131","0.0008","90","","99.888","0.001","90","","3409.4","0.3","296","2","296","2","","","","","","","see text","6","P 1 21/n 1","-P 2yn","14","","1,1,1,1-tetracarbonyl-2,3-bis[2,6-(dimethylphenyl)imino]-3-(p-chlorobenzyl) -4-(2,6-dimethylphenyl)-4-azamangancylopent-4-ene","","- C38 H33 Cl Mn N3 O4 -","- C38 H33 Cl Mn N3 O4 -","- C152 H132 Cl4 Mn4 N12 O16 -","4","1","","Becker, Thomas M.; Alexander, John J.; Krause Bauer, Jeanette A.; Nauss, Jeffrey L.; Wireko, Fred C.","CNR and CO Insertion Reactions of 2,6-Xylyl Isocyanide withp-Chlorobenzylpentacarbonylmanganese","Organometallics","1999","18","26","5594","","10.1021/om9903644","","","0.71073","MoKα","","0.1463","0.0543","","0.1269","","0.093","","","","","","1.035","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077808","11.841","0.002","12.16","0.002","15.94","0.003","97.18","0.03","105.32","0.03","98.4","0.03","2157.4","0.8","296","2","296","2","","","","","","","see text","6","P -1","-P 1","2","","tetracarbonyl-{1-[μ-O,O'-(2,6-diphenylmethyl)carbamato]-2-(p-chlorophenyl)} vinylmanganese tetracarbonyl-[1-(2,6-dimethyliminum)-2-(p-chlorobenzyl)]ethyl manganese","","- C41 H30 Cl2 Mn2 N2 O10 -","- C41 H30 Cl2 Mn2 N2 O10 -","- C82 H60 Cl4 Mn4 N4 O20 -","2","1","","Becker, Thomas M.; Alexander, John J.; Krause Bauer, Jeanette A.; Nauss, Jeffrey L.; Wireko, Fred C.","CNR and CO Insertion Reactions of 2,6-Xylyl Isocyanide withp-Chlorobenzylpentacarbonylmanganese","Organometallics","1999","18","26","5594","","10.1021/om9903644","","","1.54184","CuKα","","0.1226","0.0656","","0.1619","","0.1376","","","","","","0.961","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077809","11.637","0.006","18.452","0.002","17.227","0.003","90","","100.72","0.03","90","","3635","2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H26.4 F6 O9.2 P2 Ru S2 -","- C30 H24 F6 O9.2 P2 Ru S2 -","- C120 H96 F24 O36.8 P8 Ru4 S8 -","4","1","","Mahon, Mary F.; Whittlesey, Michael K.; Wood, Paul T.","Synthesis and Structures of Organometallic Aqua Complexes of Ruthenium(II)","Organometallics","1999","18","20","4068","","10.1021/om990411s","","","0.71073","MoKα","","0.0953","0.059","","0.1885","0.1606","","","","0.97","1.118","1.118","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077810","11.719","0.001","23.365","0.003","13.851","0.002","90","","102.54","0.01","90","","3702.1","0.8","198","2","198","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C29 H33.6 F6 O11.8 P2 Ru S2 -","- C29 H30 F6 O11.8 P2 Ru S2 -","- C116 H120 F24 O47.2 P8 Ru4 S8 -","4","1","","Mahon, Mary F.; Whittlesey, Michael K.; Wood, Paul T.","Synthesis and Structures of Organometallic Aqua Complexes of Ruthenium(II)","Organometallics","1999","18","20","4068","","10.1021/om990411s","","","0.71069","MoKα","","0.0369","0.0302","","0.0835","0.0731","","","","0.981","1.018","1.018","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077811","20.543","0.0002","6.1256","0.0002","17.8378","0.0003","90","","97.206","0.001","90","","2226.95","0.08","300","2","300","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C26 H24 Si2 -","- C26 H24 Si2 -","- C104 H96 Si8 -","4","0.5","","Toltl, Nicholas P.; Stradiotto, Mark; Morkin, Tracy L.; Leigh, William J.","Homo- and Cross-[2+2]-Cycloaddition of 1,1-Diphenylsilene and 1,1-Diphenylgermene. Absolute Rate Constants for Dimerization and the Molecular Structures and Photochemistry of the Resulting 1,3-Dimetallacyclobutanes","Organometallics","1999","18","26","5643","","10.1021/om990447k","","","0.71073","MoKα","","0.0573","0.0396","","0.1012","0.0916","","","","1.033","1.077","1.077","","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077812","10.2432","0.0002","10.5455","0.0001","11.3542","0.0001","103.452","0.001","102.52","","93.074","0.001","1157.45","0.03","300","2","300","2","","","","","","","","3","P -1","-P 1","2","","","","- C26 H24 Ge2 -","- C26 H24 Ge2 -","- C52 H48 Ge4 -","2","1","","Toltl, Nicholas P.; Stradiotto, Mark; Morkin, Tracy L.; Leigh, William J.","Homo- and Cross-[2+2]-Cycloaddition of 1,1-Diphenylsilene and 1,1-Diphenylgermene. Absolute Rate Constants for Dimerization and the Molecular Structures and Photochemistry of the Resulting 1,3-Dimetallacyclobutanes","Organometallics","1999","18","26","5643","","10.1021/om990447k","","","0.71073","MoKα","","0.037","0.029","","0.0737","0.0693","","","","1.037","1.07","1.07","","","","","has coordinates","301830","2025-08-20","13:17:25",""
"4077813","6.1718","0.0009","14.406","0.003","25.481","0.004","81.446","0.002","85.695","0.003","88.502","0.003","2233.8","0.7","299","2","299","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H24 Ge Si -","- C26 H24 Ge Si -","- C104 H96 Ge4 Si4 -","4","2","","Toltl, Nicholas P.; Stradiotto, Mark; Morkin, Tracy L.; Leigh, William J.","Homo- and Cross-[2+2]-Cycloaddition of 1,1-Diphenylsilene and 1,1-Diphenylgermene. Absolute Rate Constants for Dimerization and the Molecular Structures and Photochemistry of the Resulting 1,3-Dimetallacyclobutanes","Organometallics","1999","18","26","5643","","10.1021/om990447k","","","0.71073","MoKα","","0.1268","0.045","","0.0938","0.0751","","","","0.84","1.01","1.01","","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077814","31.167","0.002","10.995","0.0006","20.829","0.0012","90","","109.72","0.003","90","","6719.1","0.7","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C50 H92 B20 Na Nd O6 Si2 -","- C50 H92 B20 Na Nd O6 Si2 -","- C200 H368 B80 Na4 Nd4 O24 Si8 -","4","0.5","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Cyclopentadienyl vs Indenyl Substituents. Organolanthanide Complexes and Biscarborane Compounds Derived from a Versatile Ligand, Me2Si(C9H7)(C2B10H11)","Organometallics","1999","18","22","4478","","10.1021/om990453g","","","0.71073","MoKα","","0.0806","0.0799","","","0.2219","0.2226","","","","","","1.035","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077815","25.345","0.0008","12.299","0.0003","17.6292","0.0006","90","","100.52","0.001","90","","5403","0.3","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C38 H69 B20 Cl Er Na O3 Si2 -","- C38 H69 B20 Cl Er Na O3 Si2 -","- C152 H276 B80 Cl4 Er4 Na4 O12 Si8 -","4","1","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Cyclopentadienyl vs Indenyl Substituents. Organolanthanide Complexes and Biscarborane Compounds Derived from a Versatile Ligand, Me2Si(C9H7)(C2B10H11)","Organometallics","1999","18","22","4478","","10.1021/om990453g","","","0.71073","MoKα","","0.0865","0.0771","","0.2084","0.194","","","","1.053","1.06","1.06","","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077816","31.82","0.0014","20.445","0.0008","19.202","0.0008","90","","115.19","0.002","90","","11304.1","0.8","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C92 H156 B20 Er2 Na2 O13 Si4 -","- C92 H156 B20 Er2 Na2 O13 Si4 -","- C368 H624 B80 Er8 Na8 O52 Si16 -","4","0.5","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Cyclopentadienyl vs Indenyl Substituents. Organolanthanide Complexes and Biscarborane Compounds Derived from a Versatile Ligand, Me2Si(C9H7)(C2B10H11)","Organometallics","1999","18","22","4478","","10.1021/om990453g","","","0.71073","MoKα","","0.0716","0.055","","0.1376","0.1291","","","","1.06","1.08","1.08","","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077817","13.108","0.0006","13.844","0.0009","15.449","0.001","93.218","0.002","107.62","0.004","102.27","0.005","2589","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H71 B20 Cl2 Er O6 -","- C28 H67 B20 Cl2 Er O6 -","- C56 H134 B40 Cl4 Er2 O12 -","2","1","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Cyclopentadienyl vs Indenyl Substituents. Organolanthanide Complexes and Biscarborane Compounds Derived from a Versatile Ligand, Me2Si(C9H7)(C2B10H11)","Organometallics","1999","18","22","4478","","10.1021/om990453g","","","0.71073","MoKα","","0.066","0.0589","","0.19","0.1728","","","","1.05","1.055","1.055","","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077818","13.116","0.0012","13.857","0.0012","15.356","0.0015","93.093","0.01","107.58","0.003","102.41","0.009","2577.2","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H63 B20 Cl2 O5 Y -","- C24 H59 B20 Cl2 O5 Y -","- C48 H118 B40 Cl4 O10 Y2 -","2","1","","Wang, Shaowu; Yang, Qingchuan; Mak, Thomas C. W.; Xie, Zuowei","Cyclopentadienyl vs Indenyl Substituents. Organolanthanide Complexes and Biscarborane Compounds Derived from a Versatile Ligand, Me2Si(C9H7)(C2B10H11)","Organometallics","1999","18","22","4478","","10.1021/om990453g","","","0.71073","MoKα","","0.1245","0.1079","","","0.2765","0.299","","","","","","0.991","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077819","10.321","0.002","7.397","0.002","23.885","0.004","90","","99.1","0.02","90","","1800.5","0.7","113","2","113","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dicarbonyl(eta5-cyclopentadienyl)(eta2-propadien)manganese","","- C10 H9 Mn O2 -","- C10 H9 Mn O2 -","- C80 H72 Mn8 O16 -","8","2","","Lentz, Dieter; Willemsen, Stefan","Coordination Chemistry of Fluorinated Allenes","Organometallics","1999","18","20","3962","","10.1021/om9904798","","","0.71069","MoKα","","0.0964","0.0535","","","0.1422","0.1621","","","","","","1.099","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4077820","6.6825","0.0005","8.1776","0.0006","9.0073","0.0014","90.633","0.009","96.43","0.009","104.234","0.007","473.73","0.09","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","Dicarbonyl(eta5-cyclopentadienyl)(eta2-1,1-difluoropropadiene)manganese","","- C10 H7 F2 Mn O2 -","- C10 H7 F2 Mn O2 -","- C20 H14 F4 Mn2 O4 -","2","1","","Lentz, Dieter; Willemsen, Stefan","Coordination Chemistry of Fluorinated Allenes","Organometallics","1999","18","20","3962","","10.1021/om9904798","","","0.71069","MoKα","","0.044","0.0318","","","0.0761","0.0801","","","","","","1.077","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077821","6.6656","0.0008","7.1814","0.0008","11.8028","0.0015","81.32","0.01","84.44","0.01","71.33","0.009","528.41","0.11","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Dicarbonyl(eta5-cyclopentadienyl)(eta2-tetrafluoropropadiene)manganese","","- C10 H5 F4 Mn O2 -","- C10 H5 F4 Mn O2 -","- C20 H10 F8 Mn2 O4 -","2","1","","Lentz, Dieter; Willemsen, Stefan","Coordination Chemistry of Fluorinated Allenes","Organometallics","1999","18","20","3962","","10.1021/om9904798","","","0.71069","MoKα","","0.0433","0.0309","","","0.0816","0.0871","","","","","","1.042","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077822","9.7384","0.0006","13.1535","0.0008","19.0431","0.0012","70.298","0.002","81.523","0.002","68.833","0.002","2140.7","0.2","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H60 Li2 N4 P2 -","- C45 H60 Li2 N4 P2 -","- C90 H120 Li4 N8 P4 -","2","1","","Clegg, William; Izod, Keith; McFarlane, William; O'Shaughnessy, Paul","Regioselective Metalation of a Tertiary Phosphine. Solution and Solid-State Structures of an Unusual Aminobenzyllithium Complex","Organometallics","1999","18","20","3950","","10.1021/om9904910","","","0.71073","MoKα","","0.0958","0.063","","","0.1398","0.1603","","","","","","1.026","","","","has coordinates,has disorder","301830","2025-08-20","13:17:25",""
"4077823","19.4834","0.0025","12.3344","0.001","19.7114","0.0018","90","","115.095","0.008","90","","4289.8","0.8","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C41 H41 B9 Cl O3 P2 Re Ru -","- C41 H41 B9 Cl O3 P2 Re Ru -","- C164 H164 B36 Cl4 O12 P8 Re4 Ru4 -","4","1","","Ellis, Dianne D.; Jelliss, Paul A.; Stone, F. Gordon A.","Studies with the Rhenacarborane Cs[Re(CO)3(η5-7,8-C2B9H11)]: Surprising Reactivity with a Range of Metal Ligand Fragments†","Organometallics","1999","18","24","4982","","10.1021/om9905097","","","0.71073","MoKα","","0.0396","0.0249","","0.0517","0.0479","","","","0.971","1.012","1.012","","","","","has coordinates","296806","2024-12-09","16:06:24",""
"4077824","14.461","0.002","10.38","0.004","14.694","0.002","90","","114.266","0.013","90","","2010.8","0.9","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H16 B9 O5 Re Ru -","- C12 H16 B9 O5 Re Ru -","- C48 H64 B36 O20 Re4 Ru4 -","4","1","","Ellis, Dianne D.; Jelliss, Paul A.; Stone, F. Gordon A.","Studies with the Rhenacarborane Cs[Re(CO)3(η5-7,8-C2B9H11)]: Surprising Reactivity with a Range of Metal Ligand Fragments†","Organometallics","1999","18","24","4982","","10.1021/om9905097","","","0.71073","MoKα","","0.0588","0.0391","","0.091","0.0834","","","","1.076","1.134","1.134","","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077825","9.2246","0.002","13.0494","0.0013","13.5816","0.0016","63.439","0.007","84.281","0.014","70.141","0.012","1372.7","0.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H26 B9 Cu O3 P Re -","- C23 H26 B9 Cu O3 P Re -","- C46 H52 B18 Cu2 O6 P2 Re2 -","2","1","","Ellis, Dianne D.; Jelliss, Paul A.; Stone, F. Gordon A.","Studies with the Rhenacarborane Cs[Re(CO)3(η5-7,8-C2B9H11)]: Surprising Reactivity with a Range of Metal Ligand Fragments†","Organometallics","1999","18","24","4982","","10.1021/om9905097","","","0.71073","MoKα","","0.021","0.0187","","0.0374","0.0371","","","","0.905","0.953","0.953","","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077826","24.581","0.003","8.802","0.002","28.129","0.004","90","","102.19","0.011","90","","5948.8","1.8","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C23.5 H27 Ag B9 Cl O3 P Re -","- C23.5 H27 Ag B9 Cl O3 P Re -","- C188 H216 Ag8 B72 Cl8 O24 P8 Re8 -","8","1","","Ellis, Dianne D.; Jelliss, Paul A.; Stone, F. Gordon A.","Studies with the Rhenacarborane Cs[Re(CO)3(η5-7,8-C2B9H11)]: Surprising Reactivity with a Range of Metal Ligand Fragments†","Organometallics","1999","18","24","4982","","10.1021/om9905097","","","0.71073","MoKα","","0.0841","0.048","","0.0949","0.0827","","","","1.077","1.142","1.142","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4077827","19.007","0.006","10.863","0.005","25.454","0.007","90","","96.15","0.02","90","","5225","3","193","2","193","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C52 H55 B9 Cl P3 Pd -","- C52 H55 B9 Cl P3 Pd -","- C208 H220 B36 Cl4 P12 Pd4 -","4","1","","Viñas, C.; Núñez, R.; Teixidor, F.; Sillanpää, R.; Kivekäs, R.","Formation of B−P Bonds through the Reaction ofnido-Monophosphinocarboranes with Palladium(II) Complexes. The First Example of a Chelating R2P−C−B−PR2Diphosphine","Organometallics","1999","18","23","4712","","10.1021/om990599f","","","0.71069","MoKα","","0.0896","0.0688","","","0.1309","0.1418","","","","","","1.05","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077828","21.575","0.004","14.91","0.003","12.837","0.003","90","","118.09","0.03","90","","3643","1.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(ν^5^-Cyclopentadienyl)(dicarbonyl)-[(3,4,5-ν)-2-anti-(3-cyanoindol-1-yl)- 5,6-dihydro-2H-pyran-5-yl]molybdenum","","- C21 H16 Mo N2 O3 -","- C21 H16 Mo N2 O3 -","- C168 H128 Mo8 N16 O24 -","8","1","","Bjurling, Emelie; Johansson, Maria H.; Andersson, Carl-Magnus","Synthesis ofN-(2-Pyranyl)- andN-Cyclohexylindole Derivatives via Stereoselective Addition of Indole Nucleophiles to Organomolybdenum Complexes","Organometallics","1999","18","26","5606","","10.1021/om9906060","","","0.71073","MoKα","","0.0508","0.0303","","","0.073","0.0785","","","","","","0.989","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077829","17.593","0.002","11.6592","0.0007","12.979","0.001","90","","90","","90","","2662.3","0.4","173","2","173","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C26 H36 O2 Rh2 S2 Ti -","- C26 H36 O2 Rh2 S2 Ti -","- C104 H144 O8 Rh8 S8 Ti4 -","4","0.5","","Casado, Miguel A.; Pérez-Torrente, Jesús J.; Ciriano, Miguel A.; Edwards, Andrew J.; Lahoz, Fernando J.; Oro, Luis A.","Deprotonation of Cp2Ti(SH)2with Mononuclear Rhodium and Iridium Compounds: A New Route to Trinuclear Early−Late Heterobimetallic Complexes","Organometallics","1999","18","25","5299","","10.1021/om990623p","","","0.71073","MoKα","","0.0271","0.023","","0.062","","0.0588","","","1.078","","","1.08","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077830","9.379","0.003","14.912","0.008","18.946","0.005","90","","93.39","0.07","90","","2645.1","1.8","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H17 Ir3 O8 S2 Ti -","- C21 H17 Ir3 O8 S2 Ti -","- C84 H68 Ir12 O32 S8 Ti4 -","4","1","","Casado, Miguel A.; Pérez-Torrente, Jesús J.; Ciriano, Miguel A.; Edwards, Andrew J.; Lahoz, Fernando J.; Oro, Luis A.","Deprotonation of Cp2Ti(SH)2with Mononuclear Rhodium and Iridium Compounds: A New Route to Trinuclear Early−Late Heterobimetallic Complexes","Organometallics","1999","18","25","5299","","10.1021/om990623p","","","0.71073","MoKα","","0.0645","0.0346","","0.0679","","0.0582","","","1.046","","","1.068","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077831","11.5987","0.0014","12.603","0.002","15.517","0.002","67.733","0.008","82.646","0.009","86.304","0.01","2081.5","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","(dfepe)2Ir2(u,n1,n3-C4H6)(H)(u-H)","","","- C24 H14 F40 Ir2 P4 -","- C24 H14 F40 Ir2 P4 -","- C48 H28 F80 Ir4 P8 -","2","1","","Hoerter, Justin M.; Schnabel, R. Chris; Goodson, Patricia A.; Roddick, Dean M.","The Fate of a Bimetallic Ethylene Dimerization Catalyst: Synthesis and Structure of (dfepe)2Ir2(μ-η1:η3-C4H6)(μ-H)(H) (dfepe = (C2F5)2PCH2CH2P(C2F5)2)","Organometallics","1999","18","26","5717","","10.1021/om990659h","","","0.71073","MoKα","","0.0461","0.041","","0.1243","0.1177","","","","1.032","1.047","1.047","","","","","has coordinates,has disorder","178667","2020-10-21","18:00:00",""
"4077832","18.88","0.002","11.94","0.002","19.253","0.002","90","","103.259","0.011","90","","4224.5","1","143","2","143","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H60 N4 O Zr -","- C50 H60 N4 O Zr -","- C200 H240 N16 O4 Zr4 -","4","1","","Bonomo, Lucia; Toraman, Gülsen; Solari, Euro; Scopelliti, Rosario; Floriani, Carlo","Porphodimethene−Zirconium: A New Entry into Zirconium Macrocycle Organometallic Chemistry","Organometallics","1999","18","25","5198","","10.1021/om990688s","","","0.71073","MoKα","","0.1993","0.0819","","","0.1704","0.234","","","","","","1.063","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4077833","9.1942","0.0008","10.9092","0.0018","17.887","0.003","89.771","0.014","87.736","0.012","71.089","0.013","1695.9","0.4","143","2","143","2","","","","","","","","4","P -1","-P 1","2","","","","- C39 H53 N5 Zr -","- C39 H53 N5 Zr -","- C78 H106 N10 Zr2 -","2","1","","Bonomo, Lucia; Toraman, Gülsen; Solari, Euro; Scopelliti, Rosario; Floriani, Carlo","Porphodimethene−Zirconium: A New Entry into Zirconium Macrocycle Organometallic Chemistry","Organometallics","1999","18","25","5198","","10.1021/om990688s","","","0.71073","MoKα","","0.0813","0.072","","","0.1399","0.1451","","","","","","1.167","","","","has coordinates","178667","2020-10-21","18:00:00",""
"4086031","8.3068","","22.468","","8.883","","90","","96.531","","90","","1647.14","","","","","","","","","","","","","4","P 1 n 1","P -2yac","7","","Fe2 Ru (C O)12","","- C12 Fe2 O11 Ru -","- C12 Fe2 O11 Ru -","- C48 Fe8 O44 Ru4 -","4","2","","Farrugia, L.J.; Gillon, A.L.; Braga, D.; Grepioni, F.","Dynamic disorder and fluxionality in M3 (C O)12 clusters: variable-temperature X-ray diffraction studies on Fen Ru3-n (C O)12 (n = 1,2) and the low-temperature phase of Fe3 (C O)12","Organometallics","1999","18","","5022","5033","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4086032","8.4","","11.42","","8.943","","90","","96.84","","90","","851.778","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Fe2 Ru (C O)12","","- C12 Fe2 O12 Ru -","- C12 Fe2 O12 Ru -","- C24 Fe4 O24 Ru2 -","2","0.5","","Farrugia, L.J.; Gillon, A.L.; Braga, D.; Grepioni, F.","Dynamic disorder and fluxionality in M3 (C O)12 clusters: variable-temperature X-ray diffraction studies on Fen Ru3-n (C O)12(n = 1,2) and the low-temperature phase of Fe3 (C O)12","Organometallics","1999","18","","5022","5033","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4086033","22.639","","12.8789","","11.6326","","90","","90","","90","","3391.66","","","","","","","","","","","","","4","A b a 2","A 2 -2ab","41","","Fe (Ru2 (C O)12)","","- C12 Fe O12 Ru2 -","- C12 Fe O12 Ru2 -","- C96 Fe8 O96 Ru16 -","8","","","Farrugia, L.J.; Grepioni, F.; Gillon, A.L.; Braga, D.","Dynamic disorder and fluxionality in M3 (C O)12 clusters: variable-temperature X-ray diffraction studies on Fen Ru3-n (C O)12 (n = 1,2) and the low-temperature phase of Fe3 (C O)12","Organometallics","1999","18","","5022","5033","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4086034","11.65","","13.0643","","11.4808","","90","","90","","90","","1747.37","","","","","","","","","","","","","4","C c m b","-C 2ac 2ac","64","","Fe Ru2 (C O)12","","- C12 Fe O12 Ru2 -","- C12 Fe0.9998 O12 Ru1.9996 -","- C48 Fe3.9992 O48 Ru7.9984 -","4","","","Farrugia, L.J.; Grepioni, F.; Gillon, A.L.; Braga, D.","Dynamic disorder and fluxionality in M3 (C O)12 clusters: variable-temperature X-ray diffraction studies on Fen Ru3-n (C O)12(n = 1,2) and the low-temperature phase of Fe3 (C O)12","Organometallics","1999","18","","5022","5033","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4086062","8.3741","","22.711","","8.9331","","90","","96.682","","90","","1687.39","","","","","","","","","","","","","4","P 1 n 1","P -2yac","7","","Fe2 Ru (C O)12","","- C12 Fe2 O8 Ru -","- C12 Fe2 O8 Ru -","- C48 Fe8 O32 Ru4 -","4","2","","Farrugia, L.J.; Gillon, A.L.; Braga, D.; Grepioni, F.","Dynamic disorder and fluxionality in M3 (C O)12 clusters: variable-temperature X-ray diffraction studies on Fen Ru3-n (C O)12(n = 1,2) and the low-temperature phase of Fe3 (C O)12","Organometallics","1999","18","","5022","5033","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4086063","19.52","","33.408","","11.261","","90","","102.95","","90","","7156.79","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Fe3 (C O)12","","- C4.88889 Fe1.21467 O5.33333 -","- C4.88889 Fe1.21467 O5.33333 -","- C88 Fe21.864 O96 -","18","4.5","","Farrugia, L.J.; Gillon, A.L.; Grepioni, F.; Braga, D.","Dynamic disorder and fluxionality in M3 (C O)12 clusters: variable-temperature X-ray diffraction studies on Fen Ru3-n (C O)12(n = 1,2) and the low-temperature phase of Fe3 (C O)12","Organometallics","1999","18","","5022","5033","","","","","","","","","","","","","","","","","","","","","","has coordinates","145084","2020-10-21","18:00:00",""
"4089712","9.8267","0.0013","14.397","0.001","20.126","0.003","90","","90.13","0.01","90","","2847.3","0.6","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C62 H52 Cl2 Fe N2 P2 Pd2 -","- C62 H52 Cl2 Fe N2 P2 Pd2 -","- C124 H104 Cl4 Fe2 N4 P4 Pd4 -","2","0.5","","Bosque, Ramon; López, Concepción; Solans, Xavier; Font-Bardia, Mercè","Heterodi- and Heterotrimetallic Compounds Containing Five-Membered Rings and σ(Pd−Csp2,ferrocene) Bonds. X-ray Crystal Structure of themeso-Form of [Pd2{Fe[(η5-C5H3)−C(CH3)N−C6H5]}2Cl2(PPh3)2]","Organometallics","1999","18","7","1267","","10.1021/om980834e","","","0.71069","MoKα","","0.0656","0.0548","","0.152","0.1374","","","","1.05","1.067","1.067","","","","","has coordinates","243727","2020-10-21","18:00:00",""
"4116275","8.1922","0.0006","20.794","0.001","21.859","0.002","90","","98.922","0.001","90","","3678.6","0.5","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35.5 H5 B Cl Ir N6 O2 -","- C35.5 H45 B Cl Ir N6 O2 -","- C142 H180 B4 Cl4 Ir4 N24 O8 -","4","1","","Enrique Gutiérrez-Puebla; Angeles Monge; Margarita Paneque; Manuel L. Poveda; Verónica Salazar; Ernesto Carmona","Activation of Aldehydes by the Ir-2,3-Dimethylbutadiene Complex TpMe2Ir(CH2C(Me)C(Me)CH2)","Journal of the American Chemical Society","1999","121","","248","249","10.1021/ja9819357","","","0.71073","MoKα","","0.0609","0.0568","","0.1706","0.1658","","","","1.01","1.023","1.023","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116276","15.2024","0.0002","24.4219","0.0001","17.1093","0.0002","90","","96.844","0.001","90","","6306.93","0.11","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C69 H60 N16 Ni4 -","- C69 H60 N16 Ni4 -","- C276 H240 N64 Ni16 -","4","1","","Shie-Yang Lai; Tzu-Wei Lin; Yu-Hua Chen; Chih-Chieh Wang; Gene-Hsiang Lee; Ming-hwa Yang; Man-kit Leung; Shie-Ming Peng","Metal String Complexes: Synthesis and Crystal Structure of [Ni4(μ4-phdpda)4] and [Ni7(μ7-teptra)4Cl2] (H2phdpda = N-Phenyldipyridyldiamine and H3teptra = Tetrapyridyltriamine)","Journal of the American Chemical Society","1999","121","","250","251","10.1021/ja982065w","","","0.71073","MoKα","","0.0886","0.0477","","0.1421","0.1213","","","","1.012","1.099","1.099","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116277","19.7542","0.0007","16.9432","0.0005","28.5946","0.0009","90","","95.868","0.001","90","","9520.4","0.5","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C83 H59 Cl11 N28 Ni7 -","- C83 H59 Cl11 N28 Ni7 -","- C332 H236 Cl44 N112 Ni28 -","4","1","","Shie-Yang Lai; Tzu-Wei Lin; Yu-Hua Chen; Chih-Chieh Wang; Gene-Hsiang Lee; Ming-hwa Yang; Man-kit Leung; Shie-Ming Peng","Metal String Complexes: Synthesis and Crystal Structure of [Ni4(μ4-phdpda)4] and [Ni7(μ7-teptra)4Cl2] (H2phdpda = N-Phenyldipyridyldiamine and H3teptra = Tetrapyridyltriamine)","Journal of the American Chemical Society","1999","121","","250","251","10.1021/ja982065w","","","0.71073","MoKα","","0.1506","0.0824","","0.302","0.246","","","","1.072","1.215","1.215","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116278","12.3729","0.0004","12.3729","0.0004","12.3729","0.0004","79.96","","79.96","","79.96","","1816.23","0.1","223","2","223","2","","","","","","","","5","R -3 :R","-P 3*","148","","methylviologen lead(II) iodide","","- C12 H14 I6 N2 Pb2 -","- C12 H14 I6 N2 Pb2 -","- C36 H42 I18 N6 Pb6 -","3","0.5","","Zhongjia Tang; Arnold M. Guloy","A Methylviologen Lead(II) Iodide: Novel [PbI3-]∞Chains with Mixed Octahedral and Trigonal Prismatic Coordination","Journal of the American Chemical Society","1999","121","","452","453","10.1021/ja982702i","","","0.71073","MoKα","","0.0427","0.0377","","0.0988","0.0951","","","","1.174","1.185","1.185","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116279","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; Antonio Mezzetti","Dioxygen Activation at [OsCl(dcpe)2]+ Gives [OsCl(O)(dcpe)2]+, the First Stable Oxo Complex of Osmium(IV)","Journal of the American Chemical Society","1999","121","","480","481","10.1021/ja982736q","","","0.71073","MoKα","","0.1163","0.0462","","0.1148","0.0904","","","","0.979","1.067","1.067","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116280","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; Antonio Mezzetti","Dioxygen Activation at [OsCl(dcpe)2]+ Gives [OsCl(O)(dcpe)2]+, the First Stable Oxo Complex of Osmium(IV)","Journal of the American Chemical Society","1999","121","","480","481","10.1021/ja982736q","","","0.71073","MoKα","","0.0869","0.046","","0.1181","0.0999","","","","0.973","1.044","1.044","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116281","12.859","0.001","4.999","0.004","19.429","0.005","90","","104.12","0.03","90","","1211.2","1","150","0.1","150","0.1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H22 O2 -","- C12 H22 O2 -","- C48 H88 O8 -","4","1","","Robert A. Batey; Avinash N. Thadani; Alan J. Lough","Alkenylboronate Tethered Intramolecular Diels-Alder Reactions","Journal of the American Chemical Society","1999","121","","450","451","10.1021/ja9828004","","","0.71073","MoKα","","0.0998","0.0492","","","0.1151","0.1269","","","","","","0.895","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116282","11.267","0.001","5.48","0.001","19.522","0.001","90","","94.15","0.03","90","","1202.2","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 O2 -","- C14 H18 O2 -","- C56 H72 O8 -","4","1","","Robert A. Batey; Avinash N. Thadani; Alan J. Lough","Alkenylboronate Tethered Intramolecular Diels-Alder Reactions","Journal of the American Chemical Society","1999","121","","450","451","10.1021/ja9828004","","","0.71073","MoKα","","0.0698","0.0542","","","0.1513","0.1643","","","","","","1.047","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116283","10.079","0.001","11.954","0.001","13.802","0.001","70.43","0.01","80.85","0.01","83.42","0.01","1543.6","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H24 O2 -","- C18 H24 O2 -","- C72 H96 O8 -","4","2","","Robert A. Batey; Avinash N. Thadani; Alan J. Lough","Alkenylboronate Tethered Intramolecular Diels-Alder Reactions","Journal of the American Chemical Society","1999","121","","450","451","10.1021/ja9828004","","","0.71073","MoKα","","0.0531","0.0442","","","0.1129","0.12","","","","","","1.061","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116284","10.3504","0.0004","10.9465","0.0003","10.9959","0.0004","90","","113.698","0.002","90","","1140.79","0.07","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H19 B O2 -","- C11 H19 B O2 -","- C44 H76 B4 O8 -","4","1","","Robert A. Batey; Avinash N. Thadani; Alan J. Lough","Alkenylboronate Tethered Intramolecular Diels-Alder Reactions","Journal of the American Chemical Society","1999","121","","450","451","10.1021/ja9828004","","","0.71073","MoKα","","0.0719","0.0503","","","0.1446","0.1574","","","","","","1.093","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116285","6.1603","0.00001","7.2903","0.0002","15.9207","0.0001","95.679","0.001","95.058","0.001","96.741","0.001","702.97","0.02","173","2","173","2","","","","","","","C. Evans / Prof. M. Ward","5","P -1","-P 1","2","guanidinium azobenzene-4,4'-disulfonate . 1,4-divinylbenzene","","","- C24 H30 N8 O6 S2 -","- C24 H30 N8 O6 S2 -","- C24 H30 N8 O6 S2 -","1","0.5","","Cara C. Evans; Lisa Sukarto; Michael D. Ward","Sterically Controlled Architectural Reversion in Hydrogen-Bonded Crystalline Clathrates","Journal of the American Chemical Society","1999","121","","320","325","10.1021/ja983122o","","","0.71073","MoKα","","0.0485","0.04","","0.1053","0.0989","","","","1.054","1.067","1.067","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116286","7.1781","0.0003","7.3188","0.0004","16.7531","0.0007","89.185","0.002","89.696","0.002","62.094","0.001","777.7","0.06","173","2","173","2","","","","","","","C. Evans / Prof. M. Ward","5","P -1","-P 1","2","guanidinium azobenzene-4,4'-disulfonate . nitrobenzene","","","- C14 H20 N8 O6 S2 -","- C14 H20 N8 O6 S2 -","- C14 H20 N8 O6 S2 -","1","0.5","","Cara C. Evans; Lisa Sukarto; Michael D. Ward","Sterically Controlled Architectural Reversion in Hydrogen-Bonded Crystalline Clathrates","Journal of the American Chemical Society","1999","121","","320","325","10.1021/ja983122o","","","0.71073","MoKα","","0.0841","0.0673","","0.2125","0.2","","","","1.122","1.259","1.259","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116287","6.1845","0.0001","7.2317","0.0002","15.5039","0.0002","94.232","0.001","99.868","0.001","90.512","0.001","681.12","0.02","173","2","173","2","","","","","","","C. Evans / Prof. M. Ward","6","P -1","-P 1","2","guanidinium azobenzene-4,4'-disulfonate . 1,4-dibromobenzene","","","- C20 H24 Br2 N8 O6 S2 -","- C20 H24 Br2 N8 O6 S2 -","- C20 H24 Br2 N8 O6 S2 -","1","0.5","","Cara C. Evans; Lisa Sukarto; Michael D. Ward","Sterically Controlled Architectural Reversion in Hydrogen-Bonded Crystalline Clathrates","Journal of the American Chemical Society","1999","121","","320","325","10.1021/ja983122o","","","0.71073","MoKα","","0.0818","0.0643","","0.1684","0.1593","","","","1.091","1.171","1.171","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116288","11.873","0.004","9.556","0.004","14.089","0.003","90","","92.13","0.02","90","","1597.4","0.9","296.2","","296.2","","","","","","","","prepared by T. Mitsudo et al.","5","P 1 21/n 1","-P 2yn","14","[Cp*RuCl(SPh)]2","","","- C32 H40 Cl2 Ru2 S2 -","- C64 H80 Cl4 Ru4 S4 -","- C128 H160 Cl8 Ru8 S8 -","2","0.5","","Teruyuki Kondo; Shin-ya Uenoyama; Ken-ichi Fujita; Take-aki Mitsudo","First Transition-Metal Complex Catalyzed Addition of Organic Disulfides to Alkenes Enables the Rapid Synthesis of vicinal-Dithioethers","Journal of the American Chemical Society","1999","121","","482","483","10.1021/ja983497+","","","0.7107","MoKα","","0.0428","0.0428","","","0.0459","0.0459","","","","","","1.041","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4116289","22.72","0.02","22.72","0.02","13.54","0.01","90","","90","","90","","6989","10","153.2","","153.2","","","","","","","","","6","I -4","I -4","82","","","","- C52 H32 Cl4 N8 O12 Re4 -","- C58 H32 Cl4 N8 O14 Re4 -","- C232 H128 Cl16 N32 O56 Re16 -","4","0.5","","Suzanne Bélanger; Joseph T. Hupp; Charlotte L. Stern; Robert V. Slone; David F. Watson; Thomas G. Carrell","Thin-Film Molecular Materials Based on Tetrametallic ""Squares"": Nanoscale Porosity and Size-Selective Guest Transport Characteristics","Journal of the American Chemical Society","1999","121","","557","563","10.1021/ja9829867","","","0.7107","MoKα","","0.1322","0.0587","","0.0656","0.0595","","","","1.822","2.063","2.063","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116290","16.347","0.003","18.661","0.004","6.621","0.001","98.4","0.02","96.53","0.02","112.44","0.01","1814.8","0.6","293.2","","293.2","","","","","","","","electrochemical oxidation","7","P -1","-P 1","2","lambda-(BETS)2GaBr2.0Cl2.0","","","- C20 H16 Br2 Cl2 Ga S8 Se8 -","- C20 H16 Cl6.123 Ga S8 Se8 -","- C40 H32 Cl12.246 Ga2 S16 Se16 -","2","1","","Hisashi Tanaka; Akiko Kobayashi; Akane Sato; Hiroki Akutsu; Hayao Kobayashi","Chemical Control of Electrical Properties and Phase Diagram of a Series of λ-Type BETS Superconductors, λ-(BETS)2GaBrxCl4-x","Journal of the American Chemical Society","1999","121","","760","768","10.1021/ja9827806","","","0.7107","MoKα","","","0.0439","","","0.0279","","","","","1.764","1.764","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116291","16","0.01","18.42","0.01","6.535","0.005","98.79","0.05","95.49","0.07","112.1","0.04","1739","2","7.2","","7.2","","","","","","","","electrochemical oxidation","7","P -1","-P 1","2","lambda-(BETS)2GaBr1.3Cl2.7-7K","","","- C20 H16 Br1.3 Cl2.7 Ga S8 Se8 -","- C20 H16 Cl5.47 Ga S8 Se8 -","- C40 H32 Cl10.94 Ga2 S16 Se16 -","2","1","","Hisashi Tanaka; Akiko Kobayashi; Akane Sato; Hiroki Akutsu; Hayao Kobayashi","Chemical Control of Electrical Properties and Phase Diagram of a Series of λ-Type BETS Superconductors, λ-(BETS)2GaBrxCl4-x","Journal of the American Chemical Society","1999","121","","760","768","10.1021/ja9827806","","","0.7107","MoKα","","","0.0608","","","0.0843","","","","","4.956","4.956","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116292","15.906","0.004","18.43","0.005","6.536","0.002","98.6","0.02","95.81","0.03","111.99","0.02","1730.6","0.9","7.2","","7.2","","","","","","","","electrochemical oxidation","7","P -1","-P 1","2","lambda-(BETS)2GaBr0.3Cl3.3-7K","","","- C20 H16 Br0.3 Cl3.7 Ga S8 Se8 -","- C20 H16 Cl4.57 Ga S8 Se8 -","- C40 H32 Cl9.14 Ga2 S16 Se16 -","2","1","","Hisashi Tanaka; Akiko Kobayashi; Akane Sato; Hiroki Akutsu; Hayao Kobayashi","Chemical Control of Electrical Properties and Phase Diagram of a Series of λ-Type BETS Superconductors, λ-(BETS)2GaBrxCl4-x","Journal of the American Chemical Society","1999","121","","760","768","10.1021/ja9827806","","","0.7107","MoKα","","","0.0663","","","0.0783","","","","","3.594","3.594","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116293","19.9721","0.0005","7.0005","0.0001","19.5456","0.0005","90","","104.013","0.001","90","","2651.44","0.1","298","2","298","2","","","","","","","chemical synthesis","2","P 1 21/c 1","-P 2ybc","14","Hexabenzotriphenylene","Dibenzo[f,j]phenanthro[9,10-s]picene","","- C42 H24 -","- C42 H24 -","- C168 H96 -","4","1","","Lisa Barnett; Douglas M. Ho; Kim K. Baldridge; Robert A. Pascal","The Structure of Hexabenzotriphenylene and the Problem of Overcrowded ""D3h"" Polycyclic Aromatic Compounds","Journal of the American Chemical Society","1999","121","","727","733","10.1021/ja983471i","","","0.71074","MoKα","","0.1007","0.0512","","0.1327","0.1091","","","","1.013","1.095","1.095","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116294","6.6749","0.0016","11.7178","0.0014","8.6148","0.0014","90","","103.297","0.016","90","","655.7","0.2","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C4 N5 S3 -","- C4 N5 S3 -","- C16 N20 S12 -","4","1","","T. M. Barclay; A. W. Cordes; R. C. Haddon; M. E. Itkis; R. T. Oakley; R. W. Reed; H. Zhang","Preparation and Characterization of a Neutral π-Radical Molecular Conductor","Journal of the American Chemical Society","1999","121","","969","976","10.1021/ja983490s","","","0.7107","MolybdenumKα","","0.037","","","0.05","","","","","","1.25","1.25","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116295","8.699","0.0011","6.8203","0.0017","9.4167","0.001","90","","111.261","0.009","90","","520.67","0.16","293","","293","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C4 Cl3 N5 S3 -","- C4 Cl3 N5 S3 -","- C8 Cl6 N10 S6 -","2","0.5","","T. M. Barclay; A. W. Cordes; R. C. Haddon; M. E. Itkis; R. T. Oakley; R. W. Reed; H. Zhang","Preparation and Characterization of a Neutral π-Radical Molecular Conductor","Journal of the American Chemical Society","1999","121","","969","976","10.1021/ja983490s","","","0.7107","MolybdenumKα","","0.032","","","0.036","","","","","","1.21","1.21","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116296","12.221","0.008","11.052","0.007","18.194","0.009","90","","97.12","0.03","90","","2438","3","298.2","","298.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C16 H27 Br Cl2 N4 O10 Zn -","- C16 H27 Br Cl2 N4 O10 Zn -","- C64 H108 Br4 Cl8 N16 O40 Zn4 -","4","1","","Eiichi Kimura; Teruhiro Gotoh; Tohru Koike; Motoo Shiro","Dynamic Enolate Recognition in Aqueous Solution by Zinc(II) in a Phenacyl-Pendant Cyclen Complex: Implications for the Role of Zinc(II) in Class II Aldolases","Journal of the American Chemical Society","1999","121","","1267","1274","10.1021/ja982904e","","","0.7107","MoKα","","","0.041","","","0.0461","","","","","1.181","1.181","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116297","11.372","0.002","14.061","0.003","15.233","0.003","90","","103.12","0.03","90","","2372.2","0.9","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1,2-{(C5Me5)Ru}2B3H9","","- C20 H39 B3 Ru2 -","- C20 H30 B3 Ru2 -","- C80 H120 B12 Ru8 -","4","0.5","","Xinjian Lei; Maoyu Shang; Thomas P. Fehlner","Chemistry of Dimetallaboranes Derived from the Reaction of [Cp*MCl2]2 with Monoboranes (M = Ru, Rh; Cp* = η5-C5Me5)","Journal of the American Chemical Society","1999","121","","1275","1287","10.1021/ja982954j","","","0.71073","MoKα","","0.0736","0.0657","","","0.1804","0.1885","","","","","","1.093","","","","has coordinates,has disorder","178933","2020-10-21","18:00:00",""
"4116298","34.003","0.003","34.003","0.003","8.3206","0.0011","90","","90","","90","","9620.3","1.7","293","2","293","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","{(C5Me5)Ru}2B4H10","","- C20 H40 B4 Ru2 -","- C20 H40 B4 Ru2 -","- C320 H640 B64 Ru32 -","16","1","","Xinjian Lei; Maoyu Shang; Thomas P. Fehlner","Chemistry of Dimetallaboranes Derived from the Reaction of [Cp*MCl2]2 with Monoboranes (M = Ru, Rh; Cp* = η5-C5Me5)","Journal of the American Chemical Society","1999","121","","1275","1287","10.1021/ja982954j","","","0.71073","MoKα","","0.0364","0.0278","","0.0879","0.0658","","","","1.067","1.006","1.006","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116299","8.532","0.003","38.001","0.004","9.327","0.003","90","","116.68","0.03","90","","2702.1","1.5","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","1-(Cp*Ru)-2-(Cp*RuCO)-3-Co(CO)2-(mu-CO)B3H6","","- C24 H36 B3 Co O4 Ru2 -","- C24 H36 B3 Co O4 Ru2 -","- C96 H144 B12 Co4 O16 Ru8 -","4","1","","Xinjian Lei; Maoyu Shang; Thomas P. Fehlner","Chemistry of Dimetallaboranes Derived from the Reaction of [Cp*MCl2]2 with Monoboranes (M = Ru, Rh; Cp* = η5-C5Me5)","Journal of the American Chemical Society","1999","121","","1275","1287","10.1021/ja982954j","","","0.71073","MoKα","","0.0653","0.0644","","0.1768","0.1759","","","","1.082","1.085","1.085","","","","","has coordinates","178933","2020-10-21","18:00:00",""
"4116300","8.7431","0.0015","8.901","0.0015","16.019","0.003","105.446","0.012","103.633","0.014","90.769","0.013","1163.9","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","2,3-{Cp*Ru}2B4H8","","- C20 H38 B4 Ru2 -","- C20 H38 B4 Ru2 -","- C40 H76 B8 Ru4 -","2","1","","Xinjian Lei; Maoyu Shang; Thomas P. Fehlner","Chemistry of Dimetallaboranes Derived from the Reaction of [Cp*MCl2]2 with Monoboranes (M = Ru, Rh; Cp* = η5-C5Me5)","Journal of the American Chemical Society","1999","121","","1275","1287","10.1021/ja982954j","","","0.71073","MoKα","","0.0349","0.0321","","0.0864","0.0836","","","","1.125","1.164","1.164","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116301","9.241","0.003","15.112","0.003","20.047","0.003","90","","99.944","0.01","90","","2757.5","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","{Cp*Ru}2{Fe(CO)3}(mu-CO)B4H4","","- C24 H34 B4 Fe O4 Ru2 -","- C24 H34 B4 Fe O4 Ru2 -","- C96 H136 B16 Fe4 O16 Ru8 -","4","1","","Xinjian Lei; Maoyu Shang; Thomas P. Fehlner","Chemistry of Dimetallaboranes Derived from the Reaction of [Cp*MCl2]2 with Monoboranes (M = Ru, Rh; Cp* = η5-C5Me5)","Journal of the American Chemical Society","1999","121","","1275","1287","10.1021/ja982954j","","","0.71073","MoKα","","0.0363","0.0323","","0.0912","0.0866","","","","1.108","1.11","1.11","","","","","has coordinates,has disorder","178934","2020-10-21","18:00:00",""
"4116302","15.2677","0.0014","8.7342","0.0011","17.324","0.002","90","","103.572","0.009","90","","2245.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","{2,3-(Cp*Rh)2}B3H7","","- C20 H37 B3 Rh2 -","- C20 H37 B3 Rh2 -","- C80 H148 B12 Rh8 -","4","1","","Xinjian Lei; Maoyu Shang; Thomas P. Fehlner","Chemistry of Dimetallaboranes Derived from the Reaction of [Cp*MCl2]2 with Monoboranes (M = Ru, Rh; Cp* = η5-C5Me5)","Journal of the American Chemical Society","1999","121","","1275","1287","10.1021/ja982954j","","","0.71073","MoKα","","0.0298","0.0266","","0.0739","0.0713","","","","1.105","1.116","1.116","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116303","9.476","0.003","22.133","0.008","15.815","0.005","90","","91.75","0.03","90","","3315.4","1.9","128","5","293","2","","","","","","","synthesis","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H55 O Si2 Y -","- C31 H55 O Si2 Y -","- C124 H220 O4 Si8 Y4 -","4","1","","Wim T. Klooster; Lee Brammer; Colin J. Schaverien; Peter H. M. Budzelaar","C-H Bonds Are Not Elongated by Coordination to Lanthanide Metals: Single-Crystal Neutron Diffraction Structures of (C5Me5)Y(OC6H3tBu2)CH(SiMe3)2 at 20 K and (C5Me5)La{CH(SiMe3)2}2 at 15 K","Journal of the American Chemical Society","1999","121","","1381","1382","10.1021/ja983068b","","","0.71073","MoKα","","0.1329","0.0695","","0.2285","0.1548","","","","0.993","1.042","1.042","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116304","9.393","0.001","22.099","0.004","15.768","0.003","90","","92.52","0.01","90","","3269.9","0.9","20","0.5","20","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H55 O Si2 Y -","- C31 H55 O Si2 Y -","- C124 H220 O4 Si8 Y4 -","4","1","","Wim T. Klooster; Lee Brammer; Colin J. Schaverien; Peter H. M. Budzelaar","C-H Bonds Are Not Elongated by Coordination to Lanthanide Metals: Single-Crystal Neutron Diffraction Structures of (C5Me5)Y(OC6H3tBu2)CH(SiMe3)2 at 20 K and (C5Me5)La{CH(SiMe3)2}2 at 15 K","Journal of the American Chemical Society","1999","121","","1381","1382","10.1021/ja983068b","","neutron","1.15863","neutron","","0.164","0.164","","0.112","0.112","","","","1.064","1.064","1.064","","","","","has coordinates","282086","2023-03-28","13:50:54",""
"4116305","18.458","0.005","18.458","0.005","15.936","0.005","90","","90","","120","","4702","2","15","0.5","15","","","","","","","","","4","P 63","P 6c","173","","","","- C24 H53 La Si4 -","- C24 H53 La Si4 -","- C144 H318 La6 Si24 -","6","1","","Wim T. Klooster; Lee Brammer; Colin J. Schaverien; Peter H. M. Budzelaar","C-H Bonds Are Not Elongated by Coordination to Lanthanide Metals: Single-Crystal Neutron Diffraction Structures of (C5Me5)Y(OC6H3tBu2)CH(SiMe3)2 at 20 K and (C5Me5)La{CH(SiMe3)2}2 at 15 K","Journal of the American Chemical Society","1999","121","","1381","1382","10.1021/ja983068b","","neutron","1.15863","neutron","","0.221","0.221","","0.101","0.101","","","","1.289","1.289","1.289","","","","","has coordinates","282086","2023-03-28","13:50:54",""
"4116306","20.488","0.004","17.89","0.004","25.116","0.005","90","","90","","90","","9206","3","293","2","293","2","","","","","","","","10","P n a 21","P 2c -2n","33","","","","- C81 H114 Cl2 Cr F6 Fe2 N6 O9 P S6 -","- C81 H114 Cl2 Cr F6 Fe2 N6 O9 P S6 -","- C324 H456 Cl8 Cr4 F24 Fe8 N24 O36 P4 S24 -","4","1","","Thorsten Glaser; Thomas Beissel; Eckhard Bill; Thomas Weyhermüller; Volker Schünemann; Wolfram Meyer-Klaucke; Alfred X. Trautwein; Karl Wieghardt","Electronic Structure of Linear Thiophenolate-Bridged Heterotrinuclear Complexes [LFeMFeL]n+ (M = Cr, Co, Fe; n= 1-3): Localized vs Delocalized Models","Journal of the American Chemical Society","1999","121","","2193","2208","10.1021/ja982898m","","","0.71073","MoKα","","0.1216","0.0631","","0.2147","0.1671","","","","0.987","1.065","1.065","","","","","has coordinates,has disorder","301833","2025-08-20","15:22:59",""
"4116307","13.173","0.003","13.453","0.003","15.675","0.004","104.1","0.03","99.5","0.03","90.74","0.03","2653.1","1.2","100","2","100","2","","","","","","","","9","P -1","-P 1","2","","","","- C96 H138 Co F18 Fe2 N12 O2 P3 S6 -","- C96 H120 Co F18 Fe2 N12 O2 P3 S6 -","- C96 H120 Co F18 Fe2 N12 O2 P3 S6 -","1","0.5","","Thorsten Glaser; Thomas Beissel; Eckhard Bill; Thomas Weyhermüller; Volker Schünemann; Wolfram Meyer-Klaucke; Alfred X. Trautwein; Karl Wieghardt","Electronic Structure of Linear Thiophenolate-Bridged Heterotrinuclear Complexes [LFeMFeL]n+ (M = Cr, Co, Fe; n= 1-3): Localized vs Delocalized Models","Journal of the American Chemical Society","1999","121","","2193","2208","10.1021/ja982898m","","","0.71073","MoKα","","0.0909","0.0647","","0.1971","0.1728","","","","1.043","1.059","1.059","","","","","has coordinates,has disorder","178934","2020-10-21","18:00:00",""
"4116308","15.403","0.003","16.474","0.003","22.935","0.004","94.38","0.03","94.36","0.03","91.61","0.03","5782.6","1.9","123","2","123","2","","","","","","","","8","P -1","-P 1","2","","","","- C111 H146 B2 F4 Fe3 N6 O3 S6 -","- C108 H110 B2 F4 Fe3 N6 O2 S6 -","- C216 H220 B4 F8 Fe6 N12 O4 S12 -","2","1","","Thorsten Glaser; Thomas Beissel; Eckhard Bill; Thomas Weyhermüller; Volker Schünemann; Wolfram Meyer-Klaucke; Alfred X. Trautwein; Karl Wieghardt","Electronic Structure of Linear Thiophenolate-Bridged Heterotrinuclear Complexes [LFeMFeL]n+ (M = Cr, Co, Fe; n= 1-3): Localized vs Delocalized Models","Journal of the American Chemical Society","1999","121","","2193","2208","10.1021/ja982898m","","","0.71073","MoKα","","0.1448","0.101","","0.3183","0.2347","","","","1.103","1.142","1.142","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116309","14.083","0.003","12.329","0.001","23.834","0.003","90","","97.36","0.01","90","","4104.2","1.1","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tetraphenylphosphonium nonacarbonyltri(μ-hydrido)(μ~3~-methyl)trirhenate diethylether solvate","","- C38 H36 O10 P Re3 -","- C34 H26 O9 P Re3 -","- C136 H104 O36 P4 Re12 -","4","1","","T. Beringhelli; G. D'Alfonso; M. Panigati; F. Porta; P. Mercandelli; M. Moret; A. Sironi","A Methyl Group Bridging on Three Metal Atoms. Solid-State and Solution Structural Characterization of the [Re3(μ-H)3(μ3-CH3)(CO)9]- Anion","Journal of the American Chemical Society","1999","121","","2307","2308","10.1021/ja983379m","","","0.71073","MoKα","","0.0355","0.0208","","0.0463","0.0443","","","","0.942","","","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116310","14.3763","0.0008","16.6844","0.0015","15.0123","0.0012","90","","100.424","0.006","90","","3541.4","0.5","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H42 F6 P3 W -","- C36 H42 F6 P3 W -","- C144 H168 F24 P12 W4 -","4","1","","Brett Pleune; Dolores Morales; Rita Meunier-Prest; Philippe Richard; Edmond Collange; James C. Fettinger; Rinaldo Poli","Stable Paramagnetic Half-Sandwich Mo(V) and W(V) Polyhydride Complexes. Structural, Spectroscopic, Electrochemical, Theoretical, and Decomposition Mechanism Studies of [Cp*MH3(dppe)]+ (M = Mo, W)","Journal of the American Chemical Society","1999","121","","2209","2225","10.1021/ja9834881","","","0.71073","MoKα","","0.0713","0.0412","","0.0861","0.0767","","","","1.076","1.131","1.131","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116311","14.4683","0.0015","16.4788","0.0015","15.0809","0.0015","90","","100.14","0.008","90","","3539.4","0.6","153","2","153","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H43 F6 P3 W -","- C36 H39 F6 P3 W -","- C144 H156 F24 P12 W4 -","4","1","","Brett Pleune; Dolores Morales; Rita Meunier-Prest; Philippe Richard; Edmond Collange; James C. Fettinger; Rinaldo Poli","Stable Paramagnetic Half-Sandwich Mo(V) and W(V) Polyhydride Complexes. Structural, Spectroscopic, Electrochemical, Theoretical, and Decomposition Mechanism Studies of [Cp*MH3(dppe)]+ (M = Mo, W)","Journal of the American Chemical Society","1999","121","","2209","2225","10.1021/ja9834881","","","0.71073","MoKα","","0.1035","0.0558","","","0.1101","0.1265","","","","","","1.056","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116312","13.222","0.003","14.062","0.003","14.818","0.003","90","","112.76","0.03","90","","2540.5","1.1","173","2","293","2","","","","","","","Y. Zang / Prof. Que","6","P 1 21/n 1","-P 2yn","14","40215","","","- C50 H64 Cl2 Fe2 N8 O12 -","- C50 H64 Cl2 Fe2 N8 O12 -","- C100 H128 Cl4 Fe4 N16 O24 -","2","0.5","","Hui Zheng; Yan Zang; Yanhong Dong; Victor G. Young; Lawrence Que","Complexes with FeIII2(μ-O)(μ-OH), FeIII2(μ-O)2, and [FeIII3(μ2-O)3] Cores: Structures, Spectroscopy, and Core Interconversions","Journal of the American Chemical Society","1999","121","","2226","2235","10.1021/ja983615t","","","0.71073","MoKα","","0.1184","0.0656","","0.1767","0.1468","","","","1.046","1.102","1.102","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116313","21.55","0.004","18.984","0.004","12.421","0.003","90","","93.55","0.03","90","","5071.7","1.9","173","2","173","2","","","","","","","Prof. L. Que / Zang","6","P 1 21/c 1","-P 2ybc","14","40167","","","- C46 H56 Cl3 Fe2 N8 O15 -","- C46 H56 Cl3 Fe2 N8 O15 -","- C184 H224 Cl12 Fe8 N32 O60 -","4","1","","Hui Zheng; Yan Zang; Yanhong Dong; Victor G. Young; Lawrence Que","Complexes with FeIII2(μ-O)(μ-OH), FeIII2(μ-O)2, and [FeIII3(μ2-O)3] Cores: Structures, Spectroscopy, and Core Interconversions","Journal of the American Chemical Society","1999","121","","2226","2235","10.1021/ja983615t","","","0.71073","MoKα","","0.1565","0.0685","","0.2013","0.1568","","","","1.01","1.088","1.088","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116314","13.5119","0.0006","11.3219","0.0005","18.6779","0.0008","90","","103.785","0.001","90","","2775.1","0.2","173","2","173","2","","","","","","","Y. Dong / Prof. L. Que","6","P 1 2/n 1","-P 2yac","13","97082","","","- C54 H47 Cl3 Fe2 N9 O14 -","- C54 H47 Cl3 Fe2 N9 O14 -","- C108 H94 Cl6 Fe4 N18 O28 -","2","0.5","","Hui Zheng; Yan Zang; Yanhong Dong; Victor G. Young; Lawrence Que","Complexes with FeIII2(μ-O)(μ-OH), FeIII2(μ-O)2, and [FeIII3(μ2-O)3] Cores: Structures, Spectroscopy, and Core Interconversions","Journal of the American Chemical Society","1999","121","","2226","2235","10.1021/ja983615t","","","0.71073","MoKα","","0.1044","0.067","","0.1574","0.141","","","","1.044","1.128","1.128","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116315","26.1539","0.0001","64.6139","0.0003","12.7408","0.0001","90","","90","","90","","21530.7","0.2","173","2","173","2","","","","","","","Y. Zang/ Prof. L. Que","6","F d d 2","F 2 -2d","43","95060","","","- C44 H68 Cl3 Fe2 N9 O15.5 -","- C44 H68 Cl3 Fe2 N9 O15.5 -","- C704 H1088 Cl48 Fe32 N144 O248 -","16","1","","Hui Zheng; Yan Zang; Yanhong Dong; Victor G. Young; Lawrence Que","Complexes with FeIII2(μ-O)(μ-OH), FeIII2(μ-O)2, and [FeIII3(μ2-O)3] Cores: Structures, Spectroscopy, and Core Interconversions","Journal of the American Chemical Society","1999","121","","2226","2235","10.1021/ja983615t","","","0.71073","MoKα","","0.051","0.0485","","0.1374","0.1327","","","","1.052","1.05","1.05","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116316","25.5756","0.0001","14.4026","0.0002","31.4563","0.0001","90","","105.625","0.001","90","","11158.9","0.17","173","2","173","2","","","","","","","Prof. Que / H. Zheng","7","C 1 c 1","C -2yc","9","98094","","","- C124 H136 B2 Cl Fe3 N14 O7 -","- C124 H130 B2 Cl Fe3 N14 O7 -","- C496 H520 B8 Cl4 Fe12 N56 O28 -","4","1","","Hui Zheng; Yan Zang; Yanhong Dong; Victor G. Young; Lawrence Que","Complexes with FeIII2(μ-O)(μ-OH), FeIII2(μ-O)2, and [FeIII3(μ2-O)3] Cores: Structures, Spectroscopy, and Core Interconversions","Journal of the American Chemical Society","1999","121","","2226","2235","10.1021/ja983615t","","","0.71073","MoKα","","0.0987","0.0656","","0.1332","0.1156","","","","1.089","1.098","1.098","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116317","12.968","0.004","13.279","0.005","12.825","0.003","109.21","0.03","95.38","0.03","114.22","0.02","1833.6","1.2","123.2","","123.2","","","","","","","","","8","P -1","-P 1","2","","","","- C48 H64 B4 Bi Cl10 N24 Na S6 -","- C26 H30 B2 Bi0.5 Cl5 N12 Na0.5 S3 -","- C52 H60 B4 Bi Cl10 N24 Na S6 -","2","1","","John Reglinski; Mark D. Spicer; Mark Garner; Alan R. Kennedy","Structural Consequences of the Use of Hard and Soft Tripodal Ligands during Metathesis Reactions: Synthesis of the [Bis(hydrotris(methimazolyl)borato]bismuth(III) [Bis(hydrotris(pyrazolyl)borato]sodiate","Journal of the American Chemical Society","1999","121","","2317","2318","10.1021/ja983637f","","","0.7107","MoKalpha","","0.0917","0.0538","","0.1093","0.0641","","","","","1.412","1.412","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116318","9.456","0.002","12.088","0.003","13.02","0.003","78.44","0.02","72.55","0.02","69.8","0.02","1324.6","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H28 Br2 N2 Ni -","- C29 H28 Br2 N2 Ni -","- C58 H56 Br4 N4 Ni2 -","2","1","","Colin D. Abernethy; Jason A. C. Clyburne; Alan H. Cowley; Richard A. Jones","Reactions of Transition-Metal Metallocenes with Stable Carbenes","Journal of the American Chemical Society","1999","121","","2329","2330","10.1021/ja983772s","","","0.71073","MoKα","","0.1169","0.076","","0.2179","0.183","","","","1.069","1.121","1.121","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116319","11.165","0.003","9.693","0.002","23.201","0.005","90","","95.82","0.02","90","","2497.9","1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H34 N4 Ni O -","- C26 H34 N4 Ni O0.5 -","- C104 H136 N16 Ni4 O2 -","4","1","","Colin D. Abernethy; Jason A. C. Clyburne; Alan H. Cowley; Richard A. Jones","Reactions of Transition-Metal Metallocenes with Stable Carbenes","Journal of the American Chemical Society","1999","121","","2329","2330","10.1021/ja983772s","","","0.71073","MoKα","","0.0847","0.055","","0.2675","0.1736","","","","1.03","0.843","0.843","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116320","25.839","0.005","9.501","0.002","21.716","0.005","90","","107.064","0.012","90","","5096.5","1.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C52 H76 Cr2 N8 O -","- C52.08 H76.42 Cr2 N8 O -","- C208.32 H305.68 Cr8 N32 O4 -","4","1","","Colin D. Abernethy; Jason A. C. Clyburne; Alan H. Cowley; Richard A. Jones","Reactions of Transition-Metal Metallocenes with Stable Carbenes","Journal of the American Chemical Society","1999","121","","2329","2330","10.1021/ja983772s","","","0.71073","MoKα","","0.0789","0.0469","","0.1399","0.1177","","","","1.112","1.15","1.15","","","","","has coordinates,has disorder","178934","2020-10-21","18:00:00",""
"4116321","8.833","0.002","11.178","0.002","11.431","0.002","100.588","0.008","112.708","0.006","113.218","0.012","878.5","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","3-(2-(2,5-dimethyl(3-thienyl))-3,3,4,4,5,6-hexafluorocyclopent-1-enyl)-2,5-d imethylthiophene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C34 H28 F12 S4 -","2","1","","Seiya Kobatake; Taro Yamada; Kingo Uchida; Nobuo Kato; Masahiro Irie","Photochromism of 1,2-Bis(2,5-dimethyl-3-thienyl)perfluoro- cyclopentene in a Single Crystalline Phase","Journal of the American Chemical Society","1999","121","","2380","2386","10.1021/ja983717j","","","0.71073","MoKα","","0.0507","0.0346","","","0.0969","0.1044","","","","","","0.969","","","","has coordinates,has disorder","301833","2025-08-20","15:22:59",""
"4116322","6.3533","0.0015","24.75","0.006","11.46","0.003","90","","104.891","0.004","90","","1741.5","0.7","304","2","304","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","8,8,9,9,10,10-hexafluoro-1,2,4,14-tetramethyl-3,15-dithiatetracyclo[10.3.0.0^2,6^.0^7,11^]pentadeca-4,6(7),11(12),13-tetraene","","- C17 H14 F6 S2 -","- C17 H14 F6 S2 -","- C68 H56 F24 S8 -","4","1","","Seiya Kobatake; Taro Yamada; Kingo Uchida; Nobuo Kato; Masahiro Irie","Photochromism of 1,2-Bis(2,5-dimethyl-3-thienyl)perfluoro- cyclopentene in a Single Crystalline Phase","Journal of the American Chemical Society","1999","121","","2380","2386","10.1021/ja983717j","","","0.71073","MoKα","","0.1811","0.084","","","0.1592","0.1923","","","","","","1.027","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116323","10.417","0.002","13.436","0.0016","19.23","0.005","107.841","0.017","101.989","0.02","93.318","0.016","2484.7","0.9","295","","295","","","","","","","","","5","P -1","-P 1","2","","","","- C61 H51 Ir O P2 -","- C58.5 H43 Ir O P2 -","- C117 H86 Ir2 O2 P4 -","2","1","","Robert D. Gilbertson; Timothy J. R. Weakley; Michael M. Haley","Direct Synthesis of an Iridabenzene from a Nucleophilic 3-Vinyl-1-cyclopropene","Journal of the American Chemical Society","1999","121","","2597","2598","10.1021/ja984420o","","","0.71073","MoKα","","0.06","0.05","","0.067","","0.066","","","3.01","","","3.17","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116324","15.385","0.003","12.688","0.003","17.532","0.003","90","","107.48","","90","","3264.3","1.1","150","0.5","0","","","","","","","","?","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H0 F13 N4 O U2 -","- C10 F13 N4 O U2 -","- C40 F52 N16 O4 U8 -","4","1","","R. J. Francis; P. S. Halasyamani; J. S. Bee; D. O'Hare","Variable Dimensionality in the Uranium Fluoride/2-Methyl-Piperazine System: Syntheses and Structures of UFO-5, -6, and -7; Zero-, One-, and Two-Dimensional Materials with Unprecedented Topologies","Journal of the American Chemical Society","1999","121","","1609","1610","10.1021/ja983629z","","","0.7107","MoKα","","","0.074","","","0.093","","","","","0.9368","0.9368","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4116325","13.702","0.001","12.555","0.001","6.607","0.001","90","","107.08","0.04","90","","1086.5","0.3","150","0.5","150","0.5","","","","","","","synthesis as described","6","C 1 2/m 1","-C 2y","12","","","","- C5 H16 F12 N2 O U2 -","- C10 H26 F12 N4 O2 U2 -","- C20 H52 F24 N8 O4 U4 -","2","0.25","","R. J. Francis; P. S. Halasyamani; J. S. Bee; D. O'Hare","Variable Dimensionality in the Uranium Fluoride/2-Methyl-Piperazine System: Syntheses and Structures of UFO-5, -6, and -7; Zero-, One-, and Two-Dimensional Materials with Unprecedented Topologies","Journal of the American Chemical Society","1999","121","","1609","1610","10.1021/ja983629z","","","0.71073","MoKα","","0.0329","0.0307","","0.0707","0.0695","","","","1.104","1.107","1.107","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116326","19.366","0.001","8.599","0.001","14.249","0.001","90","","99.165","0.003","90","","2342.6","0.3","150","0.5","150","0.5","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C5 H17 F11 N2 O U2 -","- C2.5 H6.5 F11 N O U2 -","- C20 H52 F88 N8 O8 U16 -","8","1","","R. J. Francis; P. S. Halasyamani; J. S. Bee; D. O'Hare","Variable Dimensionality in the Uranium Fluoride/2-Methyl-Piperazine System: Syntheses and Structures of UFO-5, -6, and -7; Zero-, One-, and Two-Dimensional Materials with Unprecedented Topologies","Journal of the American Chemical Society","1999","121","","1609","1610","10.1021/ja983629z","","","0.71073","MoKα","","0.064","0.0541","","0.1571","0.1471","","","","1.072","1.097","1.097","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116327","14.6181","0.0011","8.3199","0.0007","11.878","0.0009","90","","115.877","0.003","90","","1299.77","0.18","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","HMPE(gly)2","","","- C10 H18 N2 O4 P2 -","- C10 H20 N2 O4 P2 -","- C40 H80 N8 O16 P8 -","4","0.5","","Douglas E. Berning; Kattesh V. Katti; Charles L. Barnes; Wynn A. Volkert","Chemical and Biomedical Motifs of the Reactions of Hydroxymethylphosphines with Amines, Amino Acids, and Model Peptides","Journal of the American Chemical Society","1999","121","","1658","1664","10.1021/ja9827604","","","0.7093","MolybdenumKα","","0.042","0.042","","0.069","0.069","","","","","2.12","2.12","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116328","6.8627","0.0008","9.354","0.002","14.486","0.004","84.51","0.03","77.44","0.02","86.25","0.03","902.5","0.3","293","","293","","","","","","","","","6","P -1","-P 1","2","THP(gly)3","","","- C9 H23 Cl3 N3 O7 P -","- C9 H23 Cl3 N3 O7 P -","- C18 H46 Cl6 N6 O14 P2 -","2","1","","Douglas E. Berning; Kattesh V. Katti; Charles L. Barnes; Wynn A. Volkert","Chemical and Biomedical Motifs of the Reactions of Hydroxymethylphosphines with Amines, Amino Acids, and Model Peptides","Journal of the American Chemical Society","1999","121","","1658","1664","10.1021/ja9827604","","","1.54056","CopperKα","","0.039","0.039","","0.073","0.073","","","","","2.85","2.85","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116329","21.199","0.004","8.1123","0.0007","20.854","0.003","90","","105.51","0.03","90","","3455.7","1","293","","293","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","HMPB-N-methylaniline","","","- C38 H44 N4 P2 -","- C38 H44 N4 P2 -","- C152 H176 N16 P8 -","4","1","","Douglas E. Berning; Kattesh V. Katti; Charles L. Barnes; Wynn A. Volkert","Chemical and Biomedical Motifs of the Reactions of Hydroxymethylphosphines with Amines, Amino Acids, and Model Peptides","Journal of the American Chemical Society","1999","121","","1658","1664","10.1021/ja9827604","","","1.54056","CopperKα","","0.047","0.047","","0.073","0.073","","","","","2.43","2.43","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116330","13.573","0.001","13.279","0.001","10.653","0.001","90","","108.816","0.001","90","","1817.4","0.3","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","HMPB(gly)2","","","- C14 H19 Cl N2 O4 P2 -","- C14 H19 Cl N2 O4 P2 -","- C56 H76 Cl4 N8 O16 P8 -","4","0.5","","Douglas E. Berning; Kattesh V. Katti; Charles L. Barnes; Wynn A. Volkert","Chemical and Biomedical Motifs of the Reactions of Hydroxymethylphosphines with Amines, Amino Acids, and Model Peptides","Journal of the American Chemical Society","1999","121","","1658","1664","10.1021/ja9827604","","","0.7093","MolybdenumKα","","0.031","0.031","","0.055","0.055","","","","","1.64","1.64","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116331","7.175","0.004","25.233","0.008","8.394","0.004","90","","90.6","0.02","90","","1519.6","1.2","294","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H7 Cl O2 -","- C9 H7 Cl O2 -","- C72 H56 Cl8 O16 -","8","2","","Srinivasan S. Kuduva; Donald C. Craig; Ashwini Nangia; Gautam R. Desiraju","Cubanecarboxylic Acids. Crystal Engineering Considerations and the Role of C-H...O Hydrogen Bonds in Determining O-H...O Networks","Journal of the American Chemical Society","1999","121","","1936","1944","10.1021/ja981967u","","","0.71073","MoKα","","","0.045","","","","0.057","","","","","","1.89","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116332","8.306","0.003","7.261","0.002","14.269","0.006","90","","113.13","0.02","90","","791.4","0.5","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H7 Br O2 -","- C9 H8 Br O2 -","- C36 H32 Br4 O8 -","4","1","","Srinivasan S. Kuduva; Donald C. Craig; Ashwini Nangia; Gautam R. Desiraju","Cubanecarboxylic Acids. Crystal Engineering Considerations and the Role of C-H...O Hydrogen Bonds in Determining O-H...O Networks","Journal of the American Chemical Society","1999","121","","1936","1944","10.1021/ja981967u","","","0.71073","MoKα","","","0.032","","","","0.043","","","","","","1.58","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116333","8.304","0.004","7.341","0.002","14.701","0.007","90","","113.11","0.02","90","","824.3","0.6","294","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H7 I O2 -","- C9 H8 I O2 -","- C36 H32 I4 O8 -","4","1","","Srinivasan S. Kuduva; Donald C. Craig; Ashwini Nangia; Gautam R. Desiraju","Cubanecarboxylic Acids. Crystal Engineering Considerations and the Role of C-H...O Hydrogen Bonds in Determining O-H...O Networks","Journal of the American Chemical Society","1999","121","","1936","1944","10.1021/ja981967u","","","0.71073","MoKα","","","0.023","","","","0.038","","","","","","1.35","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116334","7.26","0.001","30.507","0.003","8.252","0.002","90","","90.724","0.009","90","","1827.5","0.5","294","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 O4 -","- C11 H10 O4 -","- C88 H80 O32 -","8","2","","Srinivasan S. Kuduva; Donald C. Craig; Ashwini Nangia; Gautam R. Desiraju","Cubanecarboxylic Acids. Crystal Engineering Considerations and the Role of C-H...O Hydrogen Bonds in Determining O-H...O Networks","Journal of the American Chemical Society","1999","121","","1936","1944","10.1021/ja981967u","","","1.5418","CuKα","","","0.047","","","","","","","","","","2.22","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116335","8.599","0.002","11.131","0.002","14.588","0.004","90","","94.68","0.01","90","","1391.6","0.6","294","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C9 H8 O2 -","- C9 H9 O2 -","- C72 H72 O16 -","8","2","","Srinivasan S. Kuduva; Donald C. Craig; Ashwini Nangia; Gautam R. Desiraju","Cubanecarboxylic Acids. Crystal Engineering Considerations and the Role of C-H...O Hydrogen Bonds in Determining O-H...O Networks","Journal of the American Chemical Society","1999","121","","1936","1944","10.1021/ja981967u","","","1.54184","CuKα","","","0.039","","","","0.054","","","","","","1.73","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116336","8.998","0.002","13.605","0.002","11.056","0.002","90","","123.448","0.009","90","","1129.3","0.4","294","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 O2 -","- C15 H12 O2 -","- C60 H48 O8 -","4","1","","Srinivasan S. Kuduva; Donald C. Craig; Ashwini Nangia; Gautam R. Desiraju","Cubanecarboxylic Acids. Crystal Engineering Considerations and the Role of C-H...O Hydrogen Bonds in Determining O-H...O Networks","Journal of the American Chemical Society","1999","121","","1936","1944","10.1021/ja981967u","","","1.54184","CuKα","","","0.048","","","","0.066","","","","","","2.27","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116337","9.944","0.001","7.127","0.001","12.723","0.002","90","","90","","90","","901.7","0.2","294","","","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C10 H9 N O3 -","- C10 H9 N O3 -","- C40 H36 N4 O12 -","4","1","","Srinivasan S. Kuduva; Donald C. Craig; Ashwini Nangia; Gautam R. Desiraju","Cubanecarboxylic Acids. Crystal Engineering Considerations and the Role of C-H...O Hydrogen Bonds in Determining O-H...O Networks","Journal of the American Chemical Society","1999","121","","1936","1944","10.1021/ja981967u","","","1.54184","CuKα","","","0.039","","","","0.064","","","","","","2.75","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116338","14.183","0.004","16.477","0.004","6.387","0.004","90","","90","","90","","1492.6","1.1","291.2","","291.2","","","","","","","","prepared by T. Mitsudo","3","P n m a","-P 2ac 2n","62","tetrabromopentacyclotetradecane","","","- C14 H16 Br4 -","- C14 H16 Br4 -","- C56 H64 Br16 -","4","0.5","","Take-aki Mitsudo; Toshiaki Suzuki; Shi-Wei Zhang; Daisuke Imai; Ken-ichi Fujita; Takao Manabe; Masashi Shiotsuki; Yoshihisa Watanabe; Kenji Wada; Teruyuki Kondo","Novel Ruthenium Complex-Catalyzed Dimerization of 2,5-Norbornadiene to Pentacyclo[6.6.0.0^2,6^.0^3,13^.0^10,14^]tetradeca-4,11-diene Involving Carbon-Carbon Bond Cleavage","Journal of the American Chemical Society","1999","121","9","1839","1850","10.1021/ja9835741","","","0.7107","MoKα","","0","0","","","0","0.034","","","","","","1.88","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116339","19.708","0.004","7.742","0.004","9.858","0.004","90","","90","","90","","1504.1","1","296.2","","296.2","","","","","","","","prepared by T. Mitsudo et al.","6","P c a 21","P 2c -2ac","29","[AgOTf(PCTD)]n","","","- C15 H16 Ag F3 O3 S -","- C15 H16 Ag F3 O3 S -","- C60 H64 Ag4 F12 O12 S4 -","4","1","","Take-aki Mitsudo; Toshiaki Suzuki; Shi-Wei Zhang; Daisuke Imai; Ken-ichi Fujita; Takao Manabe; Masashi Shiotsuki; Yoshihisa Watanabe; Kenji Wada; Teruyuki Kondo","Novel Ruthenium Complex-Catalyzed Dimerization of 2,5-Norbornadiene to Pentacyclo[6.6.0.0^2,6^.0^3,13^.0^10,14^]tetradeca-4,11-diene Involving Carbon-Carbon Bond Cleavage","Journal of the American Chemical Society","1999","121","9","1839","1850","10.1021/ja9835741","","","0.7107","MoKα","","0.0288","0.0288","","","0.0302","0.0302","","","","","","1.277","","","","has coordinates","134518","2020-10-21","18:00:00",""
"4116340","7.816","0.005","25.19","0.005","11.05","0.006","90","","109.01","0.04","90","","2056.9","1.8","296.2","","296.2","","","","","","","","prepared by T. Mitsudo","4","P 1 21/c 1","-P 2ybc","14","Ru(cot)(dmfm)2","","","- C20 H26 O8 Ru -","- C20 H26 O8 Ru -","- C80 H104 O32 Ru4 -","4","1","","Take-aki Mitsudo; Toshiaki Suzuki; Shi-Wei Zhang; Daisuke Imai; Ken-ichi Fujita; Takao Manabe; Masashi Shiotsuki; Yoshihisa Watanabe; Kenji Wada; Teruyuki Kondo","Novel Ruthenium Complex-Catalyzed Dimerization of 2,5-Norbornadiene to Pentacyclo[6.6.0.02,6.03,13.010,14]tetradeca-4,11-diene Involving Carbon-Carbon Bond Cleavage","Journal of the American Chemical Society","1999","121","9","1839","1850","10.1021/ja9835741","","","0.7107","MoKα","","0","0","","","0","0.0413","","","","","","0.658","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4116341","12.0455","0.0012","7.271","0.0012","16.0707","0.0015","90","","90","","90","","1407.5","0.3","298","1","298","1","","","","","","","","5","F m m m","-F 2 2","69","","","","- C6 H16 N10 Ni O6 -","- C6 H16 N10 Ni O6 -","- C24 H64 N40 Ni4 O24 -","4","0.125","","Larry R. Falvello; Michael A. Hitchman; Fernando Palacio; Isabel Pascual; Arthur J. Schultz; Horst Stratemeier; Milagros Tomás; Esteban P. Urriolabeitia; Dianna M. Young","Tunable Molecular Distortion in a Nickel Complex Coupled to a Reversible Phase Transition in the Crystalline State","Journal of the American Chemical Society","1999","121","","2808","2819","10.1021/ja983247t","","","0.71073","MoKα","","0.0549","0.0398","","","0.101","0.1057","","","","","","1.076","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116342","12.014","0.002","7.219","0.002","15.805","0.002","90","","90","","90","","1370.8","0.5","150","1","150","1","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C6 H16 N10 Ni O6 -","- C6 H16 N10 Ni O6 -","- C24 H64 N40 Ni4 O24 -","4","0.25","","Larry R. Falvello; Michael A. Hitchman; Fernando Palacio; Isabel Pascual; Arthur J. Schultz; Horst Stratemeier; Milagros Tomás; Esteban P. Urriolabeitia; Dianna M. Young","Tunable Molecular Distortion in a Nickel Complex Coupled to a Reversible Phase Transition in the Crystalline State","Journal of the American Chemical Society","1999","121","","2808","2819","10.1021/ja983247t","","","0.71073","MoKα","","0.0542","0.0371","","0.0994","0.0917","","","","1.096","1.117","1.117","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116343","11.998","0.004","7.203","0.006","15.736","0.005","90","","90","","90","","1359.9","1.3","100","1","100","1","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C6 H16 N10 Ni O6 -","- C6 H16 N10 Ni O6 -","- C24 H64 N40 Ni4 O24 -","4","0.25","","Larry R. Falvello; Michael A. Hitchman; Fernando Palacio; Isabel Pascual; Arthur J. Schultz; Horst Stratemeier; Milagros Tomás; Esteban P. Urriolabeitia; Dianna M. Young","Tunable Molecular Distortion in a Nickel Complex Coupled to a Reversible Phase Transition in the Crystalline State","Journal of the American Chemical Society","1999","121","","2808","2819","10.1021/ja983247t","","","0.71073","MoKα","","0.0522","0.0393","","0.0966","0.0912","","","","1.069","1.124","1.124","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116344","12.0551","0.0006","7.2825","0.0006","16.0779","0.0007","90","","90","","90","","1411.5","0.15","298","1","298","1","","","","","","","","5","F m m m","-F 2 2","69","","","","- C6 H16 N10 Ni O6 -","- C6 H16 N10 Ni O6 -","- C24 H64 N40 Ni4 O24 -","4","0.125","","Larry R. Falvello; Michael A. Hitchman; Fernando Palacio; Isabel Pascual; Arthur J. Schultz; Horst Stratemeier; Milagros Tomás; Esteban P. Urriolabeitia; Dianna M. Young","Tunable Molecular Distortion in a Nickel Complex Coupled to a Reversible Phase Transition in the Crystalline State","Journal of the American Chemical Society","1999","121","","2808","2819","10.1021/ja983247t","","","0.71073","MoKα","","0.0593","0.0382","","0.1032","0.0914","","","","1.087","1.116","1.116","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116345","12.015","0.002","7.226","0.002","15.766","0.003","90","","90","","90","","1368.8","0.5","139","1","139","1","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C6 H16 N10 Ni O6 -","- C6 H16 N10 Ni O6 -","- C24 H64 N40 Ni4 O24 -","4","0.25","","Larry R. Falvello; Michael A. Hitchman; Fernando Palacio; Isabel Pascual; Arthur J. Schultz; Horst Stratemeier; Milagros Tomás; Esteban P. Urriolabeitia; Dianna M. Young","Tunable Molecular Distortion in a Nickel Complex Coupled to a Reversible Phase Transition in the Crystalline State","Journal of the American Chemical Society","1999","121","","2808","2819","10.1021/ja983247t","","","0.71073","MoKα","","0.051","0.0334","","","0.0822","0.0859","","","","","","0.997","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116346","12.0551","0.0012","7.2846","0.0012","16.0766","0.0014","90","","90","","90","","1411.8","0.3","298","1","293","2","","","","","","","","5","F m m m","-F 2 2","69","","","","- C6 H16 N10 Ni O6 -","- C6 H16 N10 Ni O6 -","- C24 H64 N40 Ni4 O24 -","4","0.125","","Larry R. Falvello; Michael A. Hitchman; Fernando Palacio; Isabel Pascual; Arthur J. Schultz; Horst Stratemeier; Milagros Tomás; Esteban P. Urriolabeitia; Dianna M. Young","Tunable Molecular Distortion in a Nickel Complex Coupled to a Reversible Phase Transition in the Crystalline State","Journal of the American Chemical Society","1999","121","","2808","2819","10.1021/ja983247t","","","0.71073","MoKα","","0.0435","0.0301","","","0.0773","0.0827","","","","","","1.075","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116347","12.0338","0.0011","7.2535","0.001","15.9377","0.0013","90","","90","","90","","1391.2","0.3","223","1","223","1","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C6 H16 N10 Ni O6 -","- C6 H16 N10 Ni O6 -","- C24 H64 N40 Ni4 O24 -","4","0.25","","Larry R. Falvello; Michael A. Hitchman; Fernando Palacio; Isabel Pascual; Arthur J. Schultz; Horst Stratemeier; Milagros Tomás; Esteban P. Urriolabeitia; Dianna M. Young","Tunable Molecular Distortion in a Nickel Complex Coupled to a Reversible Phase Transition in the Crystalline State","Journal of the American Chemical Society","1999","121","","2808","2819","10.1021/ja983247t","","","0.71073","MoKα","","0.0416","0.0313","","","0.0858","0.0895","","","","","","1.12","","","","has coordinates,has disorder","301833","2025-08-20","15:22:59",""
"4116348","12.006","0.002","7.215","0.002","15.809","0.003","90","","90","","90","","1369.4","0.5","148","2","148","2","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C6 H16 N10 Ni O6 -","- C12 H32 N20 Ni2 O12 -","- C24 H64 N40 Ni4 O24 -","2","0.125","","Larry R. Falvello; Michael A. Hitchman; Fernando Palacio; Isabel Pascual; Arthur J. Schultz; Horst Stratemeier; Milagros Tomás; Esteban P. Urriolabeitia; Dianna M. Young","Tunable Molecular Distortion in a Nickel Complex Coupled to a Reversible Phase Transition in the Crystalline State","Journal of the American Chemical Society","1999","121","","2808","2819","10.1021/ja983247t","","","0.71073","MoKα","","0.0784","0.0434","","","0.0952","0.102","","","","","","1.033","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116349","12.0323","0.0015","7.2266","0.0012","15.661","0.006","90","","90","","90","","1361.8","0.6","13","3","13","3","","","","","","","","5","C m c m","-C 2c 2","63","","","","- C6 H16 N10 Ni O6 -","- C5 H14 N7 Ni0.25 O5 -","- C20 H56 N28 Ni O20 -","4","0.25","","Larry R. Falvello; Michael A. Hitchman; Fernando Palacio; Isabel Pascual; Arthur J. Schultz; Horst Stratemeier; Milagros Tomás; Esteban P. Urriolabeitia; Dianna M. Young","Tunable Molecular Distortion in a Nickel Complex Coupled to a Reversible Phase Transition in the Crystalline State","Journal of the American Chemical Society","1999","121","","2808","2819","10.1021/ja983247t","","neutron","","neutron","","","0.069","","","0.045","","","","","","","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116350","21.119","0.003","12.021","0.004","12.901","0.003","90","","94","","90","1","3267.2","1.4","296.2","","296.2","","","","","","","","","4","C 1 c 1","C -2yc","9","N-Fused","","","- C44 H27 Br N4 -","- C44 H27 Br N4 -","- C176 H108 Br4 N16 -","4","1","","Hiroyuki Furuta; Tomoya Ishizuka; Atsuhiro Osuka; Takuji Ogawa","""N-Fused Porphyrin"" from N-Confused Porphyrin","Journal of the American Chemical Society","1999","121","","2945","2946","10.1021/ja9902672","","","0.7107","MoKα","","0.0652","0.065","","0.04","0","0.04","","","1.689","","","1.69","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116351","31.019","0.012","7.1857","0.0012","8.103","0.003","90","","96.038","0.017","90","","1796.1","1","293","2","293","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C14 H24 K2 Mn3 Mo2 N14 O12 -","- C14 K2 Mn3 Mo2 N14 O12 -","- C28 K4 Mn6 Mo4 N28 O24 -","2","0.5","","Joulia Larionova; Olivier Kahn; Stéphane Gohlen; Lahcène Ouahab; Rodolphe Clérac","Structure, Ferromagnetic Ordering, Anisotropy, and Spin Reorientation for the Two-Dimensional Cyano-Bridged Bimetallic Compound K2Mn3(H2O)6[Mo(CN)7]2.6H2O","Journal of the American Chemical Society","1999","121","","3349","3356","10.1021/ja9832717","","","0.71073","MoKα","","0.1489","0.0573","","","0.1218","0.1419","","","","","","1.116","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116352","14.756","0.0004","14.756","0.0004","14.756","0.0004","90","","90","","90","","3212.96","0.15","293","2","293","2","","","","","","","pure_elements","3","F d -3 m :2","-F 4vw 2vw 3","227","clathrate_II_type","","","- Cs Na2 Si17 -","- Cs Na2 Si17 -","- Cs8 Na16 Si136 -","8","0.0416667","","Svilen Bobev; Slavi C. Sevov","Synthesis and Characterization of Stable Stoichiometric Clathrates of Silicon and Germanium: Cs8Na16Si136 and Cs8Na16Ge136","Journal of the American Chemical Society","1999","121","","3795","3796","10.1021/ja9844175","","","0.71073","MoKα","","0.0231","0.0201","","0.0462","0.0453","","","","1.203","1.235","1.235","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116353","15.4805","0.0006","15.4805","0.0006","15.4805","0.0006","90","","90","","90","","3709.8","0.2","293","2","293","2","","","","","","","pure_elements","3","F d -3 m :2","-F 4vw 2vw 3","227","clathrate_II_type","","","- Cs Ge17 Na2 -","- Cs Ge17 Na2 -","- Cs8 Ge136 Na16 -","8","0.0416667","","Svilen Bobev; Slavi C. Sevov","Synthesis and Characterization of Stable Stoichiometric Clathrates of Silicon and Germanium: Cs8Na16Si136 and Cs8Na16Ge136","Journal of the American Chemical Society","1999","121","","3795","3796","10.1021/ja9844175","","","0.71073","MoKα","","0.0924","0.0431","","0.0981","0.083","","","","1.033","1.113","1.113","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116354","14.738","0.002","14.738","0.002","14.738","0.002","90","","90","","90","","3201.2","0.8","293","2","293","2","","","","","","","pure_elements","3","F d -3 m :2","-F 4vw 2vw 3","227","clathrate_II_type","","","- Cs Na2 Si17 -","- Cs Na2 Si17 -","- Cs8 Na16 Si136 -","8","0.0416667","","Svilen Bobev; Slavi C. Sevov","Synthesis and Characterization of Stable Stoichiometric Clathrates of Silicon and Germanium: Cs8Na16Si136 and Cs8Na16Ge136","Journal of the American Chemical Society","1999","121","","3795","3796","10.1021/ja9844175","","","0.71073","MoKα","","0.031","0.0207","","0.0501","0.0455","","","","1.142","1.152","1.152","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116355","14.726","0.001","14.726","0.001","14.726","0.001","90","","90","","90","","3193.4","0.4","293","2","293","2","","","","","","","pure_elements","3","F d -3 m :2","-F 4vw 2vw 3","227","clathrate_II_type","","","- Cs Na2 Si17 -","- Cs Na2 Si17 -","- Cs8 Na16 Si136 -","8","0.0416667","","Svilen Bobev; Slavi C. Sevov","Synthesis and Characterization of Stable Stoichiometric Clathrates of Silicon and Germanium: Cs8Na16Si136 and Cs8Na16Ge136","Journal of the American Chemical Society","1999","121","","3795","3796","10.1021/ja9844175","","","0.71073","MoKα","","0.0297","0.0221","","0.0447","0.0422","","","","1.103","1.123","1.123","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116356","14.701","0.002","14.701","0.002","14.701","0.002","90","","90","","90","","3177.2","0.7","293","2","293","2","","","","","","","pure_elements","3","F d -3 m :2","-F 4vw 2vw 3","227","clathrate_II_type","","","- Cs Na2 Si17 -","- Cs Na2 Si17 -","- Cs8 Na16 Si136 -","8","0.0416667","","Svilen Bobev; Slavi C. Sevov","Synthesis and Characterization of Stable Stoichiometric Clathrates of Silicon and Germanium: Cs8Na16Si136 and Cs8Na16Ge136","Journal of the American Chemical Society","1999","121","","3795","3796","10.1021/ja9844175","","","0.71073","MoKα","","0.0182","0.0159","","0.0457","0.045","","","","1.122","1.111","1.111","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116357","8.03","0.01","8.162","0.006","11.375","0.008","90.02","0.07","91.78","0.08","89.98","0.1","745.2","1.2","243.2","","243.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H12 O2 Sn -","- C8 H24 O4 Sn2 -","- C32 H96 O16 Sn8 -","4","1","","Jun-Chul Choi; Toshiyasu Sakakura; Takeshi Sako","Reaction of Dialkyltin Methoxide with Carbon Dioxide Relevant to the Mechanism of Catalytic Carbonate Synthesis","Journal of the American Chemical Society","1999","121","","3793","3794","10.1021/ja9900499","","","0.7107","MoKα","","0.0512","0.0512","","","0.079","0.079","","","","","","1.86","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116358","8.16","0.003","8.724","0.002","6.641","0.002","92.77","0.02","110.46","0.03","93.01","0.02","441.2","0.2","243.2","","243.2","","","","","","","","","4","P -1","-P 1","2","","","","- C5 H12 O4 Sn -","- C10 H24 O8 Sn2 -","- C20 H48 O16 Sn4 -","2","1","","Jun-Chul Choi; Toshiyasu Sakakura; Takeshi Sako","Reaction of Dialkyltin Methoxide with Carbon Dioxide Relevant to the Mechanism of Catalytic Carbonate Synthesis","Journal of the American Chemical Society","1999","121","","3793","3794","10.1021/ja9900499","","","0.7107","MoKα","","0.0512","0.0512","","","0.0447","0.0447","","","","","","1.655","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116359","21.3252","0.0012","9.4245","0.0003","20.5573","0.0012","90","","99.542","0.005","90","","4074.4","0.4","150","0.1","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C46 H56 N2 O6 -","- C46 H56 N2 O6 -","- C184 H224 N8 O24 -","4","0.5","","Wen-wei Huang; Huda Henry-Riyad; Thomas T. Tidwell","Reactions of the ""Stable"" Nitroxyl Radical TEMPO with Ketenes: Formation of a Unique Peroxidic Source of Aminyl Radicals","Journal of the American Chemical Society","1999","121","","3939","3943","10.1021/ja982944i","","","0.71073","MoKα","","0.1093","0.0558","","","0.1328","0.1485","","","","","","1.035","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116360","9.3238","0.0004","11.4506","0.0004","34.2187","0.0013","90","","90","","90","","3653.3","0.2","150","0.1","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C17 H24 O2 Si2 -","- C17 H24 O2 Si2 -","- C136 H192 O16 Si16 -","8","1","","Wen-wei Huang; Huda Henry-Riyad; Thomas T. Tidwell","Reactions of the ""Stable"" Nitroxyl Radical TEMPO with Ketenes: Formation of a Unique Peroxidic Source of Aminyl Radicals","Journal of the American Chemical Society","1999","121","","3939","3943","10.1021/ja982944i","","","0.71073","MoKα","","0.0669","0.0434","","","0.1078","0.117","","","","","","1.045","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116361","11.872","0.002","13.192","0.003","14.305","0.003","84.19","0.03","69.72","0.03","69.85","0.03","1972.5","0.9","198","2","198","2","","","","","","","","5","P -1","-P 1","2","","Fe(OEP)(1-MeIm)(CO)","","- C44 H57 Fe N6 O -","- C44 H57 Fe N6 O -","- C88 H114 Fe2 N12 O2 -","2","1","","Renzo Salzmann; Michael T. McMahon; Nathalie Godbout; Lori K. Sanders; Mark Wojdelski; Eric Oldfield","Solid-State NMR, Crystallographic and Density Functional Theory Investigation of Fe-CO and Fe-CO Analogue Metalloporphyrins and Metalloproteins","Journal of the American Chemical Society","1999","121","","3818","3828","10.1021/ja9832818","","","0.71073","MoKα","","0.1227","0.0594","","0.1673","0.1283","","","","1.025","1.152","1.152","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116362","10.4568","0.0002","12.9806","0.0001","15.9683","0.0002","80.695","0.001","76.982","0.001","72.018","0.001","1998.65","0.05","293","2","198","2","","","","","","","","6","P -1","-P 1","2","","Ru(OEP)(CO)(1-MeIm)","","- C42 H52 Cl2 N6 O Ru -","- C42 H50.86 Cl2 N6 O Ru -","- C84 H101.72 Cl4 N12 O2 Ru2 -","2","1","","Renzo Salzmann; Michael T. McMahon; Nathalie Godbout; Lori K. Sanders; Mark Wojdelski; Eric Oldfield","Solid-State NMR, Crystallographic and Density Functional Theory Investigation of Fe-CO and Fe-CO Analogue Metalloporphyrins and Metalloproteins","Journal of the American Chemical Society","1999","121","","3818","3828","10.1021/ja9832818","","","0.71073","MoKα","","0.0837","0.0593","","0.1433","0.1216","","","","1.142","1.096","1.096","","","","","has coordinates,has disorder","178934","2020-10-21","18:00:00",""
"4116363","10.3677","0.0003","12.9871","0.0004","15.9564","0.0005","80.635","0.001","76.731","0.001","72.219","0.001","1981.25","0.11","293","2","198","2","","","","","","","","6","P -1","-P 1","2","","Os(OEP)(CO)(1-MeIm)","","- C42 H52 Cl2 N6 O Os -","- C42 H52 Cl2 N6 O Os -","- C84 H104 Cl4 N12 O2 Os2 -","2","1","","Renzo Salzmann; Michael T. McMahon; Nathalie Godbout; Lori K. Sanders; Mark Wojdelski; Eric Oldfield","Solid-State NMR, Crystallographic and Density Functional Theory Investigation of Fe-CO and Fe-CO Analogue Metalloporphyrins and Metalloproteins","Journal of the American Chemical Society","1999","121","","3818","3828","10.1021/ja9832818","","","0.71073","MoKα","","0.1","0.0653","","0.1449","0.1228","","","","1.147","1.122","1.122","","","","","has coordinates,has disorder","178934","2020-10-21","18:00:00",""
"4116364","10.9981","0.0007","13.2076","0.0008","17.165","0.0011","73.86","","78.05","0.001","79.564","0.001","2322.8","0.3","198","2","198","2","","","","","","","","4","P -1","-P 1","2","","Fe(TPP)(iPrNC)(1-MeIm)","","- C54.5 H47 Fe N7 -","- C54.5 H47 Fe N7 -","- C109 H94 Fe2 N14 -","2","1","","Renzo Salzmann; Michael T. McMahon; Nathalie Godbout; Lori K. Sanders; Mark Wojdelski; Eric Oldfield","Solid-State NMR, Crystallographic and Density Functional Theory Investigation of Fe-CO and Fe-CO Analogue Metalloporphyrins and Metalloproteins","Journal of the American Chemical Society","1999","121","","3818","3828","10.1021/ja9832818","","","0.71073","MoKα","","0.1137","0.0663","","0.1988","0.1596","","","","1.078","1.149","1.149","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116365","11.904","0.0011","13.2592","0.0012","16.4523","0.0015","87.525","0.002","70.489","0.002","70.556","0.002","2301.3","0.4","198","2","198","2","","","","","","","","5","P -1","-P 1","2","","Fe-TPP-PhNO-py","","- C58.5 H42 Fe N6 O -","- C58.5 H42 Fe N6 O -","- C117 H84 Fe2 N12 O2 -","2","1","","Nathalie Godbout; Lori K. Sanders; Renzo Salzmann; Robert H. Havlin; Mark Wojdelski; Eric Oldfield","Solid-State NMR, Mössbauer, Crystallographic, and Density Functional Theory Investigation of Fe-O2 and Fe-O2 Analogue Metalloporphyrins and Metalloproteins","Journal of the American Chemical Society","1999","121","","3829","3844","10.1021/ja9832820","","","0.71073","MoKα","","0.1873","0.063","","0.1009","0.0801","","","","0.939","1.217","1.217","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116366","38.823","0.002","12.3148","0.0008","21.4172","0.0013","90","","90","","90","","10239.5","1.1","198","2","198","2","","","","","","","","5","I b a 2","I 2 -2c","45","","Fe(TPP)(NODMA)(py)","","- C64 H51 Fe N7 O -","- C64 H51 Fe N7 O -","- C512 H408 Fe8 N56 O8 -","8","1","","Nathalie Godbout; Lori K. Sanders; Renzo Salzmann; Robert H. Havlin; Mark Wojdelski; Eric Oldfield","Solid-State NMR, Mössbauer, Crystallographic, and Density Functional Theory Investigation of Fe-O2 and Fe-O2 Analogue Metalloporphyrins and Metalloproteins","Journal of the American Chemical Society","1999","121","","3829","3844","10.1021/ja9832820","","","0.71073","MoKα","","0.1429","0.0624","","0.1458","0.127","","","","1.043","1.3","1.3","","","","","has coordinates,has disorder","178934","2020-10-21","18:00:00",""
"4116367","10.779","0.002","17.829","0.003","22.728","0.004","103.22","0.004","93.811","0.004","97.839","0.004","4190.7","1.3","198","2","198","2","","","","","","","","5","P -1","-P 1","2","","TPP-Fe-MeIm-PhNO","","- C54 H39 Fe N7 O -","- C53.997 H38.9975 Fe N6.9995 O0.9995 -","- C215.988 H155.99 Fe4 N27.998 O3.998 -","4","2","","Nathalie Godbout; Lori K. Sanders; Renzo Salzmann; Robert H. Havlin; Mark Wojdelski; Eric Oldfield","Solid-State NMR, Mössbauer, Crystallographic, and Density Functional Theory Investigation of Fe-O2 and Fe-O2 Analogue Metalloporphyrins and Metalloproteins","Journal of the American Chemical Society","1999","121","","3829","3844","10.1021/ja9832820","","","0.71073","MoKα","","0.2395","0.0957","","0.2095","0.1728","","","","1.178","1.738","1.738","","","","","has coordinates,has disorder","178934","2020-10-21","18:00:00",""
"4116368","13.6795","0.0001","13.929","0.0003","23.132","0.0006","72.413","0.001","73.548","0.001","84.64","0.002","4029.42","0.14","293","2","198","2","","","","","","","","5","P -1","-P 1","2","","Fe(OEP)(PhNO)(1-MeIm)","","- C46 H55 Fe N7 O -","- C46 H55 Fe N7 O -","- C184 H220 Fe4 N28 O4 -","4","2","","Nathalie Godbout; Lori K. Sanders; Renzo Salzmann; Robert H. Havlin; Mark Wojdelski; Eric Oldfield","Solid-State NMR, Mössbauer, Crystallographic, and Density Functional Theory Investigation of Fe-O2 and Fe-O2 Analogue Metalloporphyrins and Metalloproteins","Journal of the American Chemical Society","1999","121","","3829","3844","10.1021/ja9832820","","","0.71073","MoKα","","0.1316","0.0591","","0.1726","0.135","","","","0.936","1.094","1.094","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116369","10.4844","0.0006","10.6084","0.0007","14.0904","0.0009","79.758","0.001","89.398","0.001","80.254","0.001","1519.63","0.16","293","2","198","2","","","","","","","","5","P -1","-P 1","2","","Co(OEP)(NO)","","- C36 H44 Co N5 O -","- C36 H44 Co N5 O -","- C72 H88 Co2 N10 O2 -","2","1","","Nathalie Godbout; Lori K. Sanders; Renzo Salzmann; Robert H. Havlin; Mark Wojdelski; Eric Oldfield","Solid-State NMR, Mössbauer, Crystallographic, and Density Functional Theory Investigation of Fe-O2 and Fe-O2 Analogue Metalloporphyrins and Metalloproteins","Journal of the American Chemical Society","1999","121","","3829","3844","10.1021/ja9832820","","","0.71073","MoKα","","0.0577","0.0394","","0.0915","0.082","","","","1.033","1.072","1.072","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116370","16.24","0.004","6.2157","0.0012","10.289","0.002","90","","99.23","0.02","90","","1025.2","0.4","223","2","223","2","","","","","","","","2","C 1 2/c 1","-C 2yc","15","Bicubyl","Cubylcubane","","- C16 H14 -","- C16 H14 -","- C64 H56 -","4","0.5","","Eaton, Philip E.; Pramod, Kakumanu; Emrick, Todd; Gilardi, Richard","Building with Cubane-1,4-diyl. Synthesis of Aryl-Substituted Cubanes, p-[n]Cubyls, and Cubane-Separated Bis(arenes)1","Journal of the American Chemical Society","1999","121","17","4111","4123","10.1021/ja983441f","","","0.71073","MoKα","","0.0675","0.0447","","0.1199","0.1046","","","","1.036","1.089","1.089","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116371","8.9775","0.0003","8.9775","0.0003","15.3644","0.001","90","","90","","120","","1072.4","0.09","294","2","294","2","","","","","","","","3","R -3 m :H","-R 3 2""","166","","","","- C16 H12 I2 -","- C16 H12 I2 -","- C48 H36 I6 -","3","0.0833333","","Eaton, Philip E.; Pramod, Kakumanu; Emrick, Todd; Gilardi, Richard","Building with Cubane-1,4-diyl. Synthesis of Aryl-Substituted Cubanes, p-[n]Cubyls, and Cubane-Separated Bis(arenes)1","Journal of the American Chemical Society","1999","121","17","4111","4123","10.1021/ja983441f","","","0.71073","MoKα","","0.0313","0.0265","","0.0655","0.0631","","","","1.166","1.215","1.215","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116372","5.5066","0.0008","5.939","0.0015","12.165","0.002","88.964","0.015","76.982","0.014","66.04","0.02","353.01","0.13","293","2","293","2","","","","","","","","2","P -1","-P 1","2","","","","- C22 H18 -","- C22 H18 -","- C22 H18 -","1","0.5","","Eaton, Philip E.; Pramod, Kakumanu; Emrick, Todd; Gilardi, Richard","Building with Cubane-1,4-diyl. Synthesis of Aryl-Substituted Cubanes, p-[n]Cubyls, and Cubane-Separated Bis(arenes)1","Journal of the American Chemical Society","1999","121","17","4111","4123","10.1021/ja983441f","","","1.54178","CuKα","","0.0791","0.0467","","0.1369","0.1099","","","","1.046","1.047","1.047","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116373","9.9531","0.0009","10.4357","0.0011","14.493","0.0015","89.126","0.007","89.068","0.007","62.874","0.004","1339.5","0.2","294","2","294","2","","","","","","","","2","P -1","-P 1","2","","(p-biphenyl)cubane","","- C20 H16 -","- C20 H16 -","- C80 H64 -","4","2","","Eaton, Philip E.; Pramod, Kakumanu; Emrick, Todd; Gilardi, Richard","Building with Cubane-1,4-diyl. Synthesis of Aryl-Substituted Cubanes, p-[n]Cubyls, and Cubane-Separated Bis(arenes)1","Journal of the American Chemical Society","1999","121","17","4111","4123","10.1021/ja983441f","","","0.71073","MoKα","","0.0902","0.0477","","0.1392","0.1073","","","","1.028","1.115","1.115","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116374","5.889","0.004","34.22","0.011","7.69","0.003","90","","107.52","0.04","90","","1477.8","1.3","293","2","293","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","Phenylbicubane","1-Phenyl-p-[2]cubyl","","- C22 H18 -","- C22 H18 -","- C88 H72 -","4","1","","Eaton, Philip E.; Pramod, Kakumanu; Emrick, Todd; Gilardi, Richard","Building with Cubane-1,4-diyl. Synthesis of Aryl-Substituted Cubanes, p-[n]Cubyls, and Cubane-Separated Bis(arenes)1","Journal of the American Chemical Society","1999","121","17","4111","4123","10.1021/ja983441f","","","1.54178","CuKα","","0.1432","0.0771","","0.2674","0.1913","","","","1.049","1.165","1.165","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116375","10.258","0.002","6.067","0.0015","62.852","0.017","90","","90","","90","","3911.6","1.6","223","2","223","2","","","","","","","synthesis at U. of Chicago","2","P n a 21","P 2c -2n","33","Phenyltercubyl","","","- C30 H24 -","- C30 H24 -","- C240 H192 -","8","2","","Eaton, Philip E.; Pramod, Kakumanu; Emrick, Todd; Gilardi, Richard","Building with Cubane-1,4-diyl. Synthesis of Aryl-Substituted Cubanes, p-[n]Cubyls, and Cubane-Separated Bis(arenes)1","Journal of the American Chemical Society","1999","121","17","4111","4123","10.1021/ja983441f","","","1.54178","CuKα","","0.1793","0.09","","0.3269","0.2133","","","","1.05","1.229","1.229","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116376","24.0738","0.0002","24.0738","0.0002","68.5828","0.0005","90","","90","","90","","39747","0.5","170","2","170","2","","","","","","","synthetic","5","I 41/a :2","-I 4ad","88","","","","- C186 H234 Ga4 N30 O42 -","- C197 H163 Ga4 N20 O32 -","- C1576 H1304 Ga32 N160 O256 -","8","0.5","","Thomas Beissel; Ryan E. Powers; Tatjana N. Parac; Kenneth N. Raymond","Dynamic Isomerization of a Supramolecular Tetrahedral M4L6 Cluster1","Journal of the American Chemical Society","1999","121","","4200","4206","10.1021/ja984046s","","","0.71073","MoKα","","0.1234","0.0888","","0.2523","0.2205","","","","1.033","1.085","1.085","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116377","7.564","0.002","30.261","0.009","6.268","0.003","90","0","90","0","90","0","1434.7","0.9","298","","","","","","","","","","Local laboratory","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 O2 -","- C16 H22 O2 -","- C64 H88 O8 -","4","1","","Naoki Yoshikawa; Yoichi M. A. Yamada; Jagattaran Das; Hiroaki Sasai; Masakatsu Shibasaki","Direct Catalytic Asymmetric Aldol Reaction","Journal of the American Chemical Society","1999","121","","4168","4178","10.1021/ja990031y","","","0.7107","MoKα","","","0.066","","","0.067","","","","","5.227","5.227","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116378","15.489","0.007","11.983","0.007","18.102","0.013","90","","91.23","0.05","90","","3359","3","295","2","295","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C34 H36 Cu F6 N4 P -","- C34 H36 Cu F6 N4 P -","- C136 H144 Cu4 F24 N16 P4 -","4","2","","Mark T. Miller; Peter K. Gantzel; Timothy B. Karpishin","A Highly Emissive Heteroleptic Copper(I) Bis(phenanthroline) Complex: [Cu(dbp)(dmp)]+ (dbp = 2,9-Di-tert-butyl-1,10-phenanthroline; dmp = 2,9-Dimethyl-1,10-phenanthroline)","Journal of the American Chemical Society","1999","121","","4292","4293","10.1021/ja9901415","","","0.71073","MoKα","","0.0877","0.0648","","0.1901","0.1662","","","","1.044","1.042","1.042","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116379","14.395","0.003","14.974","0.003","32.363","0.007","84.75","0.03","77.78","0.03","85.59","0.03","6777","3","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","[( 3-(Bis(diphenylmethylphosphine)palldium)-tetrabismuth][Dibromo- diphenyl bismuth]","","- C128 H124 Bi6 Br4 P8 Pd4 -","- C128 H124 Bi6 Br4 P8 Pd4 -","- C256 H248 Bi12 Br8 P16 Pd8 -","2","1","","Joseph L. Stark; Brian Harms; Ilse Guzman-Jimenez; Kenton H. Whitmire; Régis Gautier; Jean-François Halet; Jean-Yves Saillard","Different Ways To Distort a Tetracapped Tetrahedron on Route to Forming an E4M4 Cubane: The Case of [E4(Pd(PPh2Me)2)4][Ph2EX2]2 (E = Sb, X = Cl; E = Bi, X = Br)","Journal of the American Chemical Society","1999","121","","4409","4418","10.1021/ja982902u","","","0.71073","MoKa","","0.1249","0.055","","0.1658","0.1358","","","","1.039","1.121","1.121","","","","","has coordinates,has disorder","178934","2020-10-21","18:00:00",""
"4116380","14.176","0.003","14.77","0.003","32.465","0.007","85.08","0.03","77.96","0.03","85.23","0.03","6609","3","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","[tetrakis[u3-(bis(diphenylmethylphposphine)palladium)] tetraantimony] bis[diphenyldidichloroantimony]","","- C130 H128 Cl4 O0.5 P8 Pd4 Sb6 -","- C130 H128 Cl4 O0.5 P8 Pd4 Sb6 -","- C260 H256 Cl8 O P16 Pd8 Sb12 -","2","1","","Joseph L. Stark; Brian Harms; Ilse Guzman-Jimenez; Kenton H. Whitmire; Régis Gautier; Jean-François Halet; Jean-Yves Saillard","Different Ways To Distort a Tetracapped Tetrahedron on Route to Forming an E4M4 Cubane: The Case of [E4(Pd(PPh2Me)2)4][Ph2EX2]2 (E = Sb, X = Cl; E = Bi, X = Br)","Journal of the American Chemical Society","1999","121","","4409","4418","10.1021/ja982902u","","","0.71073","MoKα","","0.0502","0.0386","","0.1334","0.1206","","","","1.108","1.133","1.133","","","","","has coordinates,has disorder","301833","2025-08-20","15:22:59",""
"4116381","5.399","0.002","6.347","0.003","11.518","0.006","75.73","0.05","80.48","0.04","81.94","0.03","375.2","0.3","120","","293","2","","","","","","","","4","P -1","-P 1","2","","μ-Dioxodichloroniumhexafluoroantimonate","","- Cl2 F6 O2 Sb -","- Cl2 F6 O2 Sb -","- Cl4 F12 O4 Sb2 -","2","1","","Thomas Drews; Wolfram Koch; Konrad Seppelt","The Cl2O2+ Cation: Preparation and Structural Investigation of Cl2O2+SbF6- and Cl2O2+Sb2F11-","Journal of the American Chemical Society","1999","121","","4379","4384","10.1021/ja984474y","","","0.71069","MoKα","","0.0841","0.0507","","","0.0837","0.0936","","","","","","1.053","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116382","9.284","0.002","10.625","0.002","11.333","0.002","90","","90.04","0.01","90","","1117.9","0.4","120","","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","μ-Dioxodichloroniumenneafluorodiantimonate","","- Cl2 F11 O2 Sb2 -","- Cl2 F11 O2 Sb2 -","- Cl8 F44 O8 Sb8 -","4","1","","Thomas Drews; Wolfram Koch; Konrad Seppelt","The Cl2O2+ Cation: Preparation and Structural Investigation of Cl2O2+SbF6- and Cl2O2+Sb2F11-","Journal of the American Chemical Society","1999","121","","4379","4384","10.1021/ja984474y","","","0.71069","MoKα","","0.0259","0.0241","","","0.0636","0.0644","","","","","","1.186","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116383","10.553","0.002","11.361","0.003","12.081","0.003","90","","90","","90","","1448.4","0.6","130","","293","2","","","","","","","","3","C m c a","-C 2ac 2","64","","Trichloroniumhexafluoroantimonate","","- Cl3 F6 Sb -","- Cl3 F6 Sb -","- Cl24 F48 Sb8 -","8","","","Thomas Drews; Wolfram Koch; Konrad Seppelt","The Cl2O2+ Cation: Preparation and Structural Investigation of Cl2O2+SbF6- and Cl2O2+Sb2F11-","Journal of the American Chemical Society","1999","121","","4379","4384","10.1021/ja984474y","","","0.71069","MoKα","","0.022","0.0189","","","0.0461","0.0489","","","","","","1.013","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116384","7.653","0.001","12.623","0.002","12.207","0.001","90","","104.2","0.01","90","","1143.2","0.3","130","","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Trichloroniumenneafluorodiantimonate","","- Cl3 F11 Sb2 -","- Cl3 F11 Sb2 -","- Cl12 F44 Sb8 -","4","1","","Thomas Drews; Wolfram Koch; Konrad Seppelt","The Cl2O2+ Cation: Preparation and Structural Investigation of Cl2O2+SbF6- and Cl2O2+Sb2F11-","Journal of the American Chemical Society","1999","121","","4379","4384","10.1021/ja984474y","","","0.71069","MoKα","","0.037","0.0291","","","0.0752","0.0801","","","","","","1.088","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116385","11.213","0.002","11.898","0.001","11.308","0.002","90","","90.45","0.01","90","","1508.6","0.4","130","","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Trichloroniumhexadecafluorotriantimonate","","- Cl1.5 F8 Sb1.5 -","- Cl1.5 F8 Sb1.5 -","- Cl12 F64 Sb12 -","8","1","","Thomas Drews; Wolfram Koch; Konrad Seppelt","The Cl2O2+ Cation: Preparation and Structural Investigation of Cl2O2+SbF6- and Cl2O2+Sb2F11-","Journal of the American Chemical Society","1999","121","","4379","4384","10.1021/ja984474y","","","0.71069","MoKα","","0.0381","0.0206","","","0.0466","0.0539","","","","","","1.032","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116386","7.045","0.002","11.001","0.003","9.299","0.004","90","","94.42","0.04","90","","718.5","0.4","130","","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Trichloroniumhexafluoroarsenate","","- As Cl3 F6 -","- As Cl3 F6 -","- As4 Cl12 F24 -","4","1","","Thomas Drews; Wolfram Koch; Konrad Seppelt","The Cl2O2+ Cation: Preparation and Structural Investigation of Cl2O2+SbF6- and Cl2O2+Sb2F11-","Journal of the American Chemical Society","1999","121","","4379","4384","10.1021/ja984474y","","","0.71069","MoKα","","0.0301","0.0255","","","0.0611","0.0634","","","","","","1.118","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116387","10.7505","0.0006","11.1008","0.0007","12.4859","0.0008","90","","90","","90","","1490.06","0.16","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H22 N2 Ru -","- C15 H22 N2 Ru -","- C60 H88 N8 Ru4 -","4","1","","Jayani R. Perera; Mary Jane Heeg; H. Bernhard Schlegel; Charles H. Winter","Ruthenium Complexes Bearing η5-Pyrazolato Ligands","Journal of the American Chemical Society","1999","121","","4536","4537","10.1021/ja990109a","","","0.71073","MoKα","","0.0436","0.03","","0.0545","0.0509","","","","0.998","1.018","1.018","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116388","19.089","0.001","18.708","0.001","23.708","0.001","90","","90.7","0.01","90","","8465.9","0.7","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C139 H142 Cl22 Mo8 N16 O32 -","- C139 H120 Cl22.0002 Mo8 N16 O32 -","- C278 H240 Cl44.0004 Mo16 N32 O64 -","2","0.5","","F. Albert Cotton; Lee M. Daniels; Chun Lin; Carlos A. Murillo","Square and Triangular Arrays Based on Mo24+ and Rh24+ Units","Journal of the American Chemical Society","1999","121","","4538","4539","10.1021/ja9901563","","","0.71073","MoKα","","0.0999","0.0754","","0.1943","0.1723","","","","1.09","","","","","","","has coordinates,has disorder","178934","2020-10-21","18:00:00",""
"4116389","16.951","0.003","17.07","0.01","20.935","0.008","103.84","0.02","104.85","0.04","105.92","0.03","5309","4","273","2","273","2","","","","","","","","6","P -1","-P 1","2","","","","- C180 H180 Fe4 Mo8 N16 O32 -","- C179.68 H152 Fe4 Mo8 N16 O32 -","- C179.68 H152 Fe4 Mo8 N16 O32 -","1","0.5","","F. Albert Cotton; Lee M. Daniels; Chun Lin; Carlos A. Murillo","Square and Triangular Arrays Based on Mo24+ and Rh24+ Units","Journal of the American Chemical Society","1999","121","","4538","4539","10.1021/ja9901563","","","0.71073","MoKα","","0.1225","0.0846","","0.2508","0.2056","","","","1.077","","","","","","","has coordinates,has disorder","178934","2020-10-21","18:00:00",""
"4116390","19.072","0.0001","19.072","0.0001","12.5658","0.0002","90","","90","","120","","3958.34","0.07","293","2","193","2","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","keggin","","","- Al K5 O57 W12 -","- Al K5 O57 W12 -","- Al3 K15 O171 W36 -","3","0.25","","Ira A. Weinstock; Jennifer J. Cowan; Elena M. G. Barbuzzi; Huadong Zeng; Craig L. Hill","Equilibria between α and β Isomers of Keggin Heteropolytungstates","Journal of the American Chemical Society","1999","121","","4608","4617","10.1021/ja982908j","","","0.71073","MoKα","","0.0503","0.0342","","0.0745","","0.07","","","1.016","","","1.048","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116391","7.858","0.001","13.323","0.002","9.335","0.001","90","","102.95","0.02","90","","952.4","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H24 F6 Fe N10 P -","- C10 H24 F6 Fe N10 P -","- C20 H48 F12 Fe2 N20 P2 -","2","0.5","","Karsten Meyer; Eckhard Bill; Bernd Mienert; Thomas Weyhermüller; Karl Wieghardt","Photolysis of cis- and trans-[FeIII(cyclam)(N3)2]+ Complexes: Spectroscopic Characterization of a Nitridoiron(V) Species","Journal of the American Chemical Society","1999","121","","4859","4876","10.1021/ja983454t","","","0.71073","MoKα","","0.0631","0.0333","","0.0995","0.0858","","","","1.067","1.099","1.099","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116392","13.641","0.002","8.851","0.001","15.266","0.003","90","","99.53","0.02","90","","1817.7","0.5","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H24 Cl Fe N10 O4 -","- C10 H24 Cl Fe N10 O4 -","- C40 H96 Cl4 Fe4 N40 O16 -","4","1","","Karsten Meyer; Eckhard Bill; Bernd Mienert; Thomas Weyhermüller; Karl Wieghardt","Photolysis of cis- and trans-[FeIII(cyclam)(N3)2]+ Complexes: Spectroscopic Characterization of a Nitridoiron(V) Species","Journal of the American Chemical Society","1999","121","","4859","4876","10.1021/ja983454t","","","0.71073","MoKα","","0.0535","0.0396","","0.0939","0.0849","","","","1.063","1.091","1.091","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116393","15.385","0.003","8.027","0.002","12.471","0.003","90","","96.34","0.02","90","","1530.7","0.6","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H40 N2 O9 -","- C28 H40 N2 O9 -","- C56 H80 N4 O18 -","2","1","","Hoeon Kim; Lothar Esser; M. Bilayet Hossain; Di Xia; Chang-An Yu; Josep Rizo; Dick van der Helm; Johann Deisenhofer","Structure of Antimycin A1, a Specific Electron Transfer Inhibitor of Ubiquinol-Cytochrome c Oxidoreductase","Journal of the American Chemical Society","1999","121","","4902","4903","10.1021/ja990190h","","","1.54178","CuKα","","0.1211","0.0821","","0.2325","0.1983","","","","1.066","1.181","1.181","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116394","7.408","0.001","11.378","0.001","15.606","0.001","73.7","0.01","78.49","0.01","84.74","0.01","1236.3","0.2","293","2","293","2","","","","","","","selfmade","4","P -1","-P 1","2","Tris(pentafluorophenyl)alane","","","- C27 H9 Al F15 -","- C27 H9 Al F15 -","- C54 H18 Al2 F30 -","2","1","","Gregory S. Hair; Alan H. Cowley; Richard A. Jones; Brian G. McBurnett; Andreas Voigt","Arene Complexes of Al(C6F5)3. Relationship to a Déjà Vu Silylium Ion","Journal of the American Chemical Society","1999","121","","4922","4923","10.1021/ja9904336","","","0.71073","MoKα","","0.2372","0.0844","","0.2164","0.1495","","","","1.017","1.222","1.222","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116395","7.427","0.002","11.612","0.003","13.822","0.004","92.08","0.02","102.61","0.02","101.95","0.02","1133.9","0.6","293","2","293","2","","","","","","","selfmade","4","P -1","-P 1","2","Tris(pentafluorophenyl)alane","","","- C25 H8 Al F15 -","- C50 H16 Al2 F30 -","- C50 H16 Al2 F30 -","1","0.5","","Gregory S. Hair; Alan H. Cowley; Richard A. Jones; Brian G. McBurnett; Andreas Voigt","Arene Complexes of Al(C6F5)3. Relationship to a Déjà Vu Silylium Ion","Journal of the American Chemical Society","1999","121","","4922","4923","10.1021/ja9904336","","","0.71073","MoKα","","0.0453","0.0347","","0.123","0.1076","","","","1.023","1.04","1.04","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116396","7.4857","0.0003","9.9727","0.0003","17.7714","0.0006","90","","90","","90","","1326.68","0.08","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H14 Cr O3 -","- C14 H14 Cr O3 -","- C56 H56 Cr4 O12 -","4","1","","Malisa V. Troutman; Daniel H. Appella; Stephen L. Buchwald","Asymmetric Hydrogenation of Unfunctionalized Tetrasubstituted Olefins with a Cationic Zirconocene Catalyst","Journal of the American Chemical Society","1999","121","","4916","4917","10.1021/ja990535w","","","0.71073","MoKα","","0.069","0.0548","","0.1395","0.1277","","","","1.133","1.121","1.121","","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116397","19.2566","0.0002","16.3846","0.0002","11.2328","0.0001","90","","98.349","0.008","90","","3506.52","0.1","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C30 H22 F18 Ir N6 P3 -","- C30 H22 F18 Ir N6 P3 -","- C120 H88 F72 Ir4 N24 P12 -","4","1","","Jean-Paul Collin; Isabelle M. Dixon; Jean-Pierre Sauvage; J. A. Gareth Williams; Francesco Barigelletti; Lucia Flamigni","Synthesis and Photophysical Properties of Iridium(III) Bisterpyridine and Its Homologues: a Family of Complexes with a Long-Lived Excited State","Journal of the American Chemical Society","1999","121","","5009","5016","10.1021/ja9833669","","","0.71073","Mo-Kα","","0.044","0.034","","0.058","","0.052","","","1.24","","","1.115","","","","has coordinates","178934","2020-10-21","18:00:00",""
"4116398","18.398","0.004","6.232","0.003","19.902","0.003","90","","109.88","0.01","90","","2145.9","1.2","296.2","","296.2","","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C32 H20 -","- C32 H20 -","- C128 H80 -","4","1","","Munakata, Megumu; Wu, Liang Ping; Ning, Gui Ling; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Suenaga, Yusaku; Maeno, Naoto","Construction of Metal Sandwich Systems Derived from Assembly of Silver(I) Complexes with Polycyclic Aromatic Compounds","Journal of the American Chemical Society","1999","121","21","4968","4976","10.1021/ja983950h","","","0.7107","MoKα","","0.2269","0.0571","","","0.0401","0.0548","","","","","","1.147","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116399","9.837","0.005","11.874","0.006","11.658","0.002","90","","98.35","0.03","90","","1347.3","1","296.2","","296.2","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C22 H12 -","- C22 H12 -","- C88 H48 -","4","1","","Munakata, Megumu; Wu, Liang Ping; Ning, Gui Ling; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Suenaga, Yusaku; Maeno, Naoto","Construction of Metal Sandwich Systems Derived from Assembly of Silver(I) Complexes with Polycyclic Aromatic Compounds","Journal of the American Chemical Society","1999","121","21","4968","4976","10.1021/ja983950h","","","0.7107","MoKα","","0.0576","0.0576","","","0.0472","0.0471","","","","","","2.31","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116400","15.789","0.002","6.188","0.004","16.816","0.002","90","","111.115","0.007","90","","1532.7","1","296.2","","296.2","","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C32 H20 Ag3 Cl3 O12 -","- C32 H20 Ag3 Cl3 O12 -","- C64 H40 Ag6 Cl6 O24 -","2","0.5","","Munakata, Megumu; Wu, Liang Ping; Ning, Gui Ling; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Suenaga, Yusaku; Maeno, Naoto","Construction of Metal Sandwich Systems Derived from Assembly of Silver(I) Complexes with Polycyclic Aromatic Compounds","Journal of the American Chemical Society","1999","121","21","4968","4976","10.1021/ja983950h","","","0.7107","MoKα","","0.0302","0.0302","","","0.0404","0.0403","","","","","","1.515","","","","has coordinates","219221","2020-10-21","18:00:00",""
"4116401","29.538","0.003","10.882","0.001","24.084","0.002","90","","110.275","0.006","90","","7261.7","1.2","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C95 H56 Ag4 Cl4 O16 -","- C95 H48 Ag4 Cl4 O16 -","- C380 H192 Ag16 Cl16 O64 -","4","1","","Munakata, Megumu; Wu, Liang Ping; Ning, Gui Ling; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Suenaga, Yusaku; Maeno, Naoto","Construction of Metal Sandwich Systems Derived from Assembly of Silver(I) Complexes with Polycyclic Aromatic Compounds","Journal of the American Chemical Society","1999","121","21","4968","4976","10.1021/ja983950h","","","0.7107","MoKα","","0.0512","0.0512","","","0.0601","0.0601","","","","","","1.776","","","","has coordinates","219221","2020-10-21","18:00:00",""
"4116402","7.934","0.001","17.932","0.001","10.6046","0.0009","90","","92.097","0.009","90","","1507.7","0.2","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 Ag Cl O4 -","- C16 H16 Ag Cl O4 -","- C64 H64 Ag4 Cl4 O16 -","4","1","","Munakata, Megumu; Wu, Liang Ping; Ning, Gui Ling; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Suenaga, Yusaku; Maeno, Naoto","Construction of Metal Sandwich Systems Derived from Assembly of Silver(I) Complexes with Polycyclic Aromatic Compounds","Journal of the American Chemical Society","1999","121","21","4968","4976","10.1021/ja983950h","","","0.7107","MoKα","","0.0464","0.0464","","","0.0551","0.0551","","","","","","1.569","","","","has coordinates","219221","2020-10-21","18:00:00",""
"4116403","13.29","0.004","31.599","0.005","7.774","0.003","90","","92.46","0.03","90","","3261.7","1.7","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H24 Ag2 Cl2 O8 -","- C42 H18 Ag2 Cl2 O8 -","- C168 H72 Ag8 Cl8 O32 -","4","1","","Munakata, Megumu; Wu, Liang Ping; Ning, Gui Ling; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Suenaga, Yusaku; Maeno, Naoto","Construction of Metal Sandwich Systems Derived from Assembly of Silver(I) Complexes with Polycyclic Aromatic Compounds","Journal of the American Chemical Society","1999","121","21","4968","4976","10.1021/ja983950h","","","0.7107","MoKα","","0.0561","0.0561","","","0.0644","0.0644","","","","","","1.728","","","","has coordinates","219221","2020-10-21","18:00:00",""
"4116404","28.3689","0.0014","12.4003","0.0006","17.3397","0.0009","90","","96.306","0.001","90","","6062.9","0.5","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C5 H15 F20 N5 P10 Rh2 -","- C5 H15 F20 N5 P10 Rh2 -","- C40 H120 F160 N40 P80 Rh16 -","8","1","","Alan F. Heyduk; Ann M. Macintosh; Daniel G. Nocera","Four-Electron Photochemistry of Dirhodium Fluorophosphine Compounds","Journal of the American Chemical Society","1999","121","","5023","5032","10.1021/ja9902017","","","0.71073","MoKα","","0.0649","0.043","","0.1011","0.0715","","","","1.124","1.139","1.139","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116405","9.289","0.002","13.159","0.003","16.937","0.003","82.23","0.02","76.306","0.015","84.89","0.02","1989.5","0.7","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C22.5 H24 Br2 Cl3 F12 N3 P7 Rh2 -","- C22.5 H24 Br2 Cl3 F12 N3 P7 Rh2 -","- C45 H48 Br4 Cl6 F24 N6 P14 Rh4 -","2","1","","Alan F. Heyduk; Ann M. Macintosh; Daniel G. Nocera","Four-Electron Photochemistry of Dirhodium Fluorophosphine Compounds","Journal of the American Chemical Society","1999","121","","5023","5032","10.1021/ja9902017","","","0.71073","MoKα","","0.0516","0.0464","","0.1347","0.1183","","","","1.073","1.062","1.062","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116406","9.711","0.013","12.304","0.009","13.715","0.009","64.01","0.06","85.28","0.09","71.29","0.09","1392","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H32 I N O4 S3 -","- C26 H32 I N O4 S3 -","- C52 H64 I2 N2 O8 S6 -","2","1","","M. V. Alfimov; S. P. Gromov; Yu. V. Fedorov; O. A. Fedorova; A. I. Vedernikov; A. V. Churakov; L. G. Kuz'mina; J. A. K. Howard; S. Bossmann; A. Braun; M. Woerner; D. F. Sears; J. Saltiel","Synthesis, Structure, and Ion Selective Complexation of Trans and Cis Isomers of Photochromic Dithia-18-crown-6 Ethers","Journal of the American Chemical Society","1999","121","","4992","5000","10.1021/ja990370r","","","0.71073","MoKα","","0.0787","0.056","","0.1986","0.1779","","","","1.075","1.106","1.106","","","","","has coordinates,has disorder","301833","2025-08-20","15:22:59",""
"4116407","29.217","0.005","15.996","0.005","18.244","0.005","90","","94.965","0.01","90","","8494","4","200","2","200","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C72 H132 Fe4 O18 -","- C72 H110.4 Fe4 O18 -","- C288 H441.6 Fe16 O72 -","4","0.5","","A. L. Barra; A. Caneschi; A. Cornia; F. Fabrizi de Biani; D. Gatteschi; C. Sangregorio; R. Sessoli; L. Sorace","Single-Molecule Magnet Behavior of a Tetranuclear Iron(III) Complex. The Origin of Slow Magnetic Relaxation in Iron(III) Clusters","Journal of the American Chemical Society","1999","121","","5302","5310","10.1021/ja9818755","","","1.54052","CuKα","","0.141","0.075","","","0.2091","0.2509","","","","","","1.084","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116408","17.5143","0.0002","18.7538","0.0001","20.7147","0.0002","90","","111.945","0.001","90","","6310.95","0.11","173","2","173","2","","","","","","","Dr. H.-F. Hsu / Prof. L. Que, Jr.","6","C 1 2/c 1","-C 2yc","15","98089b","","","- C57 H80 Cl3 Fe2 N8 O17 -","- C56 H76 Cl3 Fe2 N8 O16 -","- C224 H304 Cl12 Fe8 N32 O64 -","4","0.5","","Hua-Fen Hsu; Yanhong Dong; Lijin Shu; Victor G. Young; Lawrence Que","Crystal Structure of a Synthetic High-Valent Complex with an Fe2(μ-O)2 Diamond Core. Implications for the Core Structures of Methane Monooxygenase Intermediate Q and Ribonucleotide Reductase Intermediate X","Journal of the American Chemical Society","1999","121","","5230","5237","10.1021/ja983666q","","","0.71073","MoKα","","0.0783","0.0603","","0.1568","0.1465","","","","1.04","1.106","1.106","","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116409","9.3223","0.0005","19.1403","0.0009","21.5806","0.0012","90","","98.795","0.003","90","","3805.4","0.3","130","2","130","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C40 H50 Cl Fe N7 O5 -","- C40 H50 Cl Fe N7 O5 -","- C160 H200 Cl4 Fe4 N28 O20 -","4","1","","Mary K. Ellison; W. Robert Scheidt","Synthesis, Molecular Structures, and Properties of Six-Coordinate [Fe(OEP)(L)(NO)]+ Derivatives: Elusive Nitrosyl Ferric Porphyrins","Journal of the American Chemical Society","1999","121","","5210","5219","10.1021/ja984308q","","","0.71073","MoKα","","0.0614","0.0504","","","0.1126","0.1192","","","","","","1.038","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116410","10.5062","0.0005","13.705","0.003","14.5932","0.0014","80.136","0.007","82.344","0.007","77.504","0.01","2011","0.5","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H50.5 Cl1.5 Fe N7 O5 -","- C42 H50.5 Cl1.5 Fe N7 O5 -","- C84 H101 Cl3 Fe2 N14 O10 -","2","1","","Mary K. Ellison; W. Robert Scheidt","Synthesis, Molecular Structures, and Properties of Six-Coordinate [Fe(OEP)(L)(NO)]+ Derivatives: Elusive Nitrosyl Ferric Porphyrins","Journal of the American Chemical Society","1999","121","","5210","5219","10.1021/ja984308q","","","0.71073","MoKα","","0.0828","0.0693","","","0.1922","0.2048","","","","","","1.03","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116411","10.1175","0.0004","13.1764","0.0009","29.975","0.003","90","","96.43","0.005","90","","3970.9","0.5","130","2","130","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H50 Cl Fe N7 O5 -","- C43 H50 Cl Fe N7 O5 -","- C172 H200 Cl4 Fe4 N28 O20 -","4","1","","Mary K. Ellison; W. Robert Scheidt","Synthesis, Molecular Structures, and Properties of Six-Coordinate [Fe(OEP)(L)(NO)]+ Derivatives: Elusive Nitrosyl Ferric Porphyrins","Journal of the American Chemical Society","1999","121","","5210","5219","10.1021/ja984308q","","","0.71073","MoKα","","0.0912","0.0806","","","0.1943","0.202","","","","","","1.081","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116412","12.748","0.002","22.8417","0.0016","14.8903","0.001","90","","99.677","0.005","90","","4274.2","0.8","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C86.8 H101 Cl3.8 Fe2 N12 O10 -","- C86.836 H91.03 Cl3.806 Fe2 N12 O10 -","- C173.672 H182.06 Cl7.612 Fe4 N24 O20 -","2","0.5","","Mary K. Ellison; W. Robert Scheidt","Synthesis, Molecular Structures, and Properties of Six-Coordinate [Fe(OEP)(L)(NO)]+ Derivatives: Elusive Nitrosyl Ferric Porphyrins","Journal of the American Chemical Society","1999","121","","5210","5219","10.1021/ja984308q","","","0.71073","MoKα","","0.0848","0.0655","","","0.1607","0.1761","","","","","","1.06","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116413","10.4276","0.0012","10.597","0.002","18.353","0.002","83.267","0.016","81.528","0.007","76.541","0.01","1943.5","0.5","130","2","130","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H48 Cl Fe N7 O5.4 -","- C40 H48 Cl Fe N7 O5.39 -","- C80 H96 Cl2 Fe2 N14 O10.78 -","2","1","","Mary K. Ellison; W. Robert Scheidt","Synthesis, Molecular Structures, and Properties of Six-Coordinate [Fe(OEP)(L)(NO)]+ Derivatives: Elusive Nitrosyl Ferric Porphyrins","Journal of the American Chemical Society","1999","121","","5210","5219","10.1021/ja984308q","","","0.71073","MoKα","","0.1717","0.1056","","","0.2584","0.3065","","","","","","1.02","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116414","28.074","0.005","11.287","0.001","23.654","0.003","90","0.01","117.1","0.01","90","0.01","6672.4","1.7","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C33 H74 N9 O12 -","- C43 H75 N9 O13 -","- C172 H300 N36 O52 -","4","1","","M. Dhanasekaran; F. Fabiola; V. Pattabhi; S. Durani","A Rationally Designed Turn-Helix Peptide","Journal of the American Chemical Society","1999","121","","5575","5576","10.1021/ja984237v","","","1.5418","CuKa","","0.1793","0.0988","","0.4641","0.2496","","","","1.136","1.076","1.076","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116415","17.742","0.002","18.815","0.002","21.564","0.002","112.265","0.007","103.62","0.007","97.633","0.007","6274","1.2","173","","173","","","","","","","","","8","P -1","-P 1","2","","","","- C126 H120 Ag F18 N10 O11 P3 Ru -","- C126 H108 Ag F18 N10 O9.5 P3 Ru -","- C252 H216 Ag2 F36 N20 O19 P6 Ru2 -","2","1","","Diego J. Cárdenas; Jean-Paul Collin; Pablo Gaviña; Jean-Pierre Sauvage; André De Cian; Jean Fischer; Nicola Armaroli; Lucia Flamigni; Veronica Vicinelli; Vincenzo Balzani","Synthesis, X-ray Structure, and Electrochemical and Excited-State Properties of Multicomponent Complexes Made of a [Ru(Tpy)2]2+ Unit Covalently Linked to a [2]-Catenate Moiety. Controlling the Energy-Transfer Direction by Changing the Catenate Metal Ion","Journal of the American Chemical Society","1999","121","","5481","5488","10.1021/ja990036v","","","0.71073","Mo-Kα","","0.166","0.068","","0.253","0.097","","","","5.532","1.8","1.8","","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116416","17.174","0.005","24.252","0.007","13.223","0.004","92.9","0.02","95","0.02","91.86","0.02","5476","3","173","","173","","","","","","","","","8","P -1","-P 1","2","","","","- C103 H104 Cu F18 N12 O12 P3 Ru -","- C103 H84 Cu F18 N12 O12 P3 Ru -","- C206 H168 Cu2 F36 N24 O24 P6 Ru2 -","2","1","","Diego J. Cárdenas; Jean-Paul Collin; Pablo Gaviña; Jean-Pierre Sauvage; André De Cian; Jean Fischer; Nicola Armaroli; Lucia Flamigni; Veronica Vicinelli; Vincenzo Balzani","Synthesis, X-ray Structure, and Electrochemical and Excited-State Properties of Multicomponent Complexes Made of a [Ru(Tpy)2]2+ Unit Covalently Linked to a [2]-Catenate Moiety. Controlling the Energy-Transfer Direction by Changing the Catenate Metal Ion","Journal of the American Chemical Society","1999","121","","5481","5488","10.1021/ja990036v","","","1.54184","Cu-Kα","","0.122","0.084","","0.147","","0.121","","","1.883","","","1.533","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116417","18.0798","0.0009","12.1004","0.0006","14.5384","0.0007","90","","110.213","0.001","90","","2984.7","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H44 N4 O4 -","- C32 H44 N4 O4 -","- C128 H176 N16 O16 -","4","1","","Stephen L. De Wall; Eric S. Meadows; Leonard J. Barbour; George W. Gokel","Solution- and Solid-State Evidence for Alkali Metal Cation-π Interactions with Indole, the Side Chain of Tryptophan","Journal of the American Chemical Society","1999","121","","5613","5614","10.1021/ja9907921","","","0.7107","MoKα","","0.0648","0.0458","","","0.1034","0.1139","","","","","","1.033","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116418","17.3841","0.0009","12.1395","0.0006","15.4777","0.0008","90","","91.854","0.001","90","","3264.6","0.3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H44 I N4 Na O4 -","- C32 H44 I N4 Na O4 -","- C128 H176 I4 N16 Na4 O16 -","4","0.5","","Stephen L. De Wall; Eric S. Meadows; Leonard J. Barbour; George W. Gokel","Solution- and Solid-State Evidence for Alkali Metal Cation-π Interactions with Indole, the Side Chain of Tryptophan","Journal of the American Chemical Society","1999","121","","5613","5614","10.1021/ja9907921","","","0.71073","MoKα","","0.0332","0.0277","","","0.0649","0.0669","","","","","","1.041","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116419","17.237","0.001","12.0426","0.0007","15.951","0.0009","90","","90.261","0.001","90","","3311","0.3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H44 I K N4 O4 -","- C32 H44 I K N4 O4 -","- C128 H176 I4 K4 N16 O16 -","4","0.5","","Stephen L. De Wall; Eric S. Meadows; Leonard J. Barbour; George W. Gokel","Solution- and Solid-State Evidence for Alkali Metal Cation-π Interactions with Indole, the Side Chain of Tryptophan","Journal of the American Chemical Society","1999","121","","5613","5614","10.1021/ja9907921","","","0.71073","MoKα","","0.0381","0.0291","","","0.0682","0.0711","","","","","","1.034","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116420","10.9698","0.0008","13.0812","0.0009","11.9828","0.0009","90","","95.062","0.001","90","","1712.8","0.2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H44 F6 K N4 O4 P -","- C32 H44 F6 K N4 O4 P -","- C64 H88 F12 K2 N8 O8 P2 -","2","0.5","","Stephen L. De Wall; Eric S. Meadows; Leonard J. Barbour; George W. Gokel","Solution- and Solid-State Evidence for Alkali Metal Cation-π Interactions with Indole, the Side Chain of Tryptophan","Journal of the American Chemical Society","1999","121","","5613","5614","10.1021/ja9907921","","","0.71073","MoKα","","0.049","0.0325","","","0.0842","0.0901","","","","","","1.049","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116421","9.715","0.007","15.052","0.01","22.819","0.015","90","","90","","90","","3337","4","298","","298","2","","","","","","","","4","P c 21 n","P -2n -2ac","33","dipyridiniomethane dodecamethyl-closo-decaborate(2-) acetonitrile","","","- C25 H51 B12 N3 -","- C25 H48 B12 N3 -","- C100 H192 B48 N12 -","4","1","","Toralf Peymann; Carolyn B. Knobler; M. Frederick Hawthorne","An Icosahedral Array of Methyl Groups Supported by an Aromatic Borane Scaffold: The [closo-B12(CH3)12]2- Ion","Journal of the American Chemical Society","1999","121","","5601","5602","10.1021/ja990884q","","","1.5418","CuKα","","0.1351","0.0735","","0.2316","0.1846","","","","1.042","1.128","1.128","","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116422","19.913","0.001","19.913","0.001","9.269","0.001","90","0.001","90","0.001","90","0.001","3675.4","0.5","298","","","","","","","","","","Local laboratory","4","I 4","I 4","79","","","","- C19 H25 N4 P -","- C19 H25 N4 P -","- C152 H200 N32 P8 -","8","1","","Jean Michel Brunel; Olivier Legrand; Sébastien Reymond; Gérard Buono","First Iminodiazaphospholidines with a Stereogenic Phosphorus Center. Application to Asymmetric Copper-Catalyzed Cyclopropanation","Journal of the American Chemical Society","1999","121","","5807","5808","10.1021/ja984295g","","","0.71073","xray","","","0.041","","","0.187","","","","","1.894","1.894","","","","","has coordinates,has Fobs","301833","2025-08-20","15:22:59",""
"4116423","12.7068","0.0002","13.0137","0.0002","14.3285","0.0002","70.13","0.001","72.953","0.001","65.408","0.001","1994.07","0.06","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","Dysprosium N, N', N'', N'''-tetrakis(R)-( )-1,4,7 ,10-tetraazacyclododecane","","- C20 H47 Dy F18 N8 O7.5 P3 -","- C20 H42 Dy F18 N8 O8.5 P3 -","- C40 H84 Dy2 F36 N16 O17 P6 -","2","1","","Silvio Aime; Alessandro Barge; James I. Bruce; Mauro Botta; Judith A. K. Howard; Janet M. Moloney; David Parker; Alvaro S. de Sousa; Mark Woods","NMR, Relaxometric, and Structural Studies of the Hydration and Exchange Dynamics of Cationic Lanthanide Complexes of Macrocyclic Tetraamide Ligands","Journal of the American Chemical Society","1999","121","","5762","5771","10.1021/ja990225d","","","0.71073","MoKα","","0.0271","0.0234","","0.0589","0.0563","","","","1.064","1.06","1.06","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116424","11.018","0.002","20.019","0.004","11.822","0.002","90","","91.3","0.03","90","","2606.9","0.8","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H40 Cl2 N4 O13 -","- C16 H29 Cl1.99 N4 O12.665 -","- C64 H116 Cl7.96 N16 O50.66 -","4","1","","Silvio Aime; Alessandro Barge; James I. Bruce; Mauro Botta; Judith A. K. Howard; Janet M. Moloney; David Parker; Alvaro S. de Sousa; Mark Woods","NMR, Relaxometric, and Structural Studies of the Hydration and Exchange Dynamics of Cationic Lanthanide Complexes of Macrocyclic Tetraamide Ligands","Journal of the American Chemical Society","1999","121","","5762","5771","10.1021/ja990225d","","","1.54178","CuKα","","0.0888","0.0815","","","0.2293","0.2501","","","","","","1.09","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116425","32.517","0.007","8.723","0.0017","18.638","0.004","90","","106.13","0.03","90","","5078","2","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H43 N8 O5.5 -","- C20 H43 N8 O5.5 -","- C160 H344 N64 O44 -","8","1","","Silvio Aime; Alessandro Barge; James I. Bruce; Mauro Botta; Judith A. K. Howard; Janet M. Moloney; David Parker; Alvaro S. de Sousa; Mark Woods","NMR, Relaxometric, and Structural Studies of the Hydration and Exchange Dynamics of Cationic Lanthanide Complexes of Macrocyclic Tetraamide Ligands","Journal of the American Chemical Society","1999","121","","5762","5771","10.1021/ja990225d","","","1.54184","CuKα","","0.0952","0.0765","","","0.1956","0.2179","","","","","","1.086","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116426","6.919","0.001","15.315","0.003","23.727","0.004","90","","90","","90","","2514.2","0.7","213","2","213","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Tricarbonylchloro(way)technetium(I)","","- C23 H26 Cl N4 O4 Tc -","- C23 H26 Cl N4 O4 Tc -","- C92 H104 Cl4 N16 O16 Tc4 -","4","1","","Roger Alberto; Roger Schibli; August P. Schubiger; Ulrich Abram; H.-J. Pietzsch; B. Johannsen","First Application of fac-[99mTc(OH2)3(CO)3]+ in Bioorganometallic Chemistry: Design, Structure, and in Vitro Affinity of a 5-HT1A Receptor Ligand Labeled with 99mTc","Journal of the American Chemical Society","1999","121","","6076","6077","10.1021/ja990765a","","","1.54184","CuKα","","0.0448","0.0333","","","0.0759","0.0799","","","","","","1.031","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116427","16.072","0.001","7.538","0.001","32.914","0.002","90","","103.349","0.003","90","","3879.8","0.6","220","","220","","","","","","","","by syntheses","2","P 1 21/a 1","-P 2yab","14","","","","- C38 H30 -","- C38 H30 -","- C228 H180 -","6","1.5","","Paul F. van Hutten; Jurjen Wildeman; Auke Meetsma; Georges Hadziioannou","Molecular Packing in Unsubstituted Semiconducting Phenylenevinylene Oligomer and Polymer","Journal of the American Chemical Society","1999","121","","5910","5918","10.1021/ja990934r","","","0.71073","MoKα","","0.238","0.0917","","","0.2114","0.2632","","","","","","0.882","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116428","10.0768","0.0004","11.0129","0.0005","28.318","0.0012","90","","91.302","0.001","90","","3141.8","0.2","173","2","173","2","","","","","","","Dr. S. Lange / Prof. L. Que","6","P 1 21/n 1","-P 2yn","14","98198a","","","- C28 H28 Cl2 Fe N6 O8 -","- C28 H28 Cl2 Fe N6 O8 -","- C112 H112 Cl8 Fe4 N24 O32 -","4","1","","Steven J. Lange; Hiroyuki Miyake; Lawrence Que","Evidence for a Nonheme Fe(IV)O Species in the Intramolecular Hydroxylation of a Phenyl Moiety","Journal of the American Chemical Society","1999","121","","6330","6331","10.1021/ja990233u","","","0.71073","MoKα","","0.1184","0.0653","","0.1155","0.1002","","","","1.08","1.196","1.196","","","","","has coordinates,has disorder","301833","2025-08-20","15:22:59",""
"4116429","9.8427","0.0007","13.982","0.0009","15.5076","0.001","64.763","0.001","77.158","0.001","88.792","0.001","1875.6","0.2","173","2","173","2","","","","","","","S. Lange / Prof. L. Que","6","P -1","-P 1","2","99074a","","","- C48 H41 B Fe N4 O1.5 -","- C48 H41 B Fe N4 O1.5 -","- C96 H82 B2 Fe2 N8 O3 -","2","1","","Steven J. Lange; Hiroyuki Miyake; Lawrence Que","Evidence for a Nonheme Fe(IV)O Species in the Intramolecular Hydroxylation of a Phenyl Moiety","Journal of the American Chemical Society","1999","121","","6330","6331","10.1021/ja990233u","","","0.71073","MoKα","","0.0497","0.0389","","0.1048","0.0993","","","","1.015","1.074","1.074","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116430","8.607","0.003","9.955","0.004","11.415","0.004","90","","111.09","0.04","90","","912.6","0.6","200","2","200","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C12 H25 B F4 O6 Pt -","- C12 H25 B F4 O6 Pt -","- C24 H50 B2 F8 O12 Pt2 -","2","1","","Henrik Junicke; Clemens Bruhn; Ralph Kluge; Anthony S. Serianni; Dirk Steinborn","Novel Platinum(IV)-Carbohydrate Complexes: Metal Ion Coordination Behavior of Monosaccharides in Organic Solvents","Journal of the American Chemical Society","1999","121","","6232","6241","10.1021/ja9902726","","","0.71073","MoKα","","0.0582","0.056","","0.1371","0.1353","","","","1.091","1.109","1.109","","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116431","9.851","0.002","11.141","0.004","20.418","0.006","90","","90","","90","","2240.9","1.1","220","2","220","2","","","","","","","see experimental","6","P 21 21 21","P 2ac 2ab","19","","","","- C15 H31 B F4 O7 Pt -","- C15 H31 B F4 O7 Pt -","- C60 H124 B4 F16 O28 Pt4 -","4","1","","Henrik Junicke; Clemens Bruhn; Ralph Kluge; Anthony S. Serianni; Dirk Steinborn","Novel Platinum(IV)-Carbohydrate Complexes: Metal Ion Coordination Behavior of Monosaccharides in Organic Solvents","Journal of the American Chemical Society","1999","121","","6232","6241","10.1021/ja9902726","","","0.71073","MoKα","","0.0873","0.0581","","0.1436","0.128","","","","0.955","1.021","1.021","","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116432","10.096","0.001","11.27","0.001","20.127","0.001","81.47","0.01","75.94","0.01","73.4","0.01","2121.2","0.3","123","2","123","2","","","","","","","","4","P -1","-P 1","2","","4,4'-bis[[3'',5''-bis[3''',5'''-bis(benzyloxy)]benzyloxy]phenylethyl]-2,2'-b ipyridine","","- C110 H96 N2 O12 -","- C110 H96 N2 O12 -","- C110 H96 N2 O12 -","1","0.5","","Fritz Vögtle; Marcus Plevoets; Martin Nieger; Gianluca C. Azzellini; Alberto Credi; Luisa De Cola; Valeria De Marchis; Margherita Venturi; Vincenzo Balzani","Dendrimers with a Photoactive and Redox-Active [Ru(bpy)3]2±Type Core: Photophysical Properties, Electrochemical Behavior, and Excited-State Electron-Transfer Reactions","Journal of the American Chemical Society","1999","121","","6290","6298","10.1021/ja990430t","","","0.71073","MoKα","","0.1133","0.0391","","","0.0708","","","","0.763","1.031","1.031","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116433","8.19","0.0004","13.932","0.001","16.002","0.001","90","","99.271","0.003","90","","1802.03","0.19","296.2","","296.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H23 N O3 -","- C20 H23 N O3 -","- C80 H92 N4 O12 -","4","1","","John L. Wood; Alexandra A. Holubec; Brian M. Stoltz; Matthew M. Weiss; Julie A. Dixon; Brian D. Doan; Mohammed F. Shamji; Jennifer M. Chen; Timothy P. Heffron","Application of Reactive Enols in Synthesis: A Versatile, Efficient, and Stereoselective Construction of the Welwitindolinone Carbon Skeleton","Journal of the American Chemical Society","1999","121","","6326","6327","10.1021/ja991022s","","","0.7107","MoKalpha","","","0.0607","","","0.0594","","","","","2.558","2.558","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116434","10.1123","0.0003","12.437","0.001","15.961","0.001","90","","104.98","0.01","90","","1939.1","0.2","183.2","","183.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C22 H27 N O4 -","- C22 H27 N O4 -","- C88 H108 N4 O16 -","4","1","","John L. Wood; Alexandra A. Holubec; Brian M. Stoltz; Matthew M. Weiss; Julie A. Dixon; Brian D. Doan; Mohammed F. Shamji; Jennifer M. Chen; Timothy P. Heffron","Application of Reactive Enols in Synthesis: A Versatile, Efficient, and Stereoselective Construction of the Welwitindolinone Carbon Skeleton","Journal of the American Chemical Society","1999","121","","6326","6327","10.1021/ja991022s","","","0.7107","MoKalpha","","","0.0471","","","0.0648","","","","","2.556","2.556","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116435","13.61","0.001","8.1789","0.0004","15.026","0.001","90","","93.319","0.003","90","","1669.81","0.18","183.2","","183.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H25 N O3 -","- C20 H21 N O3 -","- C80 H84 N4 O12 -","4","1","","John L. Wood; Alexandra A. Holubec; Brian M. Stoltz; Matthew M. Weiss; Julie A. Dixon; Brian D. Doan; Mohammed F. Shamji; Jennifer M. Chen; Timothy P. Heffron","Application of Reactive Enols in Synthesis: A Versatile, Efficient, and Stereoselective Construction of the Welwitindolinone Carbon Skeleton","Journal of the American Chemical Society","1999","121","","6326","6327","10.1021/ja991022s","","","0.7107","MoKalpha","","","0.0664","","","0.0605","","","","","2.063","2.063","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116436","35.29","0.01","8.897","0.009","11.656","0.008","90","","103.03","0.05","90","","3565","5","296.2","","296.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H23 Cl2 N O3 -","- C19 H23 Cl2 N O3 -","- C152 H184 Cl16 N8 O24 -","8","1","","John L. Wood; Alexandra A. Holubec; Brian M. Stoltz; Matthew M. Weiss; Julie A. Dixon; Brian D. Doan; Mohammed F. Shamji; Jennifer M. Chen; Timothy P. Heffron","Application of Reactive Enols in Synthesis: A Versatile, Efficient, and Stereoselective Construction of the Welwitindolinone Carbon Skeleton","Journal of the American Chemical Society","1999","121","","6326","6327","10.1021/ja991022s","","","0.7107","MoKalpha","","","0.0504","","","0.0525","","","","","1.501","1.501","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116437","8.1052","0.0003","9.418","0.0002","13.4027","0.0004","101.22","0.002","107.306","0.002","97.417","0.002","938.82","0.05","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C22 H20 Br N O3 -","- C22 H20 Br N O3 -","- C44 H40 Br2 N2 O6 -","2","1","","John L. Wood; Alexandra A. Holubec; Brian M. Stoltz; Matthew M. Weiss; Julie A. Dixon; Brian D. Doan; Mohammed F. Shamji; Jennifer M. Chen; Timothy P. Heffron","Application of Reactive Enols in Synthesis: A Versatile, Efficient, and Stereoselective Construction of the Welwitindolinone Carbon Skeleton","Journal of the American Chemical Society","1999","121","","6326","6327","10.1021/ja991022s","","","0.7107","MoKalpha","","","0.0349","","","0.0315","","","","","1.571","1.571","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116438","7.282","0.001","16.256","0.001","10.196","0.001","90","","91.46","0.01","90","","1206.6","0.2","296.2","","296.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 N O2 -","- C15 H15 N O2 -","- C60 H60 N4 O8 -","4","1","","John L. Wood; Alexandra A. Holubec; Brian M. Stoltz; Matthew M. Weiss; Julie A. Dixon; Brian D. Doan; Mohammed F. Shamji; Jennifer M. Chen; Timothy P. Heffron","Application of Reactive Enols in Synthesis: A Versatile, Efficient, and Stereoselective Construction of the Welwitindolinone Carbon Skeleton","Journal of the American Chemical Society","1999","121","","6326","6327","10.1021/ja991022s","","","0.7107","MoKalpha","","","0.0445","","","0.0683","","","","","4.051","4.051","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116439","5.395","0.002","4.887","0.002","4.986","0.002","90","","90","","90","","131.46","0.09","200","","200","","","","","","","","","3","P m n 21","P 2ac -2","31","","borane ammonia","","- B H6 N -","- B H6 N -","- B2 H12 N2 -","2","0.5","","Wim T. Klooster; Thomas F. Koetzle; Per E. M. Siegbahn; Thomas B. Richardson; Robert H. Crabtree","Study of the N-H...H-B Dihydrogen Bond Including the Crystal Structure of BH3NH3 by Neutron Diffraction","Journal of the American Chemical Society","1999","121","","6337","6343","10.1021/ja9825332","","neutron","1.0462","neutron","","0.2833","0.1664","","0.1602","0.1093","","","","1.0467","1.0158","1.0158","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116440","20.8935","0.0018","19.52","0.0018","25.113","0.002","90","","90.331","0.009","90","","10241.9","1.5","180","2","180","2","","","","","","","synthetic route","6","I 1 2/a 1","-I 2ya","15","","","","- C52 H92 I2 P2 Ru S -","- C52 H92 P2 Ru Si2 -","- C416 H736 P16 Ru8 Si16 -","8","1","","Fabien Delpech; Sylviane Sabo-Etienne; Jean-Claude Daran; Bruno Chaudret; Khansaa Hussein; Colin J. Marsden; Jean-Claude Barthelat","Ruthenium Complexes Containing Two Ru-(η2-Si-H) Bonds: Synthesis, Spectroscopic Properties, Structural Data, Theoretical Calculations, and Reactivity Studies","Journal of the American Chemical Society","1999","121","","6668","6682","10.1021/ja990199j","","","0.71073","MoKα","","","0.0257","","","0.0313","","","","","0.9675","0.9675","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116441","12.7187","0.0016","19.1092","0.0016","18.068","0.002","90","","90.594","0.013","90","","4391.1","0.8","160","2","160","2","","","","","","","synthetic route","6","C 1 c 1","C -2yc","9","","","","- C42 H86 I2 P2 Ru S -","- C42 H86 P2 Ru Si2 -","- C168 H344 P8 Ru4 Si8 -","4","1","","Fabien Delpech; Sylviane Sabo-Etienne; Jean-Claude Daran; Bruno Chaudret; Khansaa Hussein; Colin J. Marsden; Jean-Claude Barthelat","Ruthenium Complexes Containing Two Ru-(η2-Si-H) Bonds: Synthesis, Spectroscopic Properties, Structural Data, Theoretical Calculations, and Reactivity Studies","Journal of the American Chemical Society","1999","121","","6668","6682","10.1021/ja990199j","","","0.71073","MoKα","","","0.022","","","0.0247","","","","","1.0293","1.0293","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116442","9.907","0.001","10.9279","0.0012","24.785","0.003","99.037","0.011","99.503","0.011","100.28","0.011","2555.4","0.5","160","2","180","2","","","","","","","synthetic route","6","P -1","-P 1","2","","","","- C54 H80 I2 P2 Ru S -","- C54 H80 P2 Ru Si2 -","- C108 H160 P4 Ru2 Si4 -","2","1","","Fabien Delpech; Sylviane Sabo-Etienne; Jean-Claude Daran; Bruno Chaudret; Khansaa Hussein; Colin J. Marsden; Jean-Claude Barthelat","Ruthenium Complexes Containing Two Ru-(η2-Si-H) Bonds: Synthesis, Spectroscopic Properties, Structural Data, Theoretical Calculations, and Reactivity Studies","Journal of the American Chemical Society","1999","121","28","6668","6682","10.1021/ja990199j","","","0.71073","MoKα","","","0.0318","","","0.0355","","","","","","","1.0781","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116443","18.072","0.003","10.7807","0.0011","20.773","0.003","90","","106.855","0.018","90","","3873.3","1","150","2","150","2","","","","","","","synthetic route","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H50 I2 P2 Ru S -","- C42 H50 P2 Ru Si2 -","- C168 H200 P8 Ru4 Si8 -","4","1","","Fabien Delpech; Sylviane Sabo-Etienne; Jean-Claude Daran; Bruno Chaudret; Khansaa Hussein; Colin J. Marsden; Jean-Claude Barthelat","Ruthenium Complexes Containing Two Ru-(η2-Si-H) Bonds: Synthesis, Spectroscopic Properties, Structural Data, Theoretical Calculations, and Reactivity Studies","Journal of the American Chemical Society","1999","121","28","6668","6682","10.1021/ja990199j","","","0.71073","MoKα","","","0.0268","","","0.0278","","","","","1.0645","1.0645","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116444","20.272","0.002","19.862","0.003","24.91","0.003","90","","93.943","0.014","90","","10006","2","180","2","180","2","","","","","","","synthetic route","6","C 1 2/c 1","-C 2yc","15","","","","- C44 H93 O2.5 P2 Ru Si3 -","- C44 H93 O2.5 P2 Ru Si3 -","- C352 H744 O20 P16 Ru8 Si24 -","8","1","","Fabien Delpech; Sylviane Sabo-Etienne; Jean-Claude Daran; Bruno Chaudret; Khansaa Hussein; Colin J. Marsden; Jean-Claude Barthelat","Ruthenium Complexes Containing Two Ru-(η2-Si-H) Bonds: Synthesis, Spectroscopic Properties, Structural Data, Theoretical Calculations, and Reactivity Studies","Journal of the American Chemical Society","1999","121","28","6668","6682","10.1021/ja990199j","","","0.71073","MoKα","","","0.0326","","","0.04","","","","","1.0951","1.0951","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116445","7.2873","0.0017","13.992","0.002","10.872","0.004","90","","92.45","0.02","90","","1107.5","0.5","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 B Cl2 F4 N2 S4 -","- C4 B Cl2 F4 N2 S4 -","- C16 B4 Cl8 F16 N8 S16 -","4","1","","T. M. Barclay; L. Beer; A. W. Cordes; R. C. Haddon; M. I. Itkis; R. T. Oakley; K. E. Preuss; R. W. Reed","trans-4,4'-Dichloro-1,1',2,2',3,3'-tetrathiadiazafulvalene (DC-TAF) and Its 1:1 Radical Cation Salts [DC-TAF][X]: Preparation and Solid-State Properties of BF4-, ClO4-, and FSO3- Derivatives","Journal of the American Chemical Society","1999","121","","6657","6663","10.1021/ja990933z","","","0.7107","MolybdenumKα","","","0.039","","","0.046","","","","","1.01","1.01","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116446","7.3774","0.0011","14.1757","0.0018","10.942","0.002","90","","91.732","0.015","90","","1143.8","0.3","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 Cl2 F N2 O2 S5 -","- C4 Cl2 F2 N2 O2 S5 -","- C16 Cl8 F8 N8 O8 S20 -","4","1","","T. M. Barclay; L. Beer; A. W. Cordes; R. C. Haddon; M. I. Itkis; R. T. Oakley; K. E. Preuss; R. W. Reed","trans-4,4'-Dichloro-1,1',2,2',3,3'-tetrathiadiazafulvalene (DC-TAF) and Its 1:1 Radical Cation Salts [DC-TAF][X]: Preparation and Solid-State Properties of BF4-, ClO4-, and FSO3- Derivatives","Journal of the American Chemical Society","1999","121","","6657","6663","10.1021/ja990933z","","","0.7107","MolybdenumKα","","","0.047","","","0.054","","","","","1.15","1.15","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116447","7.3684","0.0014","14.0572","0.0019","10.942","0.002","90","","91.937","0.017","90","","1132.7","0.3","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 Cl3 N2 O4 S4 -","- C4 Cl3 N2 O4 S4 -","- C16 Cl12 N8 O16 S16 -","4","1","","T. M. Barclay; L. Beer; A. W. Cordes; R. C. Haddon; M. I. Itkis; R. T. Oakley; K. E. Preuss; R. W. Reed","trans-4,4'-Dichloro-1,1',2,2',3,3'-tetrathiadiazafulvalene (DC-TAF) and Its 1:1 Radical Cation Salts [DC-TAF][X]: Preparation and Solid-State Properties of BF4-, ClO4-, and FSO3- Derivatives","Journal of the American Chemical Society","1999","121","","6657","6663","10.1021/ja990933z","","","0.7093","MolybdenumKα","","","0.044","","0.049","","","","","","1.02","1.02","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116448","7.9364","0.0005","7.9364","0.0005","14.4339","0.001","90","","90","","120","","787.34","0.09","293","2","293","2","","","","","","","","3","R -3 :H","-R 3","148","","dititanium hexaniobium dodecaoxide","","- Nb6 O12 Ti2 -","- Nb6 O12 Ti2.16 -","- Nb18 O36 Ti6.48 -","3","0.166667","","Ekaterina V. Anokhina; Michael W. Essig; Cynthia S. Day; Abdessadek Lachgar","Ti2Nb6O12, a Novel Niobium Oxide Cluster Compound with ""Chevrel Phase"" Intercluster Connectivity Type","Journal of the American Chemical Society","1999","121","","6827","6833","10.1021/ja990759e","","","0.71073","MoKα","","0.0219","0.018","","","0.0342","0.0349","","","","","","1.116","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116449","17.0767","0.0003","9.1342","0.0003","16.3666","0.0005","90","","101.481","0.0016","90","","2501.81","0.12","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C21 H34 N8 Ni O8 -","- C21 H28 N8 Ni O8 -","- C84 H112 N32 Ni4 O32 -","4","1","","Ann J. Stemmler; Cynthia J. Burrows","The Sal-XH Motif for Metal-Mediated Oxidative DNA-Peptide Cross-Linking","Journal of the American Chemical Society","1999","121","","6956","6957","10.1021/ja991164m","","","0.71069","MoKα","","0.0339","0.0334","","","0.0969","0.0974","","","","","","1.089","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116450","23.966","0.006","9.581","0.002","19.106","0.004","90","","104.763","0.005","90","","4242.3","1.6","213","2","213","2","","","","","","","synthesized","5","C 1 2/c 1","-C 2yc","15","","Tetrakis(2,2'-dipyridylamidinato)dichromium(II)","","- C42 H36 Cl4 Cr2 N12 -","- C42 H36 Cl4 Cr2 N12 -","- C168 H144 Cl16 Cr8 N48 -","4","0.5","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; Isabel Pascual; Hong-Cai Zhou","Remarkable Effects of Axial π* Coordination on the Cr-Cr Quadruple Bond in Dichromium Paddlewheel Complexes","Journal of the American Chemical Society","1999","121","","6856","6861","10.1021/ja9912675","","","0.71073","MoKα","","0.0564","0.051","","0.1319","0.1255","","","","1.038","1.047","1.047","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116451","27.2495","0.0008","16.4863","0.0013","29.413","0.002","90","","110.416","0.005","90","","12383.6","1.4","213","2","213","2","","","","","","","synthesized","5","I 1 2/a 1","-I 2ya","15","","Tetrakis(2,6-diphenyliminopiperidinato)dichromium(II)","","- C72 H72 Cr2 N12 O -","- C72 H72 Cr2 N12 O -","- C576 H576 Cr16 N96 O8 -","8","1","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; Isabel Pascual; Hong-Cai Zhou","Remarkable Effects of Axial π* Coordination on the Cr-Cr Quadruple Bond in Dichromium Paddlewheel Complexes","Journal of the American Chemical Society","1999","121","","6856","6861","10.1021/ja9912675","","","0.71073","MoKα","","0.0751","0.0583","","0.1555","0.1325","","","","1.094","1.109","1.109","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116452","14.198","0.002","14.638","0.007","18.118","0.012","108.97","0.02","109.53","0.04","95.27","0.03","3270","3","213","2","213","2","","","","","","","synthesized","5","P -1","-P 1","2","","Tetrakis(2,6-diphenyliminopiperidinato)dichromium(II)","","- C76 H74 Cr2 N12 O2 -","- C76 H64 Cr2 N12 O2 -","- C152 H128 Cr4 N24 O4 -","2","1","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; Isabel Pascual; Hong-Cai Zhou","Remarkable Effects of Axial π* Coordination on the Cr-Cr Quadruple Bond in Dichromium Paddlewheel Complexes","Journal of the American Chemical Society","1999","121","","6856","6861","10.1021/ja9912675","","","0.71073","MoKα","","0.0716","0.0598","","0.1588","0.1467","","","","1.057","1.065","1.065","","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116453","27.197","0.003","16.467","0.008","29.511","0.01","90","","110.43","0.02","90","","12385","8","213","2","213","2","","","","","","","synthesized","5","I 1 2/a 1","-I 2ya","15","","Tetrakis(2,6-diphenyliminopiperidinato)dichromium(II)","","- C69 H66 Cl2 Cr2 N12 -","- C69.017 H64 Cl2.034 Cr2 N12 -","- C552.136 H512 Cl16.272 Cr16 N96 -","8","1","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; Isabel Pascual; Hong-Cai Zhou","Remarkable Effects of Axial π* Coordination on the Cr-Cr Quadruple Bond in Dichromium Paddlewheel Complexes","Journal of the American Chemical Society","1999","121","","6856","6861","10.1021/ja9912675","","","0.71073","MoKα","","0.091","0.0704","","0.189","0.1596","","","","1.084","1.095","1.095","","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116454","9.8649","0.0007","10.1338","0.0008","20.561","0.003","77.592","0.015","80.5","0.02","81.137","0.01","1964.9","0.4","213","2","213","2","","","","","","","synthesized","4","P -1","-P 1","2","","Tetrakas(2-phenyliminopiperidinato)dichromium(II)","","- C44 H52 Cr2 N8 -","- C44 H52 Cr2 N8 -","- C88 H104 Cr4 N16 -","2","1","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; Isabel Pascual; Hong-Cai Zhou","Remarkable Effects of Axial π* Coordination on the Cr-Cr Quadruple Bond in Dichromium Paddlewheel Complexes","Journal of the American Chemical Society","1999","121","","6856","6861","10.1021/ja9912675","","","0.71073","MoKα","","0.0565","0.0493","","0.1262","0.1171","","","","1.121","1.114","1.114","","","","","has coordinates,has disorder","301833","2025-08-20","15:22:59",""
"4116455","18.1","0.004","11.706","0.002","16.595","0.003","90","","102.48","0.03","90","","3433","1.2","213","2","213","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C80 H64 Cr4 N24 -","- C80 H64 Cr4 N24 -","- C160 H128 Cr8 N48 -","2","0.25","","F. Albert Cotton; Lee M. Daniels; Carlos A. Murillo; Isabel Pascual; Hong-Cai Zhou","Remarkable Effects of Axial π* Coordination on the Cr-Cr Quadruple Bond in Dichromium Paddlewheel Complexes","Journal of the American Chemical Society","1999","121","","6856","6861","10.1021/ja9912675","","","0.71073","MoKα","","0.1001","0.0686","","0.156","0.133","","","","1.209","1.231","1.231","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116456","18.009","0.003","5.917","0.001","29.989","0.006","90","","99.23","0.01","90","","3154.2","1","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H19 N O4 -","- C17 H19 N O4 -","- C136 H152 N8 O32 -","8","2","","Stephen F. Martin; Kenneth J. Barr; Dudley W. Smith; Scott K. Bur","Applications of Vinylogous Mannich Reactions. Concise Enantiospecific Total Syntheses of (+)-Croomine","Journal of the American Chemical Society","1999","121","","6990","6997","10.1021/ja990077r","","","0.71073","MoKα","","0.1777","0.0626","","0.1351","0.1009","","","","1.002","1.234","1.234","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116457","14.448","0.001","8.3839","0.0008","12.563","0.001","90","","112.41","0.01","90","","1406.8","0.2","198","2","198","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 N O3 -","- C16 H17 N O3 -","- C64 H68 N4 O12 -","4","1","","Stephen F. Martin; Kenneth J. Barr; Dudley W. Smith; Scott K. Bur","Applications of Vinylogous Mannich Reactions. Concise Enantiospecific Total Syntheses of (+)-Croomine","Journal of the American Chemical Society","1999","121","","6990","6997","10.1021/ja990077r","","","0.71073","MoKα","","0.0868","0.0491","","0.1216","0.1048","","","","1.032","1.124","1.124","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116458","6.154","0.004","11.495","0.015","12.322","0.01","96.24","0.09","102.65","0.06","97.01","0.08","835.9","1.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C36 H42 N2 O8 -","2","1","","Stephen F. Martin; Kenneth J. Barr; Dudley W. Smith; Scott K. Bur","Applications of Vinylogous Mannich Reactions. Concise Enantiospecific Total Syntheses of (+)-Croomine","Journal of the American Chemical Society","1999","121","","6990","6997","10.1021/ja990077r","","","0.71073","MoKα","","0.3303","0.1338","","0.2479","0.202","","","","1.768","2.827","2.827","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116459","12.162","0.002","6.282","0.001","21.198","0.002","90","","90.53","0.01","90","","1619.5","0.4","183","2","183","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C72 H84 N4 O16 -","4","1","","Stephen F. Martin; Kenneth J. Barr; Dudley W. Smith; Scott K. Bur","Applications of Vinylogous Mannich Reactions. Concise Enantiospecific Total Syntheses of (+)-Croomine","Journal of the American Chemical Society","1999","121","","6990","6997","10.1021/ja990077r","","","0.71073","MoKα","","0.0919","0.0506","","0.1153","0.0958","","","","1.052","1.113","1.113","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116460","11.82","0.001","7.5952","0.0007","36.186","0.005","90","","90","","90","","3248.6","0.6","193","2","193","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C18 H21 N O4 -","- C18 H21 N O4 -","- C144 H168 N8 O32 -","8","1","","Stephen F. Martin; Kenneth J. Barr; Dudley W. Smith; Scott K. Bur","Applications of Vinylogous Mannich Reactions. Concise Enantiospecific Total Syntheses of (+)-Croomine","Journal of the American Chemical Society","1999","121","","6990","6997","10.1021/ja990077r","","","0.71073","MoKα","","0.1213","0.0517","","0.1107","0.0885","","","","1.011","1.152","1.152","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116461","6.34","0.0005","12.796","0.001","9.4006","0.0006","90","","101.502","0.006","90","","747.32","0.1","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H19 N O4 -","- C17 H19 N O4 -","- C34 H38 N2 O8 -","2","1","","Stephen F. Martin; Kenneth J. Barr; Dudley W. Smith; Scott K. Bur","Applications of Vinylogous Mannich Reactions. Concise Enantiospecific Total Syntheses of (+)-Croomine","Journal of the American Chemical Society","1999","121","","6990","6997","10.1021/ja990077r","","","0.71073","MoKα","","0.0512","0.0399","","0.1047","0.0978","","","","1.047","1.067","1.067","","","","","has coordinates,has disorder","301833","2025-08-20","15:22:59",""
"4116462","6.1423","0.0004","9.9509","0.0008","13.63","0.001","74.383","0.007","88.256","0.007","73.228","0.006","767.19","0.1","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H19 N O4 -","- C17 H19 N O4 -","- C34 H38 N2 O8 -","2","1","","Stephen F. Martin; Kenneth J. Barr; Dudley W. Smith; Scott K. Bur","Applications of Vinylogous Mannich Reactions. Concise Enantiospecific Total Syntheses of (+)-Croomine","Journal of the American Chemical Society","1999","121","","6990","6997","10.1021/ja990077r","","","0.71073","MoKα","","0.0924","0.0495","","0.1193","0.0996","","","","0.995","1.053","1.053","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116463","3.9424","0.0002","7.2936","0.0004","24.6902","0.0011","90","","94.038","0.003","90","","708.19","0.06","161","2","161","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C7 H8 O5 -","- C7 H8 O5 -","- C28 H32 O20 -","4","1","","Scott Lovell; Paramjeet Subramony; Bart Kahr","Poppy Acid: Synthesis and Crystal Chemistry","Journal of the American Chemical Society","1999","121","","7020","7025","10.1021/ja990402a","","","0.7107","MoKα","","0.0693","0.0534","","","0.1542","0.1688","","","","","","1.097","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116464","15.9821","0.0004","6.3658","0.0001","19.6955","0.0005","90","","90","","90","","2003.8","0.08","161","2","161","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","meconic acid","","","- C7 H10 O10 -","- C7 H10 O10 -","- C56 H80 O80 -","8","1","","Scott Lovell; Paramjeet Subramony; Bart Kahr","Poppy Acid: Synthesis and Crystal Chemistry","Journal of the American Chemical Society","1999","121","","7020","7025","10.1021/ja990402a","","","0.7107","MoKα","","0.0578","0.0473","","","0.1426","0.1579","","","","","","1.169","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116465","12.2591","0.0006","9.8938","0.0005","16.2499","0.0004","90","","95.791","0.0003","90","","1960.88","0.15","161","2","161","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","meconic acid","","","- C7 H10 O10 -","- C7 H10 O10 -","- C56 H80 O80 -","8","1","","Scott Lovell; Paramjeet Subramony; Bart Kahr","Poppy Acid: Synthesis and Crystal Chemistry","Journal of the American Chemical Society","1999","121","","7020","7025","10.1021/ja990402a","","","0.7107","MoKα","","0.0664","0.0451","","","0.1184","0.1278","","","","","","1.044","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116466","10.2025","0.0002","6.7648","0.0002","18.0353","0.0006","90","","102.846","0.002","90","","1213.6","0.06","161","2","161","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H11 Br O6 -","- C11 H11 Br O6 -","- C44 H44 Br4 O24 -","4","1","","Scott Lovell; Paramjeet Subramony; Bart Kahr","Poppy Acid: Synthesis and Crystal Chemistry","Journal of the American Chemical Society","1999","121","","7020","7025","10.1021/ja990402a","","","0.7107","MoKα","","0.07","0.058","","","0.1596","0.1656","","","","","","1.141","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116467","10.3391","0.0002","12.8377","0.0006","14.0874","0.0006","90","","101.049","0.002","90","","1835.16","0.12","161","2","161","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H5 K O8 -","- C7 H5 K O8 -","- C56 H40 K8 O64 -","8","2","","Scott Lovell; Paramjeet Subramony; Bart Kahr","Poppy Acid: Synthesis and Crystal Chemistry","Journal of the American Chemical Society","1999","121","","7020","7025","10.1021/ja990402a","","","0.7107","MoKα","","0.0747","0.0488","","","0.1325","0.146","","","","","","1.034","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116468","6.554","0.002","16.73","0.004","9.633","0.002","90","","106","0.02","90","","1015.3","0.5","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H7 K O9 -","- C7 H7 K O9 -","- C28 H28 K4 O36 -","4","1","","Scott Lovell; Paramjeet Subramony; Bart Kahr","Poppy Acid: Synthesis and Crystal Chemistry","Journal of the American Chemical Society","1999","121","","7020","7025","10.1021/ja990402a","","","0.7093","Mo-Kα","","0.0904","0.0439","","","0.1002","0.1348","","","","","","1.117","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116469","14.841","0.008","21.055","0.016","29.308","0.016","90","","90","","90","","9158","10","154","2","154","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","C~60~^.^2Co(OEP)^.^CHCl~3~","","","- C133 H89 Cl3 Co2 N8 -","- C133 H89 Cl3 Co2 N8 -","- C532 H356 Cl12 Co8 N32 -","4","1","","Marilyn M. Olmstead; David A. Costa; Kalyani Maitra; Bruce C. Noll; Shane L. Phillips; Pamela M. Van Calcar; Alan L. Balch","Interaction of Curved and Flat Molecular Surfaces. The Structures of Crystalline Compounds Composed of Fullerene (C60, C60O, C70, and C120O) and Metal Octaethylporphyrin Units","Journal of the American Chemical Society","1999","121","","7090","7097","10.1021/ja990618c","","","0.71073","MoKα","","0.1299","0.0823","","0.1969","0.1711","","","","1.109","1.212","1.212","","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116470","14.833","0.004","20.936","0.005","29.515","0.009","90","","90","","90","","9166","4","156","2","156","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","C~60~^.^2Zn(OEP)^.^CHCl~3~","","","- C133 H89 Cl3 N8 Zn2 -","- C133 H89 Cl3 N8 Zn2 -","- C532 H356 Cl12 N32 Zn8 -","4","1","","Marilyn M. Olmstead; David A. Costa; Kalyani Maitra; Bruce C. Noll; Shane L. Phillips; Pamela M. Van Calcar; Alan L. Balch","Interaction of Curved and Flat Molecular Surfaces. The Structures of Crystalline Compounds Composed of Fullerene (C60, C60O, C70, and C120O) and Metal Octaethylporphyrin Units","Journal of the American Chemical Society","1999","121","","7090","7097","10.1021/ja990618c","","","0.71073","MoKα","","0.1062","0.0689","","","0.128","0.1483","","","","","","1.15","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116471","14.846","0.003","21.06","0.005","29.249","0.008","90","","90","","90","","9145","4","130","2","130","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","[Co(OEP)]~2~C~60~O^.^CHCl~3~","","","- C133 H89 Cl3 Co2 N8 O -","- C133 H89 Cl2.994 Co2 N8 O0.727 -","- C532 H356 Cl11.976 Co8 N32 O2.908 -","4","1","","Marilyn M. Olmstead; David A. Costa; Kalyani Maitra; Bruce C. Noll; Shane L. Phillips; Pamela M. Van Calcar; Alan L. Balch","Interaction of Curved and Flat Molecular Surfaces. The Structures of Crystalline Compounds Composed of Fullerene (C60, C60O, C70, and C120O) and Metal Octaethylporphyrin Units","Journal of the American Chemical Society","1999","121","","7090","7097","10.1021/ja990618c","","","1.54178","CuKα","","0.1133","0.0689","","0.1844","0.1548","","","","1.063","1.122","1.122","","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116472","14.359","0.0002","14.628","0.0002","18.7817","0.0002","89.879","0.001","87.452","0.001","61.097","0.001","3449.32","0.08","156","2","156","2","","","","","","","","5","P -1","-P 1","2","C~70~^.^Co(OEP)^.^CHCl~3~^.^benzene","","","- C113 H50 Cl3 Co N4 -","- C113 H50 Cl3 Co N4 -","- C226 H100 Cl6 Co2 N8 -","2","1","","Marilyn M. Olmstead; David A. Costa; Kalyani Maitra; Bruce C. Noll; Shane L. Phillips; Pamela M. Van Calcar; Alan L. Balch","Interaction of Curved and Flat Molecular Surfaces. The Structures of Crystalline Compounds Composed of Fullerene (C60, C60O, C70, and C120O) and Metal Octaethylporphyrin Units","Journal of the American Chemical Society","1999","121","","7090","7097","10.1021/ja990618c","","","0.71073","MoKα","","0.1649","0.1019","","0.3097","0.2549","","","","1.081","1.251","1.251","","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116473","14.412","0.002","14.723","0.002","18.882","0.002","89.579","0.011","86.987","0.01","60.562","0.01","3483.6","0.8","130","2","130","2","","","","","","","","5","P -1","-P 1","2","C~70~^.^Ni(OEP)^.^CHCl~3~^.^benzene","","","- C113 H50 Cl3 N4 Ni -","- C113 H50 Cl3 N4 Ni -","- C226 H100 Cl6 N8 Ni2 -","2","1","","Marilyn M. Olmstead; David A. Costa; Kalyani Maitra; Bruce C. Noll; Shane L. Phillips; Pamela M. Van Calcar; Alan L. Balch","Interaction of Curved and Flat Molecular Surfaces. The Structures of Crystalline Compounds Composed of Fullerene (C60, C60O, C70, and C120O) and Metal Octaethylporphyrin Units","Journal of the American Chemical Society","1999","121","","7090","7097","10.1021/ja990618c","","","1.54178","CuKα","","0.1645","0.0986","","","0.2464","0.3056","","","","","","1.02","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116474","18.951","0.004","20.784","0.004","15.81","0.003","90","","90","","90","","6227","2","130","2","130","2","","","","","","","","5","C m c m","-C 2c 2","63","C~60~^.^ClFe(OEP)^.^CHCl~3~","","","- C97 H45 Cl4 Fe N4 -","- C97 H48 Cl4 Fe N4 -","- C388 H192 Cl16 Fe4 N16 -","4","0.25","","Marilyn M. Olmstead; David A. Costa; Kalyani Maitra; Bruce C. Noll; Shane L. Phillips; Pamela M. Van Calcar; Alan L. Balch","Interaction of Curved and Flat Molecular Surfaces. The Structures of Crystalline Compounds Composed of Fullerene (C60, C60O, C70, and C120O) and Metal Octaethylporphyrin Units","Journal of the American Chemical Society","1999","121","","7090","7097","10.1021/ja990618c","","","1.54178","CuKα","","0.144","0.1258","","","0.3252","0.3435","","","","","","1.052","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116475","24.271","0.005","15.199","0.002","17.27","0.002","90","","108.974","0.011","90","","6024.7","1.7","130","2","130","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","(C~60~OC~60~)^.^2Co(OEP)^.^1.2CHCl~3~^.^0.8benzene","","","- C198 H94 Cl3.6 Co2 N8 O -","- C201.9 H94 Cl3.6 Co2 N8 O -","- C403.8 H188 Cl7.2 Co4 N16 O2 -","2","0.25","","Marilyn M. Olmstead; David A. Costa; Kalyani Maitra; Bruce C. Noll; Shane L. Phillips; Pamela M. Van Calcar; Alan L. Balch","Interaction of Curved and Flat Molecular Surfaces. The Structures of Crystalline Compounds Composed of Fullerene (C60, C60O, C70, and C120O) and Metal Octaethylporphyrin Units","Journal of the American Chemical Society","1999","121","","7090","7097","10.1021/ja990618c","","","1.54178","CuKα","","0.2366","0.1508","","","0.3887","0.4554","","","","","","1.439","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116476","14.402","0.006","14.654","0.007","18.836","0.011","90.088","0.01","87.45","0.014","61.38","0.007","3485","3","156","2","156","2","","","","","","","","5","P -1","-P 1","2","C~70~^.^Cu(OEP)^.^CHCl~3~^.^benzene","","","- C113 H50 Cl3 Cu N4 -","- C113 H50 Cl3 Cu N4 -","- C226 H100 Cl6 Cu2 N8 -","2","1","","Marilyn M. Olmstead; David A. Costa; Kalyani Maitra; Bruce C. Noll; Shane L. Phillips; Pamela M. Van Calcar; Alan L. Balch","Interaction of Curved and Flat Molecular Surfaces. The Structures of Crystalline Compounds Composed of Fullerene (C60, C60O, C70, and C120O) and Metal Octaethylporphyrin Units","Journal of the American Chemical Society","1999","121","","7090","7097","10.1021/ja990618c","","","0.71073","MoKα","","0.2197","0.1262","","","0.3233","0.3829","","","","","","1.14","","","","has coordinates,has disorder","178935","2020-10-21","18:00:00",""
"4116477","5.723","0.003","9.58","0.006","9.67","0.006","97.79","0.02","104.12","0.02","91.26","0.02","508.6","0.5","293","1","293","1","","","","","","","","5","P -1","-P 1","2","","","","- C14 H20 N4 Ni S6 -","- C18 H20 N4 Ni0.5 S10 -","- C18 H20 N4 Ni0.5 S10 -","1","0.5","","Maria Carla Aragoni; Massimiliano Arca; Francesco Demartin; Francesco A. Devillanova; Alessandra Garau; Francesco Isaia; Francesco Lelj; Vito Lippolis; Gaetano Verani","New [M(R,R'timdt)2] Metal-Dithiolenes and Related Compounds (M = Ni, Pd, Pt; R,R'timdt = Monoanion of Disubstituted Imidazolidine-2,4,5-trithiones): An Experimental and Theoretical Investigation","Journal of the American Chemical Society","1999","121","","7098","7107","10.1021/ja990827x","","","0.71073","MoKα","","0.107","0.043","","","0.048","","","","1.076","1.388","1.388","","","","","has coordinates","176338","2020-10-21","18:00:00",""
"4116478","15.419","0.002","15.799","0.002","12.989","0.001","90","0","126.14","0.01","90","0","2555.3","0.6","293","1","293","1","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C22 H20 N4 S6 -","- C22 H20 N4 S6 -","- C88 H80 N16 S24 -","4","0.5","","Maria Carla Aragoni; Massimiliano Arca; Francesco Demartin; Francesco A. Devillanova; Alessandra Garau; Francesco Isaia; Francesco Lelj; Vito Lippolis; Gaetano Verani","New [M(R,R'timdt)2] Metal-Dithiolenes and Related Compounds (M = Ni, Pd, Pt; R,R'timdt = Monoanion of Disubstituted Imidazolidine-2,4,5-trithiones): An Experimental and Theoretical Investigation","Journal of the American Chemical Society","1999","121","","7098","7107","10.1021/ja990827x","","","0.71073","MoKα","","0.039","0.026","","","0.033","","","","0.864","1.07","1.07","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116479","15.036","0.003","9.582","0.003","26.118","0.008","90","","102.23","0.02","90","","3677.5","1.8","296.2","","296.2","","","","","","","","","8","P 1 2/n 1","-P 2yac","13","","","","- C25 H27 Br Cl2 F12 Mn N2 O7 -","- C25 H27 Br Cl2 F12 Mn N2 O7 -","- C100 H108 Br4 Cl8 F48 Mn4 N8 O28 -","4","1","","Fumiyasu Iwahori; Katsuya Inoue; Hiizu Iwamura","Mn(II)-Induced Formation and Structural Elucidation of a [3 + 3] Benzene Dimer Derivative from m-Phenylenebis(N-tert-butylaminoxyl)","Journal of the American Chemical Society","1999","121","","7264","7265","10.1021/ja9844534","","","0.7107","MoKα","","0.1445","0.0714","","0.0803","0.078","","","","3.305","4.468","4.468","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116480","4.9976","0.0009","10.802","0.004","12.494","0.004","81.28","0.03","82.871","0.019","83.31","0.02","658.2","0.3","294","","294","","","","","","","","","3","P -1","-P 1","2","","","","- C30 H24 N6 -","- C30 H24 N6 -","- C30 H24 N6 -","1","0.5","","James L. Foley; Lian Li; Daniel J. Sandman; Michael J. Vela; Bruce M. Foxman; Rick Albro; Craig J. Eckhardt","Side Group Interactions in a Polydiacetylene Single Crystal","Journal of the American Chemical Society","1999","121","","7262","7263","10.1021/ja990436i","","","1.54178","CuKα","","","0.0652","","","0.086","","","","","0.9666","0.9666","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116481","4.935","0.002","10.861","0.007","12.373","0.012","82.77","0.07","83.84","0.07","83.25","0.05","650.5","0.8","294","","294","","","","","","","","?","3","P -1","-P 1","2","","","","- C15 H12 N3 -","- C15 H12 N3 -","- C30 H24 N6 -","2","1","","James L. Foley; Lian Li; Daniel J. Sandman; Michael J. Vela; Bruce M. Foxman; Rick Albro; Craig J. Eckhardt","Side Group Interactions in a Polydiacetylene Single Crystal","Journal of the American Chemical Society","1999","121","","7262","7263","10.1021/ja990436i","","","1.54178","CuKα","","","0.0845","","","0.1013","","","","","1.4143","1.4143","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116482","4.93","0.003","10.839","0.013","12.33","0.01","83.41","0.08","84.08","0.07","83.24","0.08","647.3","1","294","","294","","","","","","","","?","3","P -1","-P 1","2","","","","- C15 H12 N3 -","- C30 H24 N6 -","- C30 H24 N6 -","1","0.5","","James L. Foley; Lian Li; Daniel J. Sandman; Michael J. Vela; Bruce M. Foxman; Rick Albro; Craig J. Eckhardt","Side Group Interactions in a Polydiacetylene Single Crystal","Journal of the American Chemical Society","1999","121","","7262","7263","10.1021/ja990436i","","","1.54178","CuKα","","","0.0847","","","0.1056","","","","","1.1783","1.1783","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116483","4.9192","0.0016","10.847","0.005","12.21","0.01","84.49","0.06","84.7","0.05","83.1","0.03","641.6","0.6","294","","294","","","","","","","","?","3","P -1","-P 1","2","","","","- C15 H12 N3 -","- C15 H12 N3 -","- C30 H24 N6 -","2","1","","James L. Foley; Lian Li; Daniel J. Sandman; Michael J. Vela; Bruce M. Foxman; Rick Albro; Craig J. Eckhardt","Side Group Interactions in a Polydiacetylene Single Crystal","Journal of the American Chemical Society","1999","121","","7262","7263","10.1021/ja990436i","","","1.54178","CuKα","","","0.0904","","","0.1158","","","","","1.1492","1.1492","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116484","4.9085","0.0014","10.89","0.01","12.007","0.005","86.44","0.05","85.68","0.03","83.19","0.05","634.6","0.7","294","","294","","","","","","","","?","3","P -1","-P 1","2","","","","- C15 H12 N3 -","- C15 H12 N3 -","- C30 H24 N6 -","2","1","","James L. Foley; Lian Li; Daniel J. Sandman; Michael J. Vela; Bruce M. Foxman; Rick Albro; Craig J. Eckhardt","Side Group Interactions in a Polydiacetylene Single Crystal","Journal of the American Chemical Society","1999","121","","7262","7263","10.1021/ja990436i","","","1.54178","CuKα","","","0.0914","","","0.1043","","","","","1.1617","1.1617","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116485","4.9067","0.0005","10.9054","0.0009","11.8787","0.0015","87.517","0.009","86.25","0.01","83.147","0.008","629.33","0.12","294","","294","","","","","","","","?","3","P -1","-P 1","2","","","","- C15 H12 N3 -","- C15 H12 N3 -","- C30 H24 N6 -","2","1","","James L. Foley; Lian Li; Daniel J. Sandman; Michael J. Vela; Bruce M. Foxman; Rick Albro; Craig J. Eckhardt","Side Group Interactions in a Polydiacetylene Single Crystal","Journal of the American Chemical Society","1999","121","","7262","7263","10.1021/ja990436i","","","1.54178","CuKα","","","0.0801","","","0.1063","","","","","1.0335","1.0335","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116486","4.9052","0.0003","10.921","0.001","11.833","0.002","87.908","0.011","86.45","0.01","83.132","0.007","627.86","0.13","294","","294","","","","","","","","?","3","P -1","-P 1","2","","","","- C15 H12 N3 -","- C15 H12 N3 -","- C30 H24 N6 -","2","1","","James L. Foley; Lian Li; Daniel J. Sandman; Michael J. Vela; Bruce M. Foxman; Rick Albro; Craig J. Eckhardt","Side Group Interactions in a Polydiacetylene Single Crystal","Journal of the American Chemical Society","1999","121","","7262","7263","10.1021/ja990436i","","","1.54178","CuKα","","","0.0781","","","0.1087","","","","","0.976","0.976","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116487","9.751","0.001","12.457","0.001","10.542","0.001","90","","110.63","0.01","90","","1198.4","0.2","300","2","300","2","","","","","","","synthetic","5","P 1 21/n 1","-P 2yn","14","","Hexakis(carbonyl)iron(II) undecafluorodiantimonate(V),","","- C6 F22 Fe O6 Sb4 -","- C6 F22 Fe O6 Sb4 -","- C12 F44 Fe2 O12 Sb8 -","2","0.5","","Eduard Bernhardt; Bianca Bley; Rudolf Wartchow; Helge Willner; Eckhard Bill; Peter Kuhn; Iona H. T. Sham; Matthias Bodenbinder; Raimund Bröchler; Friedhelm Aubke","Hexakis(carbonyl)iron(II) Undecafluorodiantimonate(V), [Fe(CO)6][Sb2F11]2, and -Hexafluoroantimonate(V), [Fe(CO)6][SbF6]2, Their Syntheses, and Spectroscopic and Structural Characterization by Single Crystal X-ray Diffraction and Normal Coordinate Analysis","Journal of the American Chemical Society","1999","121","","7188","7200","10.1021/ja990958y","","","0.71073","MoKα","","0.0585","0.0282","","0.0532","","0.0483","","","0.843","","","0.958","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116488","8.258","0.001","8.258","0.001","12.471","0.002","90","","90","","90","","850.5","0.2","300","2","300","2","","","","","","","synthetic","5","P 4/m n c","-P 4 2n","128","","Hexakis(carbonyl)iron(II) hexafluoroantimonate(V),","","- C6 F12 Fe O6 Sb2 -","- C6 F12 Fe O6 Sb2 -","- C12 F24 Fe2 O12 Sb4 -","2","0.125","","Eduard Bernhardt; Bianca Bley; Rudolf Wartchow; Helge Willner; Eckhard Bill; Peter Kuhn; Iona H. T. Sham; Matthias Bodenbinder; Raimund Bröchler; Friedhelm Aubke","Hexakis(carbonyl)iron(II) Undecafluorodiantimonate(V), [Fe(CO)6][Sb2F11]2, and -Hexafluoroantimonate(V), [Fe(CO)6][SbF6]2, Their Syntheses, and Spectroscopic and Structural Characterization by Single Crystal X-ray Diffraction and Normal Coordinate Analysis","Journal of the American Chemical Society","1999","121","","7188","7200","10.1021/ja990958y","","","0.71073","MoKα","","0.0377","0.0259","","0.0668","","0.0626","","","1.026","","","1.13","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116489","10.526","0.003","10.774","0.003","10.818","0.005","90","","90","","90","","1226.8","0.7","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(4R,5S,S(S))-4-(tert-butylsulfinyl)bicyclo(3.3.0)oct-1-en-3-one","","- C12 H18 O2 S -","- C12 H18 O2 S -","- C48 H72 O8 S4 -","4","1","","Javier Adrio; Juan C. Carretero","The tert-Butylsulfinyl Group as a Highly Efficient Chiral Auxiliary in Asymmetric Pauson-Khand Reactions","Journal of the American Chemical Society","1999","121","","7411","7412","10.1021/ja990546p","","","1.54178","CuKα","","0.0364","0.0353","","0.1055","0.1026","","","","0.586","0.582","0.582","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116490","13.352","0.001","14.035","0.001","20.269","0.002","90","","106.599","0.002","90","","3640","0.5","213","2","213","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H42 Cd Cl2 N6 O9 Pt -","- C33 H36 Cd Cl2 N6 O9 Pt -","- C132 H144 Cd4 Cl8 N24 O36 Pt4 -","4","1","","Tadashi Yamaguchi; Fumie Yamazaki; Tasuku Ito","The First Examples of Platinum(II)-Cadmium(II) Bonds: The Role of Strong Field Ligands in Making Dative Pt\ρightarrowM Bonds","Journal of the American Chemical Society","1999","121","","7405","7406","10.1021/ja991053n","","","0.7107","MoKα","","0.1093","0.0506","","","","0.1452","","","","","","0.779","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116491","20.966","0.002","11.314","0.001","16.582","0.002","90","","120.944","0.002","90","","3373.6","0.6","293","2","293","2","","","","","","","","7","C 1 2 1","C 2y","5","","","","- C20 H34 Cd Cl2 N6 O8 Pt -","- C23 H34 Cd Cl2 N6 O9 Pt -","- C92 H136 Cd4 Cl8 N24 O36 Pt4 -","4","1","","Tadashi Yamaguchi; Fumie Yamazaki; Tasuku Ito","The First Examples of Platinum(II)-Cadmium(II) Bonds: The Role of Strong Field Ligands in Making Dative Pt\ρightarrowM Bonds","Journal of the American Chemical Society","1999","121","","7405","7406","10.1021/ja991053n","","","0.7107","MoKα","","0.0615","0.0373","","","","0.0876","","","","","","0.941","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116492","9.108","0.001","10.059","0.001","13.633","0.001","90","","97.023","0.001","90","","1239.6","0.2","150","0.1","150","0.1","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H12 F6 N2 O2 U2 -","- C4 H6 F6 N2 O4 U2 -","- C16 H24 F24 N8 O16 U8 -","4","0.5","","P. S. Halasyamani; S. M. Walker; D. O'Hare","The First Open Framework Actinide Material (C4N2H12)U2O4F6 (MUF-1)","Journal of the American Chemical Society","1999","121","","7415","7416","10.1021/ja9912271","","","0.71073","MoKα","","0.0403","0.0399","","0.1031","0.1029","","","","1.103","1.103","1.103","","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116493","23.282","0.002","16.787","0.002","15.0481","0.0014","90","","90","","90","","5881.3","1","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","(Me5CpRe)2[Co2(CO)5]B4H4","","- C25 H34 B4 Co2 O5 Re2 -","- C25 H34 B4 Co2 O5 Re2 -","- C200 H272 B32 Co16 O40 Re16 -","8","1","","Sundargopal Ghosh; Maoyu Shang; Thomas P. Fehlner","A Novel Coordinated Inorganic Benzene: Synthesis and Characterization of {η5-C5Me5Re}2{μ-η6:η6-B4H4Co2(CO)5}","Journal of the American Chemical Society","1999","121","","7451","7452","10.1021/ja991306c","","","0.71073","MoKα","","0.0752","0.0368","","","0.0757","0.0915","","","","","","1","","","","has coordinates","178935","2020-10-21","18:00:00",""
"4116494","10.556","0.0007","12.225","0.0007","11.7344","0.0008","90","","105.213","0.002","90","","1461.22","0.16","193","2","193","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H23 N O3 -","- C16 H23 N O3 -","- C64 H92 N4 O12 -","4","1","","Andrew S. Kende; Terrence L. Smalley; He Huang","Total Synthesis of (\±)-Isostemofoline","Journal of the American Chemical Society","1999","121","","7431","7432","10.1021/ja991528a","","","0.71073","MoKα","","0.0866","0.0603","","0.1289","0.1179","","","","1.152","1.211","1.211","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116495","8.962","0.003","11.569","0.002","12.316","0.002","90","","105.48","0.01","90","","1230.6","0.5","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H17 N2 O6.5 V -","- C8 H16 N2 O6.5 V -","- C32 H64 N8 O26 V4 -","4","1","","Kawabe, Kenji; Tadokoro, Makoto; Ichimura, Akio; Kojima, Yoshitane; Takino, Toshikazu; Sakurai, Hiromu","Stereospecific and Structure-Dependent Insulin-Mimetic Oxovanadium(IV) Complexes with N,N'-Ethylenebis(amino acids)","Journal of the American Chemical Society","1999","121","34","7937","7938","10.1021/ja984225+","","","0.7107","MoKα","","0","0","","","0","0.0515","","","","","","1.525","","","","has coordinates","270160","2021-10-29","11:54:26",""
"4116496","7.6043","0.0005","9.049","0.001","6.7747","0.0009","99.2","0.01","102.186","0.008","78.951","0.009","443.75","0.08","296.2","","296.2","","","","","","","","","6","P 1","P 1","1","","","","- C12 H24 N2 O6 S2 V -","- C12 H24 N2 O6 S2 V -","- C12 H24 N2 O6 S2 V -","1","1","","Kawabe, Kenji; Tadokoro, Makoto; Ichimura, Akio; Kojima, Yoshitane; Takino, Toshikazu; Sakurai, Hiromu","Stereospecific and Structure-Dependent Insulin-Mimetic Oxovanadium(IV) Complexes with N,N'-Ethylenebis(amino acids)","Journal of the American Chemical Society","1999","121","34","7937","7938","10.1021/ja984225+","","","1.5418","CuKα","","0.0276","0.0276","","","0.0382","0.0382","","","","","","1.36","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116497","15.8","0.002","16.424","0.004","8.073","0.002","90","","90","","90","","2094.9","0.8","23","","23","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C20 H27 Cl Ru S2 Ti -","- C80 H108 Cl4 Ru4 S8 Ti4 -","- C80 H108 Cl4 Ru4 S8 Ti4 -","","","","Shin-ichiro Kabashima; Shigeki Kuwata; Masanobu Hidai","Electron-Deficient Early-Late Heterobimetallic Sulfido Clusters. Unusual Reactivities of Ti2Ru2S4 Cubane-Type Clusters with Four Cyclopentadienyl Coligands","Journal of the American Chemical Society","1999","121","","7837","7845","10.1021/ja990034a","","","0.7107","MoKalpha","","","0.028","","","0.022","","","","","2.46","2.46","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116498","16.799","0.001","19.335","0.002","10.035","0.001","90","","90","","90","","3259.5","0.5","296.2","","296.2","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C30 H40 Ru2 S4 Ti2 -","- C30 H40 Ru2 S4 Ti2 -","- C120 H160 Ru8 S16 Ti8 -","4","0.5","","Shin-ichiro Kabashima; Shigeki Kuwata; Masanobu Hidai","Electron-Deficient Early-Late Heterobimetallic Sulfido Clusters. Unusual Reactivities of Ti2Ru2S4 Cubane-Type Clusters with Four Cyclopentadienyl Coligands","Journal of the American Chemical Society","1999","121","","7837","7845","10.1021/ja990034a","","","0.7107","MoKα","","0","0","","","0","0.024","","","","","","2.704","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116499","20.284","0.004","11.094","0.004","21.909","0.004","90","","105.36","0.02","90","","4754","2","296.2","","296.2","","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C36 H54 F12 N2 O2 P2 Ru2 S4 Ti2 -","- C36 H54 F12 N2 O2 P2 Ru2 S4 Ti2 -","- C144 H216 F48 N8 O8 P8 Ru8 S16 Ti8 -","4","1","","Shin-ichiro Kabashima; Shigeki Kuwata; Masanobu Hidai","Electron-Deficient Early-Late Heterobimetallic Sulfido Clusters. Unusual Reactivities of Ti2Ru2S4 Cubane-Type Clusters with Four Cyclopentadienyl Coligands","Journal of the American Chemical Society","1999","121","","7837","7845","10.1021/ja990034a","","","0.7107","MoKα","","0.046","0.046","","","0.0355","0.0355","","","","","","1.855","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116500","10.398","0.004","18.263","0.005","19.474","0.004","90","","92.55","0.03","90","","3694.4","1.9","296.2","","296.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H42 Cl4 Ru2 S4 Ti2 -","- C31 H42 Cl4 Ru2 S4 Ti2 -","- C124 H168 Cl16 Ru8 S16 Ti8 -","4","1","","Shin-ichiro Kabashima; Shigeki Kuwata; Masanobu Hidai","Electron-Deficient Early-Late Heterobimetallic Sulfido Clusters. Unusual Reactivities of Ti2Ru2S4 Cubane-Type Clusters with Four Cyclopentadienyl Coligands","Journal of the American Chemical Society","1999","121","","7837","7845","10.1021/ja990034a","","","0.7107","MoKα","","0.0478","0.0478","","","0.032","0.032","","","","","","1.632","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116501","9.857","0.002","19.792","0.002","17.774","0.002","90","","91.72","0.01","90","","3466","0.9","296.2","","296.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H37 Cl5 Ru2 S4 Ti2 -","- C26 H37 Cl5 Ru2 S4 Ti2 -","- C104 H148 Cl20 Ru8 S16 Ti8 -","4","1","","Shin-ichiro Kabashima; Shigeki Kuwata; Masanobu Hidai","Electron-Deficient Early-Late Heterobimetallic Sulfido Clusters. Unusual Reactivities of Ti2Ru2S4 Cubane-Type Clusters with Four Cyclopentadienyl Coligands","Journal of the American Chemical Society","1999","121","","7837","7845","10.1021/ja990034a","","","0.7107","MoKα","","0.0439","0.0439","","","0.0336","0.0336","","","","","","1.602","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116502","20.75","0.001","17.0434","0.0009","17.1877","0.0009","90","","124.79","0.01","90","","4991.9","0.7","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C54 H76 Cl2 O4 Si Ti -","- C54 H76 Cl2 O4 Si Ti -","- C216 H304 Cl8 O16 Si4 Ti4 -","4","0.5","","Oleg V. Ozerov; Folami T. Ladipo; Brian O. Patrick","Highly Regioselective Alkyne Cyclotrimerization Catalyzed by Titanium Complexes Supported by Proximally Bridged p-tert-Butylcalix[4]arene Ligands","Journal of the American Chemical Society","1999","121","","7941","7942","10.1021/ja990740b","","","0.71073","MoKα","","0.1549","0.1231","","0.2649","0.2505","","","","1.194","1.258","1.258","","","","","has coordinates,has disorder","178936","2020-10-21","18:00:00",""
"4116503","11.5028","0.0001","12.4083","0.0001","12.4609","0.0002","106.587","0.001","93.1","0.001","116.809","0.001","1486.17","0.04","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C32.5 H31 B0.5 N0.5 P2 Pd -","- C32.75 H29.5 B0.25 N0.5 P2 Pd -","- C65.5 H59 B0.5 N P4 Pd2 -","2","1","","Robert A. Stockland; Gordon K. Anderson; Nigam P. Rath","Reductive Elimination of Alkanes and Arenes from [Pd2R2(μ-H)(μ-dppm)2]PF6 Complexes","Journal of the American Chemical Society","1999","121","","7945","7946","10.1021/ja990815b","","","0.71073","MoKα","","0.0689","0.0436","","0.1445","0.1181","","","","1.069","1.145","1.145","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116504","11.7906","0.0014","12.4046","0.001","23.7952","0.0018","90","0.006","90","0.008","90","0.008","3480.2","0.6","293","2","293","2","","","","","","","synthesized","6","P 21 21 21","P 2ac 2ab","19","none","Zinc(II)-2-devinyl-2-carboximinopyropheophorbide a methyl ester chloroform solvate","","- C34 H34 Cl3 N5 O4 Zn -","- C34 H34 Cl3 N5 O4 Zn -","- C136 H136 Cl12 N20 O16 Zn4 -","4","1","","Spencer Knapp; Buwen Huang; Thomas J. Emge; Suzie Sheng; Karsten Krogh-Jespersen; Joseph A. Potenza; Harvey J. Schugar","A Pyropheophorbide Dimer with Single Pyrrole π Overlap and a Low-Energy Q Absorption","Journal of the American Chemical Society","1999","121","","7977","7978","10.1021/ja991632s","","","1.54184","CuKα","","0.0766","0.0646","","","0.1569","0.163","","","","","","1.002","","","","has coordinates,has disorder","178936","2020-10-21","18:00:00",""
"4116505","17.876","0.001","10.73","0.001","37.935","0.002","90","","96.75","0.01","90","","7225.9","0.9","110","1","110","1","","","","","","","Synthesized in the laboratory of Mark S. Meier","3","P 1 21/c 1","-P 2ybc","14","","7,8-dichloromethanohomo70-fullerene","","- C73.61 H5.78 Cl2 -","- C73.612 H5.776 Cl2 -","- C588.896 H46.208 Cl16 -","8","2","","Andrew F. Kiely; Robert C. Haddon; Mark S. Meier; John P. Selegue; Carolyn Pratt Brock; Brian O. Patrick; Guan-Wu Wang; Yongsheng Chen","The First Structurally Characterized Homofullerene (Fulleroid)","Journal of the American Chemical Society","1999","121","","7971","7972","10.1021/ja991692y","","","0.71073","MoKα","","0.175","0.089","","0.144","0.126","","","","1.1","1.25","1.25","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116506","8.3256","0.0009","20.008","0.002","21.468","0.002","90","","93.725","0.01","90","","3568.6","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33.5 H45 B2 N10 Sm -","- C33.5 H41 B2 N10 Sm -","- C134 H164 B8 N40 Sm4 -","4","1","","I. Lopes; G. Y. Lin; A. Domingos; R. McDonald; N. Marques; J. Takats","Unprecedented Transformation of a Hydrotris(pyrazolyl)borate Ligand at a Metal Center: Synthesis and Rearrangement of the First Mixed Tp/Cp Lanthanide Complex, Sm(TpMe2)2(Cp)","Journal of the American Chemical Society","1999","121","","8110","8111","10.1021/ja984227u","","","0.71073","MoKα","","0.1151","0.0653","","0.2281","0.136","","","","1.106","1.117","1.117","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116507","9.8344","0.0011","15.8217","0.0016","18.058","0.002","103.464","0.002","106.315","0.002","90.169","0.002","2615.5","0.5","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C53 H67 B2 N12 Sm -","- C53 H67 B2 N12 Sm -","- C106 H134 B4 N24 Sm2 -","2","1","","I. Lopes; G. Y. Lin; A. Domingos; R. McDonald; N. Marques; J. Takats","Unprecedented Transformation of a Hydrotris(pyrazolyl)borate Ligand at a Metal Center: Synthesis and Rearrangement of the First Mixed Tp/Cp Lanthanide Complex, Sm(TpMe2)2(Cp)","Journal of the American Chemical Society","1999","121","","8110","8111","10.1021/ja984227u","","","0.71073","MoKα","","0.1089","0.0675","","","0.1446","0.1636","","","","","","0.936","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116508","16.7314","0.0002","17.3877","0.0003","46.0307","0.0006","90","","90","","90","","13391.3","0.3","103","2","103","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","o-Cl-HABI","","","- C42 H28 Cl2 N4 -","- C42 H28 Cl2 N4 -","- C672 H448 Cl32 N64 -","16","2","","Masaki Kawano; Tomokatsu Sano; Jiro Abe; Yuji Ohashi","The First in Situ Direct Observation of the Light-Induced Radical Pair from a Hexaarylbiimidazolyl Derivative by X-ray Crystallography","Journal of the American Chemical Society","1999","121","","8106","8107","10.1021/ja9903173","","","0.71073","MoKα","","0.0622","0.0409","","","0.0924","0.101","","","","","","1.005","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116509","16.6975","0.0003","17.3715","0.0003","45.9434","0.0003","90","","90","","90","","13326.4","0.3","103","2","103","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","o-Cl-HABI & lophine radical","","","- C42 H28 Cl2 N4 -","- C42 H28 Cl2 N4 -","- C672 H448 Cl32 N64 -","16","2","","Masaki Kawano; Tomokatsu Sano; Jiro Abe; Yuji Ohashi","The First in Situ Direct Observation of the Light-Induced Radical Pair from a Hexaarylbiimidazolyl Derivative by X-ray Crystallography","Journal of the American Chemical Society","1999","121","","8106","8107","10.1021/ja9903173","","","0.71073","MoKα","","0.0795","0.0535","","","0.1117","0.121","","","","","","1.08","","","","has coordinates,has disorder","301833","2025-08-20","15:22:59",""
"4116510","11.647","0.004","11.986","0.003","12.047","0.006","103.25","0.03","106.01","0.03","109.91","0.02","1419.5","1.1","296","","","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H21 N3 Ni O2 S10 -","- C20 H21 N3 Ni O2 S10 -","- C40 H42 N6 Ni2 O4 S20 -","2","1","","Hiroyuki Imai; Takeo Otsuka; Toshio Naito; Kunio Awaga; Tamotsu Inabe","M(dmit)2 Salts with Nitronyl Nitroxide Radical Cations (M = Ni and Au, dmit = 1,3-Dithiol-2-thione-4,5-dithiolate). Nonmagnetic Single-Chain Formation vs Antiferromagnetic Spin-Ladder-Chain Formation of M(dmit)2","Journal of the American Chemical Society","1999","121","","8098","8103","10.1021/ja991058k","","","0.71073","MoKα","","","0.045","","","0.048","","","","","1.453","1.453","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116511","14.42","0.005","16.544","0.004","12.741","0.003","92.71","0.02","100.13","0.02","103.61","0.02","2895.6","1.4","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H21 Au N3 O2 S10 -","- C20 H21 Au0.75 N3 O2 S10 -","- C80 H84 Au3 N12 O8 S40 -","4","2","","Hiroyuki Imai; Takeo Otsuka; Toshio Naito; Kunio Awaga; Tamotsu Inabe","M(dmit)2 Salts with Nitronyl Nitroxide Radical Cations (M = Ni and Au, dmit = 1,3-Dithiol-2-thione-4,5-dithiolate). Nonmagnetic Single-Chain Formation vs Antiferromagnetic Spin-Ladder-Chain Formation of M(dmit)2","Journal of the American Chemical Society","1999","121","","8098","8103","10.1021/ja991058k","","","0.7107","MoKα","","0","0.082","","","0","0.0577","","","","","","3.056","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116512","13.6792","0.0006","14.7758","0.0007","20.9824","0.0012","90","","90","","90","","4241","0.4","220","2","293","2","","","","","","","","6","C 2 2 21","C 2c 2","20","","","","- C24 H74 N2 P6 Ru2 Si2 -","- C24 H74 N2 P6 Ru2 Si2 -","- C96 H296 N8 P24 Ru8 Si8 -","4","0.5","","Vladimir K. Dioumaev; Karl Plössl; Patrick J. Carroll; Donald H. Berry","Formation and Interconversion of Ruthenium-Silene and 16-Electron Ruthenium Silyl Complexes","Journal of the American Chemical Society","1999","121","","8391","8392","10.1021/ja984363z","","","0.7107","MoKα","","0.0512","0.048","","0.109","0.1069","","","","1.108","1.118","1.118","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116513","27.086","0.005","15.533","0.003","14.207","0.003","90","","104.31","0.03","90","","5792","2","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C36 H40 Zr -","- C36 H40 Zr -","- C288 H320 Zr8 -","8","1","","Paul-Michael Pellny; Frank G. Kirchbauer; Vladimir V. Burlakov; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Reactivity of Permethylzirconocene and Permethyltitanocene toward Disubstituted 1,3-Butadiynes: η4- vs η2-Complexation or C-C Coupling with the Permethyltitanocene","Journal of the American Chemical Society","1999","121","","8313","8323","10.1021/ja991046z","","","0.71073","MoKα","","0.063","0.0326","","0.0801","0.0744","","","","0.919","1.116","1.116","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116514","10.595","0.002","18.22","0.004","15.891","0.003","90","","94.5","0.03","90","","3058.2","1.1","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H48 Si2 Zr -","- C30 H48 Si2 Zr -","- C120 H192 Si8 Zr4 -","4","1","","Paul-Michael Pellny; Frank G. Kirchbauer; Vladimir V. Burlakov; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Reactivity of Permethylzirconocene and Permethyltitanocene toward Disubstituted 1,3-Butadiynes: η4- vs η2-Complexation or C-C Coupling with the Permethyltitanocene","Journal of the American Chemical Society","1999","121","","8313","8323","10.1021/ja991046z","","","0.71073","MoKα","","0.0653","0.049","","0.1348","0.1266","","","","1.057","1.128","1.128","","","","","has coordinates,has disorder","178936","2020-10-21","18:00:00",""
"4116515","11.237","0.002","11.534","0.002","13.691","0.003","76.36","0.03","67.09","0.03","74.46","0.03","1557.3","0.6","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H48 Si2 Ti -","- C30 H48 Si2 Ti -","- C60 H96 Si4 Ti2 -","2","1","","Paul-Michael Pellny; Frank G. Kirchbauer; Vladimir V. Burlakov; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Reactivity of Permethylzirconocene and Permethyltitanocene toward Disubstituted 1,3-Butadiynes: η4- vs η2-Complexation or C-C Coupling with the Permethyltitanocene","Journal of the American Chemical Society","1999","121","","8313","8323","10.1021/ja991046z","","","0.71073","MoKα","","0.0564","0.0442","","0.1355","0.128","","","","0.999","1.067","1.067","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116516","26.632","0.005","8.931","0.002","25.953","0.005","90","","109.16","0.03","90","","5831","2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C36 H40 Ti -","- C36 H40 Ti -","- C288 H320 Ti8 -","8","2","","Paul-Michael Pellny; Frank G. Kirchbauer; Vladimir V. Burlakov; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Reactivity of Permethylzirconocene and Permethyltitanocene toward Disubstituted 1,3-Butadiynes: η4- vs η2-Complexation or C-C Coupling with the Permethyltitanocene","Journal of the American Chemical Society","1999","121","","8313","8323","10.1021/ja991046z","","","0.71073","MoKα","","0.0831","0.0461","","0.1108","0.1023","","","","0.861","1.051","1.051","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116517","17.064","0.003","8.838","0.002","21.308","0.004","90","","107.7","0.03","90","","3061.4","1.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C37 H40 O2 Ti -","- C37 H40 O2 Ti -","- C148 H160 O8 Ti4 -","4","1","","Paul-Michael Pellny; Frank G. Kirchbauer; Vladimir V. Burlakov; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Reactivity of Permethylzirconocene and Permethyltitanocene toward Disubstituted 1,3-Butadiynes: η4- vs η2-Complexation or C-C Coupling with the Permethyltitanocene","Journal of the American Chemical Society","1999","121","","8313","8323","10.1021/ja991046z","","","0.71073","MoKα","","0.0983","0.0452","","0.0998","0.0885","","","","0.817","1.053","1.053","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116518","17.104","0.003","17.173","0.003","48.17","0.01","90","","90","","90","","14149","5","293","2","293","2","","","","","","","","5","F d d d :2","-F 2uv 2vw","70","","","","- C32 H48 O4 Si2 Zr -","- C32 H48 O4 Si2 Zr -","- C512 H768 O64 Si32 Zr16 -","16","0.5","","Paul-Michael Pellny; Frank G. Kirchbauer; Vladimir V. Burlakov; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Reactivity of Permethylzirconocene and Permethyltitanocene toward Disubstituted 1,3-Butadiynes: η4- vs η2-Complexation or C-C Coupling with the Permethyltitanocene","Journal of the American Chemical Society","1999","121","","8313","8323","10.1021/ja991046z","","","0.71073","MoKα","","0.0458","0.0345","","0.0925","0.0886","","","","0.976","1.054","1.054","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116519","10.567","0.002","12.213","0.002","13.991","0.003","92.07","0.03","100.15","0.03","114.87","0.03","1600.2","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H48 O2 Si2 Ti -","- C31 H48 O2 Si2 Ti -","- C62 H96 O4 Si4 Ti2 -","2","1","","Paul-Michael Pellny; Frank G. Kirchbauer; Vladimir V. Burlakov; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Reactivity of Permethylzirconocene and Permethyltitanocene toward Disubstituted 1,3-Butadiynes: η4- vs η2-Complexation or C-C Coupling with the Permethyltitanocene","Journal of the American Chemical Society","1999","121","","8313","8323","10.1021/ja991046z","","","0.71073","MoKα","","0.0499","0.0403","","0.1269","0.1171","","","","1.082","1.109","1.109","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116520","31.235","0.004","10.637","0.001","8.579","0.003","90","","90","","90","","2850.3","1.1","132","","132","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H18 O -","- C19 H18 O -","- C152 H144 O8 -","8","1","","Kazumasa Honda; Fusae Nakanishi; Neil Feeder","Kinetic and Mechanistic Study on Single-Crystal-to-Single-Crystal Photodimerization of 2-Benzyl-5-benzylidenecyclopentanone Utilizing X-ray Diffraction","Journal of the American Chemical Society","1999","121","","8246","8250","10.1021/ja991386k","","","0.71073","MoKα","","0.1572","0.0631","","0.0919","","0.0696","","","","","","1.16","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116521","31.263","0.004","10.668","0.001","8.604","0.004","90","","90","","90","","2869.6","1.4","175","","175","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H18 O -","- C19 H18 O -","- C152 H144 O8 -","8","1","","Kazumasa Honda; Fusae Nakanishi; Neil Feeder","Kinetic and Mechanistic Study on Single-Crystal-to-Single-Crystal Photodimerization of 2-Benzyl-5-benzylidenecyclopentanone Utilizing X-ray Diffraction","Journal of the American Chemical Society","1999","121","","8246","8250","10.1021/ja991386k","","","0.71073","MoKα","","0.1705","0.0673","","0.0978","","0.0717","","","","","","1.061","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116522","31.276","0.003","10.687","0.001","8.62","0.003","90","","90","","90","","2881.2","1.1","190","","132","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H18 O -","- C19 H18 O -","- C152 H144 O8 -","8","1","","Kazumasa Honda; Fusae Nakanishi; Neil Feeder","Kinetic and Mechanistic Study on Single-Crystal-to-Single-Crystal Photodimerization of 2-Benzyl-5-benzylidenecyclopentanone Utilizing X-ray Diffraction","Journal of the American Chemical Society","1999","121","","8246","8250","10.1021/ja991386k","","","0.71073","MoKα","","0.1891","0.0746","","0.1027","","0.0781","","","","","","1.22","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116523","31.284","0.002","10.702","0.0006","8.629","0.002","90","","90","","90","","2889","0.7","204","","132","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H18 O -","- C19 H18 O -","- C152 H144 O8 -","8","1","","Kazumasa Honda; Fusae Nakanishi; Neil Feeder","Kinetic and Mechanistic Study on Single-Crystal-to-Single-Crystal Photodimerization of 2-Benzyl-5-benzylidenecyclopentanone Utilizing X-ray Diffraction","Journal of the American Chemical Society","1999","121","","8246","8250","10.1021/ja991386k","","","0.71073","MoKα","","0.222","0.0809","","0.113","","0.0852","","","","","","1.314","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116524","31.292","0.002","10.7148","0.0006","8.637","0.002","90","","90","","90","","2895.9","0.7","219","","219","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H18 O -","- C19 H18 O -","- C152 H144 O8 -","8","1","","Kazumasa Honda; Fusae Nakanishi; Neil Feeder","Kinetic and Mechanistic Study on Single-Crystal-to-Single-Crystal Photodimerization of 2-Benzyl-5-benzylidenecyclopentanone Utilizing X-ray Diffraction","Journal of the American Chemical Society","1999","121","","8246","8250","10.1021/ja991386k","","","0.71073","MoKα","","0.1829","0.0677","","0.0911","","0.0705","","","","","","1.223","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116525","31.317","0.002","10.7471","0.0007","8.66","0.002","90","","90","","90","","2914.7","0.7","250","","250","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H18 O -","- C19 H18 O -","- C152 H144 O8 -","8","1","","Kazumasa Honda; Fusae Nakanishi; Neil Feeder","Kinetic and Mechanistic Study on Single-Crystal-to-Single-Crystal Photodimerization of 2-Benzyl-5-benzylidenecyclopentanone Utilizing X-ray Diffraction","Journal of the American Chemical Society","1999","121","","8246","8250","10.1021/ja991386k","","","0.71073","MoKα","","0.2061","0.0779","","0.1123","","0.0849","","","","","","1.221","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116526","31.333","0.002","10.7715","0.0007","8.677","0.002","90","","90","","90","","2928.5","0.7","273","","273","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H18 O -","- C19 H18 O -","- C152 H144 O8 -","8","1","","Kazumasa Honda; Fusae Nakanishi; Neil Feeder","Kinetic and Mechanistic Study on Single-Crystal-to-Single-Crystal Photodimerization of 2-Benzyl-5-benzylidenecyclopentanone Utilizing X-ray Diffraction","Journal of the American Chemical Society","1999","121","","8246","8250","10.1021/ja991386k","","","0.71073","MoKα","","0.1434","0.0606","","0.0819","","0.0669","","","","","","1.406","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116527","31.378","0.002","10.8387","0.0006","8.714","0.002","90","","90","","90","","2963.6","0.7","324","","324","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C19 H18 O -","- C19 H18 O -","- C152 H144 O8 -","8","1","","Kazumasa Honda; Fusae Nakanishi; Neil Feeder","Kinetic and Mechanistic Study on Single-Crystal-to-Single-Crystal Photodimerization of 2-Benzyl-5-benzylidenecyclopentanone Utilizing X-ray Diffraction","Journal of the American Chemical Society","1999","121","","8246","8250","10.1021/ja991386k","","","0.71073","MoKα","","0.1657","0.0611","","0.0836","","0.0659","","","","","","1.376","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116528","9.42","0.003","12.022","0.004","18.224","0.003","73.26","0.018","82.468","0.02","74.29","0.03","1899.4","1","295.2","","295","","","","","","","","","3","P -1","-P 1","2","","","","- C46 H46 N2 -","- C46 H37 N2 -","- C92 H74 N4 -","2","1","","Joshua J. Pak; Timothy J. R. Weakley; Michael M. Haley","Stepwise Assembly of Site Specifically Functionalized Dehydrobenzo[18]annulenes","Journal of the American Chemical Society","1999","121","","8182","8192","10.1021/ja991749g","","","0.71073","MoKα","","0.21","0.096","","0.099","","0.093","","","2.28","","","3.15","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116529","10.023","0.001","13.922","0.002","16.577","0.002","74.555","0.009","86.062","0.009","79.597","0.01","2192.5","0.5","294","","294","","","","","","","","","5","P -1","-P 1","2","","","","- C47 H46 Cl2 N4 O4 -","- C47 H46 Cl2 N4 O4 -","- C94 H92 Cl4 N8 O8 -","2","1","","Joshua J. Pak; Timothy J. R. Weakley; Michael M. Haley","Stepwise Assembly of Site Specifically Functionalized Dehydrobenzo[18]annulenes","Journal of the American Chemical Society","1999","121","","8182","8192","10.1021/ja991749g","","","0.71073","MoKα","","","0.1011","","","0.0534","","","","","1.69","1.69","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116530","9.7761","0.001","31.232","0.004","10.954","0.003","90","","114.464","0.014","90","","3044.3","1","294","","294","","","","","","","","","4","I 1 a 1","I -2ya","9","","","","- C38 H28 N2 O2 -","- C38 H28 N2 O2 -","- C152 H112 N8 O8 -","4","1","","Joshua J. Pak; Timothy J. R. Weakley; Michael M. Haley","Stepwise Assembly of Site Specifically Functionalized Dehydrobenzo[18]annulenes","Journal of the American Chemical Society","1999","121","","8182","8192","10.1021/ja991749g","","","0.71073","MoKα","","0.079","0.053","","0.098","","0.045","","","1.26","","","1.27","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116531","10.7692","0.0018","11.4492","0.0029","14.3082","0.0017","70.552","0.016","78.929","0.012","64.781","0.017","1502.4","0.5","273","","273","","","","","","","","","4","P -1","-P 1","2","","","","- C38 H28 N2 O2 -","- C38 H28 N2 O2 -","- C76 H56 N4 O4 -","2","1","","Joshua J. Pak; Timothy J. R. Weakley; Michael M. Haley","Stepwise Assembly of Site Specifically Functionalized Dehydrobenzo[18]annulenes","Journal of the American Chemical Society","1999","121","","8182","8192","10.1021/ja991749g","","","0.71073","MoKα","","0.316","0.147","","0.082","","0.067","","","1.17","","","1.37","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116532","33.401","0.007","33.401","0.007","9.241","0.004","90","","90","","120","","8928","5","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","ZnDachPO","zinc(1,2-diaminocyclohexane)phosphate","","- C6 H21 N2 O14 P3 Zn3 -","- C6 H21 N2 O14 P3 Zn3 -","- C108 H378 N36 O252 P54 Zn54 -","18","1","","Guo-Yu Yang; Slavi C. Sevov","Zinc Phosphate with Gigantic Pores of 24 Tetrahedra","Journal of the American Chemical Society","1999","121","","8389","8390","10.1021/ja991985r","","","0.71073","MoKα","","0.0704","0.0523","","","0.1471","0.1592","","","","","","1.101","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116533","16.6797","0.0008","14.6412","0.0007","21.2925","0.001","90","","112.26","0.001","90","","4812.3","0.4","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- H76 Na14 O110 P2 U2 W18 -","- Na12.8 O110 P2 U2 W18 -","- Na25.6 O220 P4 U4 W36 -","2","0.5","","Kee-Chan Kim; Michael T. Pope","Cation-Directed Structure Changes in Polyoxometalate Chemistry. Equilibria between Isomers of Bis(9-tungstophosphatodioxouranate(VI)) Complexes","Journal of the American Chemical Society","1999","121","","8512","8517","10.1021/ja9909125","","","0.71073","MoKα","","0.061","0.0549","","","0.1407","0.1458","","","","","","1.156","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116534","12.601","0.0017","20.175","0.003","35.124","0.008","90","","99.056","0.019","90","","8818","3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- H94 N14 O91 P2 U2 W18 -","- O105 P2 U2 W18 -","- O420 P8 U8 W72 -","4","1","","Kee-Chan Kim; Michael T. Pope","Cation-Directed Structure Changes in Polyoxometalate Chemistry. Equilibria between Isomers of Bis(9-tungstophosphatodioxouranate(VI)) Complexes","Journal of the American Chemical Society","1999","121","","8512","8517","10.1021/ja9909125","","","0.71073","MoKα","","0.0839","0.0563","","","0.1346","0.1449","","","","","","1.069","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116535","11.3537","0.0014","15.0288","0.0018","15.6424","0.0018","90","","104.358","0.002","90","","2585.7","0.5","103","2","103","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","1,2-bis(2-methyl-6-nitro-1-benzothiophen-3-yl)perfluorocyclopentene (2a-b)","3-(3,3,4,4,5,5-hexafluoro-2-(2-methyl-6-nitrobenzo[b]thiophen-3- yl)cyclopent-1-enyl)-2-methyl-6-nitrobenzo[b]thiophene","","- C26 H18 F6 N2 O5 S2 -","- C26 H18 F6 N2 O5 S2 -","- C104 H72 F24 N8 O20 S8 -","4","1","","Seiya Kobatake; Motoki Yamada; Taro Yamada; Masahiro Irie","Photochromism of 1,2-Bis(2-methyl-6-nitro-1-benzothiophen-3-yl)perfluorocyclopentene in a Single-Crystalline Phase: Dichroism of the Closed-Ring Form Isomer","Journal of the American Chemical Society","1999","121","","8450","8456","10.1021/ja991013j","","","0.71073","MoKα","","0.1014","0.0852","","","0.2403","0.2498","","","","","","1.154","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116536","9.9409","0.0017","15.748","0.003","14.492","0.003","90","","100.297","0.004","90","","2232.2","0.7","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","1,2-bis(2-methyl-6-nitro-1-benzothiophen-3-yl)perfluorocyclopentene (2a-a)","3-(3,3,4,4,5,5-hexafluoro-2-(2-methyl-6-nitrobenzo[b]thiophen-3- yl)cyclopent-1-enyl)-2-methyl-6-nitrobenzo[b]thiophene","","- C23 H12 F6 N2 O4 S2 -","- C23 H12 F6 N2 O4 S2 -","- C92 H48 F24 N8 O16 S8 -","4","1","","Seiya Kobatake; Motoki Yamada; Taro Yamada; Masahiro Irie","Photochromism of 1,2-Bis(2-methyl-6-nitro-1-benzothiophen-3-yl)perfluorocyclopentene in a Single-Crystalline Phase: Dichroism of the Closed-Ring Form Isomer","Journal of the American Chemical Society","1999","121","","8450","8456","10.1021/ja991013j","","","0.71073","MoKα","","0.0571","0.0413","","","0.1248","0.132","","","","","","1.068","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116537","11.597","0.0009","13.085","0.0011","14.2697","0.0011","83.585","0.001","80.643","0.001","87.451","0.001","2122.4","0.3","103","2","103","2","","","","","","","","6","P -1","-P 1","2","(2b)","3,3,4,4,5,5-hexafluoro-15,16-dimethyl-11,20-dinitro-14,17-dithiahexacyclo[14.7.0.0^2,6^.0^7,15^.0^8,13^.0^18,23^]tricosa-1(2),6(7),8(9),10,12,18(19),20,22-octaene","","- C23 H12 F6 N2 O4 S2 -","- C23 H12 F6 N2 O4 S2 -","- C92 H48 F24 N8 O16 S8 -","4","2","","Seiya Kobatake; Motoki Yamada; Taro Yamada; Masahiro Irie","Photochromism of 1,2-Bis(2-methyl-6-nitro-1-benzothiophen-3-yl)perfluorocyclopentene in a Single-Crystalline Phase: Dichroism of the Closed-Ring Form Isomer","Journal of the American Chemical Society","1999","121","","8450","8456","10.1021/ja991013j","","","0.71073","MoKα","","0.0706","0.0416","","","0.0996","0.1145","","","","","","1.01","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116538","13.4685","0.0007","13.7905","0.0007","19.4425","0.001","106.512","0.001","92.157","0.001","94.53","0.001","3444.6","0.3","158","2","158","2","","","","","","","","6","P -1","-P 1","2","","","","- C72 H61 B11 Br6 Fe N4 -","- C72 H61 B11 Br6 Fe N4 -","- C144 H122 B22 Br12 Fe2 N8 -","2","1","","Daniel R. Evans; Nathanael L. P. Fackler; Zuowei Xie; Clifton E. F. Rickard; Peter D. W. Boyd; Christopher A. Reed","π-Arene/Cation Structure and Bonding. Solvation versus Ligand Binding in Iron(III) Tetraphenylporphyrin Complexes of Benzene, Toluene, p-Xylene, and [60]Fullerene","Journal of the American Chemical Society","1999","121","","8466","8474","10.1021/ja9910816","","","0.71073","MoKα","","0.108","0.0565","","0.1083","0.0882","","","","1.034","1.132","1.132","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116539","13.6005","0.0007","14.6761","0.0007","15.9556","0.0008","68.142","0.001","82.499","0.001","75.838","0.001","2863.2","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H50 Al B F20 N2 -","- C60 H50 Al B F20 N2 -","- C120 H100 Al2 B2 F40 N4 -","2","1","","Catherine E. Radzewich; Ilia A. Guzei; Richard F. Jordan","Three-Coordinate Cationic Aluminum Alkyl Complexes Incorporating β-Diketiminate Ligands","Journal of the American Chemical Society","1999","121","","8673","8674","10.1021/ja991759h","","","0.71073","MoKα","","0.0614","0.0374","","","0.0936","0.1019","","","","","","1.033","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116540","14.07","0.0007","16.6044","0.0009","20.3608","0.0011","99.262","0.001","92.093","0.001","98.103","0.001","4639.3","0.4","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C49 H47 Al B F15 N2 -","- C49 H47 Al B F15 N2 -","- C196 H188 Al4 B4 F60 N8 -","4","2","","Catherine E. Radzewich; Ilia A. Guzei; Richard F. Jordan","Three-Coordinate Cationic Aluminum Alkyl Complexes Incorporating β-Diketiminate Ligands","Journal of the American Chemical Society","1999","121","","8673","8674","10.1021/ja991759h","","","0.71073","MoKα","","0.0625","0.0368","","","0.0898","0.0984","","","","","","1.033","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116541","14.569","0.002","15.0986","0.0014","14.554","0.002","90","","113.14","0.012","90","","2943.9","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H34 Cl2 Fe N4 -","- C29 H34 Cl2 Fe N4 -","- C116 H136 Cl8 Fe4 N16 -","4","1","","George J. P. Britovsek; Michael Bruce; Vernon C. Gibson; Brian S. Kimberley; Peter J. Maddox; Sergio Mastroianni; Stuart J. McTavish; Carl Redshaw; Gregory A. Solan; Staffan Strömberg; Andrew J. P. White; David J. Williams","Iron and Cobalt Ethylene Polymerization Catalysts Bearing 2,6-Bis(Imino)Pyridyl Ligands: Synthesis, Structures, and Polymerization Studies","Journal of the American Chemical Society","1999","121","","8728","8740","10.1021/ja990449w","","","1.54178","CuKα","","0.1332","0.0685","","0.1801","0.1442","","","","1.028","1.142","1.142","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116542","14.536","0.002","15.273","0.003","14.676","0.002","90","","112.409","0.013","90","","3012.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H34 Br2 Fe N4 -","- C29 H34 Br2 Fe N4 -","- C116 H136 Br8 Fe4 N16 -","4","1","","George J. P. Britovsek; Michael Bruce; Vernon C. Gibson; Brian S. Kimberley; Peter J. Maddox; Sergio Mastroianni; Stuart J. McTavish; Carl Redshaw; Gregory A. Solan; Staffan Strömberg; Andrew J. P. White; David J. Williams","Iron and Cobalt Ethylene Polymerization Catalysts Bearing 2,6-Bis(Imino)Pyridyl Ligands: Synthesis, Structures, and Polymerization Studies","Journal of the American Chemical Society","1999","121","","8728","8740","10.1021/ja990449w","","","1.54178","CuKα","","0.1172","0.0592","","0.1451","0.118","","","","1.021","1.116","1.116","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116543","8.7484","0.0012","9.8655","0.0012","20.97","0.003","84.137","0.012","88.233","0.011","65.676","0.009","1640.5","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C33 H44 Cl2 Co N3 O0.5 -","- C33 H43 Cl2 Co N3 O0.5 -","- C66 H86 Cl4 Co2 N6 O -","2","1","","George J. P. Britovsek; Michael Bruce; Vernon C. Gibson; Brian S. Kimberley; Peter J. Maddox; Sergio Mastroianni; Stuart J. McTavish; Carl Redshaw; Gregory A. Solan; Staffan Strömberg; Andrew J. P. White; David J. Williams","Iron and Cobalt Ethylene Polymerization Catalysts Bearing 2,6-Bis(Imino)Pyridyl Ligands: Synthesis, Structures, and Polymerization Studies","Journal of the American Chemical Society","1999","121","","8728","8740","10.1021/ja990449w","","","0.71073","MoKα","","0.089","0.0506","","0.1163","0.0991","","","","1.012","1.079","1.079","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116544","14.3725","0.0002","26.2888","0.0001","26.5749","0.0004","73.468","0.001","76.193","0.001","84.178","0.001","9341.7","0.2","173","2","173","2","","","","","","","Prof. R. Beer - Columbia University","8","P -1","-P 1","2","96092","","","- C108 H229 N7 Nb2 O80 P2 W22 Zr -","- C108 H229 N7 Nb2 O80 P2 W22 Zr -","- C216 H458 N14 Nb4 O160 P4 W44 Zr2 -","2","1","","Emil V. Radkov; Victor G. Young; Robert H. Beer","A Polyoxometalate Transfer Reagent: Synthesis, Structure, and Reactivity of Zirconocene Polyoxometalate [(PNbW11O40)2ZrCp2]6-","Journal of the American Chemical Society","1999","121","","8953","8954","10.1021/ja9905039","","","0.71073","MoKα","","0.1019","0.0818","","0.1783","0.1622","","","","1.132","1.161","1.161","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116545","12.2029","0.0015","7.5521","0.0012","25.833","0.003","90","0.015","98.344","0.012","90","0.011","2355.5","0.6","293","2","293","2","","","","","","","synthesis","3","P 1 21/n 1","-P 2yn","14","","4'',3'''-dimethyl-2,2':5,2'':5'',2''':5''',2'''':5'''',2'''''.- sexithiophene","","- C26 H18 S6 -","- C26 H18 S6 -","- C104 H72 S24 -","4","1","","Giovanna Barbarella; Massimo Zambianchi; Luciano Antolini; Paolo Ostoja; Piera Maccagnani; Alessandro Bongini; Elisabeth A. Marseglia; Emilio Tedesco; Giuseppe Gigli; Roberto Cingolani","Solid-State Conformation, Molecular Packing, and Electrical and Optical Properties of Processable β-Methylated Sexithiophenes","Journal of the American Chemical Society","1999","121","","8920","8926","10.1021/ja9916512","","","0.71069","MoKα","","0.1143","0.0629","","0.2011","0.1576","","","","1.032","1.083","1.083","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116546","42.629","0.003","7.7776","0.0005","7.8672","0.0009","90","0.008","98.036","0.007","90","0.007","2582.8","0.4","293","2","293","2","","","","","","","synthesis","3","C 1 2/c 1","-C 2yc","15","","4',3'',4''',3''''-tetramethyl-2,2':5,2'':5'',2''':5''',2'''':5'''',2'''''.- sexithiophene (monoclinic form)","","- C28 H22 S6 -","- C28 H22 S6 -","- C112 H88 S24 -","4","0.5","","Giovanna Barbarella; Massimo Zambianchi; Luciano Antolini; Paolo Ostoja; Piera Maccagnani; Alessandro Bongini; Elisabeth A. Marseglia; Emilio Tedesco; Giuseppe Gigli; Roberto Cingolani","Solid-State Conformation, Molecular Packing, and Electrical and Optical Properties of Processable β-Methylated Sexithiophenes","Journal of the American Chemical Society","1999","121","","8920","8926","10.1021/ja9916512","","","0.71069","MoKα","","0.0695","0.0479","","0.1632","0.1244","","","","1.053","1.052","1.052","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116547","7.595","0.002","7.68","0.002","11.438","0.003","99.47","0.02","91.62","0.02","107.08","0.02","627","0.3","293","2","293","2","","","","","","","synthesis","3","P -1","-P 1","2","","4',3'',4''',3''''-tetramethyl-2,2':5,2'':5'',2''':5''',2'''':5'''',2'''''.- sexithiophene (triclinic form) ?","","- C28 H22 S6 -","- C28 H22 S6 -","- C28 H22 S6 -","1","0.5","","Giovanna Barbarella; Massimo Zambianchi; Luciano Antolini; Paolo Ostoja; Piera Maccagnani; Alessandro Bongini; Elisabeth A. Marseglia; Emilio Tedesco; Giuseppe Gigli; Roberto Cingolani","Solid-State Conformation, Molecular Packing, and Electrical and Optical Properties of Processable β-Methylated Sexithiophenes","Journal of the American Chemical Society","1999","121","","8920","8926","10.1021/ja9916512","","","0.71069","MoKα","","0.0511","0.0388","","0.1165","0.0957","","","","1.053","1.072","1.072","","","","","has coordinates,has disorder","301833","2025-08-20","15:22:59",""
"4116548","16.037","0.005","24.02","0.006","17.81","0.003","90","","94.74","0.02","90","","6837","3","299.2","","299.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C144 H156 Cl12 N12 O2 -","- C144 H156 Cl12 N12 O2 -","- C288 H312 Cl24 N24 O4 -","2","0.5","","Jun-ichiro Setsune; Yasuyuki Katakami; Noriko Iizuna","[48]Dodecaphyrin-(1.0.1.0.1.0.1.0.1.0.1.0) and [64]Hexadecaphyrin-(1.0.1.0.1.0.1.0.1.0.1.0.1.0.1.0): The Largest Cyclopolypyrroles","Journal of the American Chemical Society","1999","121","","8957","8958","10.1021/ja991669c","","","0.7107","MoKα","","","0.087","","","0.064","","","","","2.193","2.193","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116549","37.73","0.02","37.73","0.02","10.323","0.005","90","","90","","120","","12727","11","293","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","tetra(p-tolyl)porphyrin-Sn-(α-naphthoxy)2","","- C68 H50 N4 O2 Sn -","- C68 H50 N4 O2 Sn -","- C612 H450 N36 O18 Sn9 -","9","0.5","","Shai Nimri; Ehud Keinan","Antibody-Metalloporphyrin Catalytic Assembly Mimics Natural Oxidation Enzymes","Journal of the American Chemical Society","1999","121","","8978","8982","10.1021/ja990314q","","","0.71069","MoKα","","0.2851","0.0951","","","0.1714","0.2501","","","","","","0.962","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116550","33.441","0.004","10.835","0.0017","25.571","0.003","90","","120.65","0.06","90","","7971","5","150","","","","","","","","","","see text","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H32 Cl6 N8 O4 -","- C26 H32 Cl6 N8 O4 -","- C208 H256 Cl48 N64 O32 -","8","1","","Brigitte J. B. Folmer; Rint P. Sijbesma; Huub Kooijman; Anthony L. Spek; E. W. Meijer","Cooperative Dynamics in Duplexes of Stacked Hydrogen-Bonded Moieties","Journal of the American Chemical Society","1999","121","","9001","9007","10.1021/ja991409v","","","0.71073","MoKα","","0.0802","0.0705","","","0.1903","0.1977","","","","","","1.057","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116551","14.2449","0.0015","14.9691","0.0013","16.573","0.0015","111.565","0.007","91.186","0.008","97.456","0.007","3249.8","0.6","153","","","","","","","","","","see text","4","P -1","-P 1","2","","","","- C30 H44 N10 O6 -","- C30 H44 N10 O6 -","- C120 H176 N40 O24 -","4","2","","Brigitte J. B. Folmer; Rint P. Sijbesma; Huub Kooijman; Anthony L. Spek; E. W. Meijer","Cooperative Dynamics in Duplexes of Stacked Hydrogen-Bonded Moieties","Journal of the American Chemical Society","1999","121","","9001","9007","10.1021/ja991409v","","","0.71073","MoKα","","0.1158","0.0625","","","0.1442","0.1717","","","","","","1.01","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116552","13.7165","0.0003","14.8857","0.0002","16.5289","0.0004","104.403","0.001","109.278","0.001","107.093","0.001","2812.42","0.11","298","2","298","2","","","","","","","","6","P -1","-P 1","2","S2N3-TFA","","","- C58 H36 F15 N3 O10 S2 -","- C58 H36 F15 N3 O10 S2 -","- C116 H72 F30 N6 O20 S4 -","2","1","","Seenichamy Jeyaprakash Narayanan; Bashyam Sridevi; Tavarekere K. Chandrashekar; Ashwani Vij; Raja Roy","Novel Core-Modified Expanded Porphyrins with meso-Aryl Substituents: Synthesis, Spectral and Structural Characterization","Journal of the American Chemical Society","1999","121","","9053","9068","10.1021/ja991472k","","","0.71073","MoKα","","0.0931","0.0739","","","0.1784","0.1926","","","","","","1.197","","","","has coordinates,has disorder","178936","2020-10-21","18:00:00",""
"4116553","29.0002","0.0006","15.0991","0.0004","11.9801","0.0003","90","","105.816","0.001","90","","5047.2","0.2","213","2","213","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","S2N4 Rubyrin","","","- C66 H44 N6 S2 -","- C66 H44 N6 S2 -","- C264 H176 N24 S8 -","4","0.5","","Seenichamy Jeyaprakash Narayanan; Bashyam Sridevi; Tavarekere K. Chandrashekar; Ashwani Vij; Raja Roy","Novel Core-Modified Expanded Porphyrins with meso-Aryl Substituents: Synthesis, Spectral and Structural Characterization","Journal of the American Chemical Society","1999","121","","9053","9068","10.1021/ja991472k","","","0.71073","MoKα","","0.0598","0.0444","","","0.1132","0.121","","","","","","1.045","","","","has coordinates,has disorder","178936","2020-10-21","18:00:00",""
"4116554","16.8453","0.0003","17.1105","0.0002","21.2573","0.0003","91.248","0.001","112.815","0.001","90.368","0.001","5645.58","0.15","298","2","298","2","","","","","","","","5","P -1","-P 1","2","Se2N4 Rubyrin","","","- C136 H99 N13 O11 Se4 -","- C136 H99 N13 O11 Se4 -","- C272 H198 N26 O22 Se8 -","2","1","","Seenichamy Jeyaprakash Narayanan; Bashyam Sridevi; Tavarekere K. Chandrashekar; Ashwani Vij; Raja Roy","Novel Core-Modified Expanded Porphyrins with meso-Aryl Substituents: Synthesis, Spectral and Structural Characterization","Journal of the American Chemical Society","1999","121","","9053","9068","10.1021/ja991472k","","","0.71073","MoKα","","0.1164","0.0768","","","0.2041","0.2207","","","","","","1.107","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116555","5.9753","0.0001","13.1916","0.0002","26.6852","0.0006","90","","94.272","0.001","90","","2097.58","0.07","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","SeTripyrrane","","","- C26 H22 N2 Se -","- C26 H22 N2 Se -","- C104 H88 N8 Se4 -","4","1","","Seenichamy Jeyaprakash Narayanan; Bashyam Sridevi; Tavarekere K. Chandrashekar; Ashwani Vij; Raja Roy","Novel Core-Modified Expanded Porphyrins with meso-Aryl Substituents: Synthesis, Spectral and Structural Characterization","Journal of the American Chemical Society","1999","121","","9053","9068","10.1021/ja991472k","","","0.71073","MoKα","","0.1007","0.0629","","","0.0903","0.0995","","","","","","1.121","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116556","18.6416","0.0002","18.8457","0.0004","24.151","0.0004","90","","90","","90","","8484.6","0.2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C86 H74 Au4 F12 P6 S2 -","- C86 H74 Au4 F12 P6 S2 -","- C344 H296 Au16 F48 P24 S8 -","4","0.5","","Jinhua Chen; Tong Jiang; Gang Wei; Ahmed A. Mohamed; Craig Homrighausen; Jeanette A. Krause Bauer; Alice E. Bruce; Mitchell R. M. Bruce","Electrochemical and Chemical Oxidation of Gold(I) Thiolate Phosphine Complexes: Formation of Gold Clusters and Disulfide","Journal of the American Chemical Society","1999","121","","9225","9226","10.1021/ja991986j","","","0.71073","MoKα","","0.1492","0.0365","","0.0498","0.0376","","","","0.804","0.985","0.985","","","","","has coordinates,has disorder","301833","2025-08-20","15:22:59",""
"4116557","14.0845","0.0003","13.2873","0.0002","19.6109","0.0003","90","","97.516","0.001","90","","3638.55","0.11","270","2","270","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C66 H66 Au4 F12 O2 P6 S2 -","- C66 H66 Au4 F12 O2 P6 S2 -","- C132 H132 Au8 F24 O4 P12 S4 -","2","0.5","","Jinhua Chen; Tong Jiang; Gang Wei; Ahmed A. Mohamed; Craig Homrighausen; Jeanette A. Krause Bauer; Alice E. Bruce; Mitchell R. M. Bruce","Electrochemical and Chemical Oxidation of Gold(I) Thiolate Phosphine Complexes: Formation of Gold Clusters and Disulfide","Journal of the American Chemical Society","1999","121","","9225","9226","10.1021/ja991986j","","","0.71073","MoKα","","0.0999","0.053","","0.1476","0.1277","","","","1.002","1.135","1.135","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116558","11.0058","0.0008","12.615","0.001","18.518","0.002","101.804","0.009","100.032","0.007","98.682","0.008","2431.3","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Cs4(K-crypt)2[(Ge9)-(Ge9)](en)6","","- C24 H60 Cs2 Ge9 K N8 O6 -","- C24 H60 Cs2 Ge9 K N8 O6 -","- C48 H120 Cs4 Ge18 K2 N16 O12 -","2","1","","Li Xu; Slavi C. Sevov","Oxidative Coupling of Deltahedral [Ge9]4- Zintl Ions","Journal of the American Chemical Society","1999","121","","9245","9246","10.1021/ja992269s","","","0.71073","MoKα","","0.0828","0.0558","","","0.1536","0.1722","","","","","","1.036","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116559","13.2949","0.0005","13.2949","0.0005","61.02","0.003","90","","90","","120","","9340.6","0.7","200","","","","","","","","","","","8","R -3 :H","-R 3","148","","{4,4',4""-[nitrilotris-[2,1-ethanediyl(N-methylcarboxamido)]]tris[2-(6-N,N diethylcarboxamidopyridine)]} Europium(III) tris(trifluoromethanesulfonate)- hexafluorophosphate hemi acetonitrile.","","- C46 H62.5 Eu F15 N10.5 O15 P S3 -","- C46 H61 Eu F15.001 N10.5 O15 P S3 -","- C276 H366 Eu6 F90.006 N63 O90 P6 S18 -","6","0.333333","","Fabien Renaud; Claude Piguet; Gérald Bernardinelli; Jean-Claude Bünzli; Gérard Hopfgartner","Nine-Coordinate Lanthanide Podates with Predetermined Structural and Electronic Properties: Facial Organization of Unsymmetrical Tridentate Binding Units by a Protonated Covalent Tripod","Journal of the American Chemical Society","1999","121","","9326","9342","10.1021/ja990898w","","","1.54183","CuKα","","","0.065","","","","0.062","","","","","","2.687","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116560","10.156","0.001","10.435","0.001","16.845","0.002","83.97","0.02","75.47","0.02","69.06","0.02","1613.7","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H47 Cu N3 O2 -","- C36 H47 Cu N3 O2 -","- C72 H94 Cu2 N6 O4 -","2","1","","Phalguni Chaudhuri; Martina Hess; Jochen Müller; Knut Hildenbrand; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","Aerobic Oxidation of Primary Alcohols (Including Methanol) by Copper(II)- and Zinc(II)-Phenoxyl Radical Catalysts","Journal of the American Chemical Society","1999","121","","9599","9610","10.1021/ja991481t","","","0.71073","MoKα","","0.0716","0.0455","","0.1102","0.1019","","","","0.954","1.04","1.04","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116561","10.173","0.001","10.44","0.001","16.856","0.002","83.95","0.02","75.41","0.02","69.11","0.02","1618.4","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H47 N3 O2 Zn -","- C36 H47 N3 O2 Zn -","- C72 H94 N6 O4 Zn2 -","2","1","","Phalguni Chaudhuri; Martina Hess; Jochen Müller; Knut Hildenbrand; Eckhard Bill; Thomas Weyhermüller; Karl Wieghardt","Aerobic Oxidation of Primary Alcohols (Including Methanol) by Copper(II)- and Zinc(II)-Phenoxyl Radical Catalysts","Journal of the American Chemical Society","1999","121","","9599","9610","10.1021/ja991481t","","","0.71073","MoKα","","0.0794","0.0483","","0.1214","0.1111","","","","1.04","1.134","1.134","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116562","13.483","0.003","11.304","0.004","16.667","0.002","90","","113.28","0.01","90","","2333.4","1","150.2","","150.2","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C16 H40 Si5 -","- C16 H40 Si5 -","- C64 H160 Si20 -","4","1","","Mitsuo Kira; Shintaro Ishida; Takeaki Iwamoto; Chizuko Kabuto","The First Isolable Dialkylsilylene","Journal of the American Chemical Society","1999","121","","9722","9723","10.1021/ja9925305","","","0.7107","MoKα","","0.034","0.034","","","0.0359","0.0358","","","","","","2.079","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116563","9.718","0.002","10.116","0.002","10.318","0.002","77.67","0.02","69.64","0.02","88.51","0.02","927.7","0.4","143","2","143","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H60 Ga K N2 O8 -","- C30 H60 Ga K N2 O8 -","- C30 H60 Ga K N2 O8 -","1","0.5","","Eva S. Schmidt; Alexander Jockisch; Hubert Schmidbaur","A Carbene Analogue with Low-Valent Gallium as a Heteroatom in a quasi-Aromatic Imidazolate Anion","Journal of the American Chemical Society","1999","121","","9758","9759","10.1021/ja9928780","","","0.71073","MoKα","","0.0717","0.0336","","","0.0751","0.0857","","","","","","1.017","","","","has coordinates,has disorder","178936","2020-10-21","18:00:00",""
"4116564","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","","Eva S. Schmidt; Alexander Jockisch; Hubert Schmidbaur","A Carbene Analogue with Low-Valent Gallium as a Heteroatom in a quasi-Aromatic Imidazolate Anion","Journal of the American Chemical Society","1999","121","","9758","9759","10.1021/ja9928780","","","0.71073","MoKα","","0.1172","0.0615","","","0.1286","0.1436","","","","","","1.056","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116565","9.1858","0.0002","11.7879","0.0002","12.4318","0.0002","90","","102.651","0.001","90","","1313.45","0.04","171","2","171","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H20 O2 -","- C14 H20 O2 -","- C56 H80 O8 -","4","1","","Heiko Weiner; Richard G. Finke","An All-Inorganic, Polyoxometalate-Based Catechol Dioxygenase That Exhibits > 100000 Catalytic Turnovers","Journal of the American Chemical Society","1999","121","","9831","9842","10.1021/ja991503b","","","0.71073","MoKα","","0.0777","0.051","","0.1285","0.1132","","","","1.01","1.044","1.044","","","","","has coordinates","301833","2025-08-20","15:22:59",""
"4116566","10.694","0.0008","10.0875","0.0008","11.8878","0.0009","90","","106.054","0.001","90","","1232.39","0.16","162","2","162","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H20 O2 -","- C13 H20 O2 -","- C52 H80 O8 -","4","1","","Heiko Weiner; Richard G. Finke","An All-Inorganic, Polyoxometalate-Based Catechol Dioxygenase That Exhibits > 100000 Catalytic Turnovers","Journal of the American Chemical Society","1999","121","","9831","9842","10.1021/ja991503b","","","0.71073","MoKα","","0.0859","0.0508","","0.1397","0.1215","","","","1.011","1.084","1.084","","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116567","9.7459","0.0007","22.702","0.002","12.0229","0.0009","90","","98.142","0.002","90","","2633.3","0.4","165","2","165","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H40 O4 -","- C28 H40 O4 -","- C112 H160 O16 -","4","1","","Heiko Weiner; Richard G. Finke","An All-Inorganic, Polyoxometalate-Based Catechol Dioxygenase That Exhibits > 100000 Catalytic Turnovers","Journal of the American Chemical Society","1999","121","","9831","9842","10.1021/ja991503b","","","0.71073","MoKα","","0.2233","0.0876","","0.2172","0.153","","","","0.928","1.028","1.028","","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116568","10.4909","0.0001","10.0974","0.0002","13.4891","0.0001","90","","103.372","0.002","90","","1390.17","0.03","164","2","164","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H20 O3 -","- C14 H20 O3 -","- C56 H80 O12 -","4","1","","Heiko Weiner; Richard G. Finke","An All-Inorganic, Polyoxometalate-Based Catechol Dioxygenase That Exhibits > 100000 Catalytic Turnovers","Journal of the American Chemical Society","1999","121","","9831","9842","10.1021/ja991503b","","","0.71073","MoKα","","0.1194","0.0532","","0.1383","0.1136","","","","0.917","1.057","1.057","","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116569","14.9812","0.0003","16.4516","0.0004","19.8007","0.0004","105.631","0.001","92.076","0.001","109.402","0.001","4390.13","0.17","188","2","188","2","","","","","","","","5","P -1","-P 1","2","[Fe(m-O2CArTol)4(4-tBuC5H4N)2]","","","- C108 H100 Fe2 N2 O8 -","- C108 H100 Fe2 N2 O8 -","- C216 H200 Fe4 N4 O16 -","2","1","","Dongwhan Lee; J. Du Bois; Doros Petasis; Michael P. Hendrich; Carsten Krebs; Boi Hanh Huynh; Stephen J. Lippard","Formation of Fe(III)Fe(IV) Species from the Reaction between a Diiron(II) Complex and Dioxygen: Relevance to Ribonucleotide Reductase Intermediate X","Journal of the American Chemical Society","1999","121","","9893","9894","10.1021/ja9923686","","","0.71073","MoKα","","0.1988","0.0645","","","0.146","0.2116","","","","","","0.77","","","","has coordinates,has disorder","301833","2025-08-20","15:23:00",""
"4116570","14.7583","0.0008","14.9097","0.0008","24.8019","0.0014","91.95","0.001","93.961","0.001","110.962","0.001","5074","0.5","188","2","188","2","","","","","","","","6","P -1","-P 1","2","[Fe2(m-OH)2(m-O2CArTol)2(O2CArTol)2(4-tBuC5H4N2)]","","","- C109.5 H96 Cl6.6 Fe2 N2 O10 -","- C109.075 H96 Cl6.762 Fe2 N2 O10 -","- C218.15 H192 Cl13.524 Fe4 N4 O20 -","2","1","","Dongwhan Lee; J. Du Bois; Doros Petasis; Michael P. Hendrich; Carsten Krebs; Boi Hanh Huynh; Stephen J. Lippard","Formation of Fe(III)Fe(IV) Species from the Reaction between a Diiron(II) Complex and Dioxygen: Relevance to Ribonucleotide Reductase Intermediate X","Journal of the American Chemical Society","1999","121","","9893","9894","10.1021/ja9923686","","","0.71073","MoKα","","0.1143","0.0664","","","0.1755","0.2002","","","","","","1.054","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116571","10.536","0.002","20.451","0.004","27.557","0.006","90","","90","","90","","5938","2","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","g-lactam 4","3S-Hydroxy-2R-(1S-hydroxy-2-methyl-propyl)-4R-n-propyl-5- oxo-pyrrolidine-2-carboxylic acid methyl ester","","- C13 H23 N O5 -","- C13 H23 N O5 -","- C208 H368 N16 O80 -","16","4","","François Soucy; Louis Grenier; Mark L. Behnke; Antonia T. Destree; Teresa A. McCormack; Julian Adams; Louis Plamondon","A Novel and Efficient Synthesis of a Highly Active Analogue of clasto-Lactacystin β-Lactone","Journal of the American Chemical Society","1999","121","","9967","9976","10.1021/ja991175f","","","0.71073","MoKα","","0.1156","0.0736","","","0.1714","0.1957","","","","","","1.026","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116572","18.1764","0.0007","24.2486","0.0009","26.3578","0.001","90","","101.013","0.001","90","","11403.3","0.7","293","2","138","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","1","","","- C128 H78 Au2 Cl5.5 N6 O12 P6 Tl -","- C128 H78 Au2 Cl5.5 N6 O12 P6 Tl -","- C512 H312 Au8 Cl22 N24 O48 P24 Tl4 -","4","1","","Vincent J. Catalano; Byron L. Bennett; Heidi M. Kar; Bruce C. Noll","Synthesis and Characterization of Trigonal Gold(I) Cage Complexes: Luminescent Metallocryptates Encapsulating Tl(I) and Na+ Ions","Journal of the American Chemical Society","1999","121","","10235","10236","10.1021/ja991982e","","","0.71073","MoKα","","0.1594","0.0671","","","0.1123","0.1345","","","","","","0.992","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116573","18.4038","0.0018","24.336","0.003","27.089","0.002","90","","101.394","0.006","90","","11893","2","138","2","138","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","2","","","- C125.5 H78 Au2 Cl2 F18 N6 Na O2 P9 -","- C125.5 H78 Au2 Cl2 F18 N6 Na O2 P9 -","- C502 H312 Au8 Cl8 F72 N24 Na4 O8 P36 -","4","1","","Vincent J. Catalano; Byron L. Bennett; Heidi M. Kar; Bruce C. Noll","Synthesis and Characterization of Trigonal Gold(I) Cage Complexes: Luminescent Metallocryptates Encapsulating Tl(I) and Na+ Ions","Journal of the American Chemical Society","1999","121","","10235","10236","10.1021/ja991982e","","","0.71073","MoKα","","0.0974","0.0547","","","0.1349","0.152","","","","","","1.056","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4116574","33.03","0.005","15.798","0.003","23.331","0.006","90","","129.357","0.012","90","","9413","4","298","2","298","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","AuMacrocycle","","","- C88 H52 Au2 Cl3 F12 N4 O P6 -","- C88 H52 Au2 Cl3 F12 N4 O P6 -","- C352 H208 Au8 Cl12 F48 N16 O4 P24 -","4","0.5","","Vincent J. Catalano; Byron L. Bennett; Heidi M. Kar; Bruce C. Noll","Synthesis and Characterization of Trigonal Gold(I) Cage Complexes: Luminescent Metallocryptates Encapsulating Tl(I) and Na+ Ions","Journal of the American Chemical Society","1999","121","","10235","10236","10.1021/ja991982e","","","0.71073","MoKα","","0.1517","0.0742","","","0.1688","0.2041","","","","","","1.048","","","","has coordinates,has disorder","286259","2023-09-07","06:04:40",""
"4116575","12.39","0.002","11.8747","0.0008","18.655","0.002","90","","91.79","0.01","90","","2743.3","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","[3,6-di-tert-butyl-9,10-dimethylbicyclo[6.3.0]undec-4-en-(5-1,8- 11-dienyl)][ 3: 4-1,2-dimethyl-3,4- dimethylenecyclopentenyl]titanium(II)","","- C30 H44 Ti -","- C30 H44 Ti -","- C120 H176 Ti4 -","4","1","","Michal Horáček; Petr Štěpnička; Róbert Gyepes; Ivana Císařová; Miroslav Polášek; Karel Mach; Paul-Michael Pellny; Vladimir V. Burlakov; Wolfgang Baumann; Anke Spannenberg; Uwe Rosenthal","Novel Addition Reactions of 2,2,7,7-Tetramethyl-3,5-octadiyne to the Methyl Groups of a η5-Pentamethylcyclopentadienyl Ligand","Journal of the American Chemical Society","1999","121","","10638","10639","10.1021/ja991299s","","","0.71069","MoKα","","0.0726","0.0409","","","0.1053","0.1175","","","","","","1.032","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116576","11.0367","0.0004","11.0367","0.0004","30.4227","0.0014","90","","90","","120","","3209.3","0.2","188","2","188","2","","","","","","","","4","P 65 2 2","P 65 2 (0 0 1)","179","[Fe(TC-5,5)] (1)","","","- C24 H30 Fe N4 -","- C24 H30 Fe N4 -","- C144 H180 Fe6 N24 -","6","0.5","","Katherine J. Franz; Stephen J. Lippard","NO Disproportionation Reactivity of Fe Tropocoronand Complexes","Journal of the American Chemical Society","1999","121","","10504","10512","10.1021/ja991664f","","","0.71073","MoKα","","0.0879","0.0796","","","0.147","0.1495","","","","","","1.387","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116577","15.4688","0.0002","9.4959","0.0002","18.5944","0.0002","90","","113.551","0.001","90","","2503.83","0.07","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","[Fe(OTf)(TC-5,5)] (2)","","","- C25 H30 F3 Fe N4 O3 S -","- C25 H30 F3 Fe N4 O3 S -","- C100 H120 F12 Fe4 N16 O12 S4 -","4","1","","Katherine J. Franz; Stephen J. Lippard","NO Disproportionation Reactivity of Fe Tropocoronand Complexes","Journal of the American Chemical Society","1999","121","","10504","10512","10.1021/ja991664f","","","0.71073","MoKα","","0.097","0.0623","","","0.1434","0.1556","","","","","","1.096","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116578","9.21","0.003","10.096","0.005","23.334","0.008","90","","94.58","0.03","90","","2162.8","1.5","188","2","188","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Fe(NO)(TC-5,5)] (3)","","","- C24 H30 Fe N5 O -","- C24 H30 Fe N5 O -","- C96 H120 Fe4 N20 O4 -","4","1","","Katherine J. Franz; Stephen J. Lippard","NO Disproportionation Reactivity of Fe Tropocoronand Complexes","Journal of the American Chemical Society","1999","121","","10504","10512","10.1021/ja991664f","","","0.71073","MoKα","","0.1082","0.0608","","","0.1768","0.1925","","","","","","1.095","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116579","8.503","0.001","9.847","0.001","15.009","0.001","90","","100.17","0.03","90","","1236.9","0.2","150","0.1","150","0.1","","","","","","","hydrothermal synthesis","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H18 F4 N2 O5 U -","- C4 H12 F4 N2 O5 U -","- C16 H48 F16 N8 O20 U4 -","4","1","","Susan M. Walker; P. Shiv Halasyamani; Simon Allen; Dermot O'Hare","From Molecules to Frameworks: Variable Dimensionality in the UO2(CH3COO)2.2H2O/HF(aq)/Piperazine System. Syntheses, Structures, and Characterization of Zero-Dimensional (C4N2H12)UO2F4.3H2O, One-Dimensional (C4N2H12)2U2F12.H2O, Two-Dimensional (C4N2H12)2(U2O4F5)4.11H2O, and Three-Dimensional (C4N2H12)U2O4F6","Journal of the American Chemical Society","1999","121","","10513","10521","10.1021/ja992145f","","","0.71073","MoKα","","0.0363","0.0335","","0.085","0.0832","","","","1.042","1.048","1.048","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116580","11.983","0.001","8.751","0.001","6.412","0.001","91.53","0.004","112.143","0.004","98.444","0.003","613.57","0.13","200","0.2","150","0.2","","","","","","","hydrothermal synthesis","6","P -1","-P 1","2","","","","- C4 H18 F4 N2 O5 U -","- C4 H12 F4 N2 O5 U -","- C8 H24 F8 N4 O10 U2 -","2","1","","Susan M. Walker; P. Shiv Halasyamani; Simon Allen; Dermot O'Hare","From Molecules to Frameworks: Variable Dimensionality in the UO2(CH3COO)2.2H2O/HF(aq)/Piperazine System. Syntheses, Structures, and Characterization of Zero-Dimensional (C4N2H12)UO2F4.3H2O, One-Dimensional (C4N2H12)2U2F12.H2O, Two-Dimensional (C4N2H12)2(U2O4F5)4.11H2O, and Three-Dimensional (C4N2H12)U2O4F6","Journal of the American Chemical Society","1999","121","","10513","10521","10.1021/ja992145f","","","0.71073","MoKα","","0.0472","0.0438","","0.1173","0.1147","","","","1.016","1.036","1.036","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116581","13.017","0.001","12.379","0.001","6.651","0.001","90","","107.68","0.01","90","","1021.1","0.2","150","0.1","150","0.1","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C8 H26 F12 N4 O U2 -","- C8 H24 F12 N4 O U2 -","- C16 H48 F24 N8 O2 U4 -","2","0.25","","Susan M. Walker; P. Shiv Halasyamani; Simon Allen; Dermot O'Hare","From Molecules to Frameworks: Variable Dimensionality in the UO2(CH3COO)2.2H2O/HF(aq)/Piperazine System. Syntheses, Structures, and Characterization of Zero-Dimensional (C4N2H12)UO2F4.3H2O, One-Dimensional (C4N2H12)2U2F12.H2O, Two-Dimensional (C4N2H12)2(U2O4F5)4.11H2O, and Three-Dimensional (C4N2H12)U2O4F6","Journal of the American Chemical Society","1999","121","","10513","10521","10.1021/ja992145f","","","0.71073","MoKα","","0.0299","0.0293","","","0.0793","0.0798","","","","","","1.208","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116582","17.309","0.005","12.092","0.005","24.399","0.007","90","","90.47","0.02","90","","5107","3","150","0.2","150","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C8 H46 F20 N4 O27 U8 -","- C8 H24 F20 N4 O27 U8 -","- C32 H96 F80 N16 O108 U32 -","4","1","","Susan M. Walker; P. Shiv Halasyamani; Simon Allen; Dermot O'Hare","From Molecules to Frameworks: Variable Dimensionality in the UO2(CH3COO)2.2H2O/HF(aq)/Piperazine System. Syntheses, Structures, and Characterization of Zero-Dimensional (C4N2H12)UO2F4.3H2O, One-Dimensional (C4N2H12)2U2F12.H2O, Two-Dimensional (C4N2H12)2(U2O4F5)4.11H2O, and Three-Dimensional (C4N2H12)U2O4F6","Journal of the American Chemical Society","1999","121","","10513","10521","10.1021/ja992145f","","","0.71073","MoKα","","0.0841","0.0576","","0.1619","0.1552","","","","1.063","1.238","1.238","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116583","9.108","0.001","10.059","0.001","13.633","0.001","90","","97.023","0.001","90","","1239.6","0.2","293","2","293","2","","","","","","","synthesis as described","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H12 F6 N2 O4 U2 -","- C4 F6 N1.99 O4 U2 -","- C16 F24 N7.96 O16 U8 -","4","0.5","","Susan M. Walker; P. Shiv Halasyamani; Simon Allen; Dermot O'Hare","From Molecules to Frameworks: Variable Dimensionality in the UO2(CH3COO)2.2H2O/HF(aq)/Piperazine System. Syntheses, Structures, and Characterization of Zero-Dimensional (C4N2H12)UO2F4.3H2O, One-Dimensional (C4N2H12)2U2F12.H2O, Two-Dimensional (C4N2H12)2(U2O4F5)4.11H2O, and Three-Dimensional (C4N2H12)U2O4F6","Journal of the American Chemical Society","1999","121","","10513","10521","10.1021/ja992145f","","","0.71073","MoKα","","0.0409","0.0405","","0.1053","0.1051","","","","1.313","1.314","1.314","","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116584","8.1477","0.0007","13.8943","0.0012","10.1659","0.0009","90","","109.454","0.01","90","","1085.14","0.18","150","2","150","2","","","","","","","","6","P 1 21 1","P 2yb","4","","dihydride-triisopropylphosphine-1,3,5-trimethylbenzene-iridium(III) tetrafluoro borate","","- C18 H35 B F4 Ir P -","- C18 H35 B F4 Ir P -","- C36 H70 B2 F8 Ir2 P2 -","2","1","","Francisco Torres; Eduardo Sola; Marta Martín; José A. López; Fernando J. Lahoz; Luis A. Oro","C-H Bond Activations by New Labile η6-Arene Complexes of Iridium","Journal of the American Chemical Society","1999","121","","10632","10633","10.1021/ja9923890","","","0.71073","MoKα","","0.0367","0.0345","","","0.0816","0.0833","","","","","","1.079","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116585","4.9028","0.0004","14.349","0.001","16.165","0.002","90","","90","","90","","1137.21","0.19","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H17 N O3 -","- C11 H16 N O3 -","- C44 H64 N4 O12 -","4","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.1001","0.0659","","","0.1641","0.1847","","","","","","1.069","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116586","8.2686","0.0008","9.2367","0.0009","17.212","0.002","90","","90","","90","","1314.6","0.2","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H17 N O5 -","- C12 H17 N O5 -","- C48 H68 N4 O20 -","4","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.1064","0.0408","","","0.0507","0.0581","","","","","","0.989","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116587","7.9966","0.0003","9.443","0.0004","19.1856","0.0008","90","","90","","90","","1448.74","0.1","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H19 N O5 -","- C13 H19 N O5 -","- C52 H76 N4 O20 -","4","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.0481","0.0404","","","0.1063","0.1106","","","","","","1.063","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116588","8.1179","0.0004","23.51","0.001","9.4519","0.0005","90","","92.719","0.001","90","","1801.88","0.15","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H23 N O4 -","- C18 H23 N O4 -","- C72 H92 N4 O16 -","4","2","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.0575","0.0405","","","0.0887","0.0953","","","","","","1.009","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116589","16.277","0.002","30.993","0.004","10.906","0.001","90","","90","","90","","5501.8","1.1","213","2","213","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C14 H21 N O3 -","- C14 H21 N O3 -","- C224 H336 N16 O48 -","16","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.1056","0.0434","","","0.0581","0.0641","","","","","","1.139","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116590","12.3563","0.0002","5.3759","0.0003","13.1034","0.0007","90","","111.416","0.003","90","","810.31","0.07","213","2","213","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C17 H18 O6 -","- C17.001 H18 O6 -","- C34.002 H36 O12 -","2","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.0666","0.0411","","","0.093","0.0986","","","","","","1.006","","","","has coordinates,has disorder","178936","2020-10-21","18:00:00",""
"4116591","6.2147","0.0002","15.7066","0.0005","16.6334","0.0002","90","","90","","90","","1623.62","0.08","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H23 N O3 -","- C18 H23 N O3 -","- C72 H92 N4 O12 -","4","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.0809","0.0589","","","0.1505","0.1643","","","","","","1.043","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116592","4.938","0.0004","15.519","0.001","16.645","0.001","90","","90","","90","","1275.55","0.15","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H19 N O3 -","- C12 H19 N O3 -","- C48 H76 N4 O12 -","4","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.1249","0.0657","","","0.136","0.1624","","","","","","1.009","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116593","11.715","0.003","4.965","0.001","12.921","0.004","90","","96.798","0.005","90","","746.3","0.3","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H21 N O5 -","- C14 H21 N O5 -","- C28 H42 N2 O10 -","2","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.1135","0.0736","","","0.1834","0.212","","","","","","1.031","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116594","8.1709","0.0004","9.6189","0.0004","8.9825","0.0001","90","","96.239","0.002","90","","701.8","0.05","213","2","213","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H19 N O5 -","- C13 H19 N O5 -","- C26 H38 N2 O10 -","2","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.0442","0.0371","","","0.09","0.0921","","","","","","1.03","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116595","15.629","0.004","8.23","0.002","9.739","0.002","90","","94.815","0.005","90","","1248.3","0.5","213","2","213","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C12 H19 N O3 -","- C12 H19 N O3 -","- C48 H76 N4 O12 -","4","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.1135","0.0527","","","0.0834","0.0975","","","","","","1.039","","","","has coordinates,has disorder","301833","2025-08-20","15:23:00",""
"4116596","16.9921","0.0006","18.2387","0.0008","5.915","0.0003","90","","90","","90","","1833.14","0.14","213","2","213","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C20 H27 N O3 -","- C20 H27 N O3 -","- C80 H108 N4 O12 -","4","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.1295","0.0553","","","0.1114","0.1287","","","","","","1.064","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116597","5.1736","0.0002","12.1557","0.0006","22.513","0.001","90","","90","","90","","1415.81","0.11","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H18 N O3 -","- C16 H18 N O3 -","- C64 H72 N4 O12 -","4","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.0936","0.0438","","","0.0782","0.0841","","","","","","1.065","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116598","7.958","0.0004","9.2646","0.0005","25.971","0.001","90","","90","","90","","1914.78","0.16","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H23 N O5 -","- C18 H23 N O5 -","- C72 H92 N4 O20 -","4","1","","Daesung Lee; Jason K. Sello; Stuart L. Schreiber","A Strategy for Macrocyclic Ring Closure and Functionalization Aimed toward Split-Pool Syntheses","Journal of the American Chemical Society","1999","121","","10648","10649","10.1021/ja992658m","","","0.71073","MoKα","","0.1219","0.0399","","","0.0536","0.06","","","","","","1.039","","","","has coordinates","178936","2020-10-21","18:00:00",""
"4116599","14.555","0.002","14.555","0.002","11.446","0.002","90","","90","","120","","2099.9","0.5","173","2","293","2","","","","","","","","3","R 3 :H","R 3","146","","","","- C24 H54 N8 -","- C24 H36 N8 -","- C72 H108 N24 -","3","0.333333","","Jineun Kim; Andrew S. Ichimura; Rui H. Huang; Mikhail Redko; Richard C. Phillips; James E. Jackson; James L. Dye","Crystalline Salts of Na-and K-(Alkalides) that Are Stable at Room Temperature","Journal of the American Chemical Society","1999","121","","10666","10667","10.1021/ja992667v","","","0.71073","MoKα","","0.0837","0.072","","0.2505","0.2299","","","","0.982","1.003","1.003","","","","","has coordinates,has disorder","178936","2020-10-21","18:00:00",""
"4116600","17.815","0.004","16.942","0.003","23.136","0.005","90","","90","","90","","6983","3","173","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C26 H59 I K N8 O -","- C26 H60 I K N8 O -","- C208 H480 I8 K8 N64 O8 -","8","1","","Jineun Kim; Andrew S. Ichimura; Rui H. Huang; Mikhail Redko; Richard C. Phillips; James E. Jackson; James L. Dye","Crystalline Salts of Na-and K-(Alkalides) that Are Stable at Room Temperature","Journal of the American Chemical Society","1999","121","","10666","10667","10.1021/ja992667v","","","0.71073","MoKα","","0.0788","0.0521","","0.1271","0.1147","","","","1.036","1.09","1.09","","","","","has coordinates","178937","2020-10-21","18:00:00",""
"4116601","26.388","0.004","26.388","","26.388","","90","","90","","90","","18375","3","183.2","","183.2","","","","","","","","","7","I -4 3 d","I -4bd 2c 3","220","","","","- C26.33 H53.33 Cl8 O28 P4 Pt4 S8 -","- C29 Cl8 O16 P4 Pt4 S8 -","- C348 Cl96 O192 P48 Pt48 S96 -","12","0.25","","Tadashi Yamaguchi; Haruko Saito; Taro Maki; Tasuku Ito","Syntheses and Structures of Bridge and Chelate Isomers of Tetraplatinum(II) Cluster Complex with Diethyldithiophosphate Ion (Et2dtp) at In-Plane Sites, [Pt4(CH3COO)4(Et2dtp)4], and Their Mutual Isomerization via Cluster Core Rotation","Journal of the American Chemical Society","1999","121","","10738","10742","10.1021/ja990596u","","","0.7107","MoKα","","","0.0461","","","","0.0444","","","","","","1.269","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116602","12.794","0.008","24.99","0.003","14.927","0.003","90","","90","","90","","4772","3","183.2","","183.2","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C24 H52 O16 P4 Pt4 S8 -","- C24 O16 P4 Pt4 S8 -","- C96 O64 P16 Pt16 S32 -","4","0.5","","Tadashi Yamaguchi; Haruko Saito; Taro Maki; Tasuku Ito","Syntheses and Structures of Bridge and Chelate Isomers of Tetraplatinum(II) Cluster Complex with Diethyldithiophosphate Ion (Et2dtp) at In-Plane Sites, [Pt4(CH3COO)4(Et2dtp)4], and Their Mutual Isomerization via Cluster Core Rotation","Journal of the American Chemical Society","1999","121","","10738","10742","10.1021/ja990596u","","","0.7107","MoKα","","","0.0342","","","","0.0374","","","","","","1.477","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116603","10.096","0.004","11.802","0.004","12.42","0.01","90","","108.74","0.06","90","","1401.4","1.4","296","","296","","","","","","","","electrochemical oxidation","4","C 1 2/m 1","-C 2y","12","Ni(ptdt)2 296K","","","- C18 H12 Ni S16 -","- C15 H10 Ni0.25 S16 -","- C30 H20 Ni0.5 S32 -","2","0.25","","Akiko Kobayashi; Hisashi Tanaka; Mieko Kumasaki; Hajime Torii; Bakhyt Narymbetov; Takahumi Adachi","Origin of the High Electrical Conductivity of Neutral [Ni(ptdt)2] (ptdt2-= propylenedithiotetrathiafulvalenedithiolate): A Route to Neutral Molecular Metal","Journal of the American Chemical Society","1999","121","","10763","10771","10.1021/ja9921017","","","0.7107","MoKα","","","0.0873","","","0.1498","","","","","0.14","0.14","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116604","10.058","0.006","11.728","0.006","12.16","0.01","90","","108.11","0.06","90","","1363.3","1.6","90","","90","","","","","","","","electrochemical oxidation","4","C 1 2/m 1","-C 2y","12","Ni(ptdt)2 90K","","","- C18 H12 Ni S16 -","- C15 H10 Ni0.25 S16 -","- C30 H20 Ni0.5 S32 -","2","0.25","","Akiko Kobayashi; Hisashi Tanaka; Mieko Kumasaki; Hajime Torii; Bakhyt Narymbetov; Takahumi Adachi","Origin of the High Electrical Conductivity of Neutral [Ni(ptdt)2] (ptdt2-= propylenedithiotetrathiafulvalenedithiolate): A Route to Neutral Molecular Metal","Journal of the American Chemical Society","1999","121","","10763","10771","10.1021/ja9921017","","","0.7107","MoKα","","","0.0904","","","0.1667","","","","","0.148","0.148","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116605","14.003","0.003","15.695","0.003","12.6","0.004","98.56","0.02","96.49","0.02","69.32","0.02","2556.4","1.2","288.2","","288.2","","","","","","","","","8","P -1","-P 1","2","","","","- C41 H42 Cl6 Cu2 F12 N6 O2 P2 -","- C41 H40 Cl6.01 Cu2 F12 N6 O2 P2 -","- C82 H80 Cl12.02 Cu4 F24 N12 O4 P4 -","2","1","","Masahito Kodera; Kou Katayama; Yoshimitsu Tachi; Koji Kano; Shun Hirota; Shuhei Fujinami; Masatatu Suzuki","Crystal Structure and Reversible O2-Binding of a Room Temperature Stable μ-η2:η2-Peroxodicopper(II) Complex of a Sterically Hindered Hexapyridine Dinucleating Ligand","Journal of the American Chemical Society","1999","121","","11006","11007","10.1021/ja992295q","","","0.7107","MoKα","","","0.0799","","","0.1137","","","","","1.625","1.625","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116606","16.0292","0.0004","19.0713","0.0006","16.8933","0.0005","90","","111.288","0.002","90","","4811.9","0.2","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C56 H58 N6 O4 -","- C56 H58 N6 O4 -","- C224 H232 N24 O16 -","4","1","","Pavel Anzenbacher; Karolina Jursíková; Vincent M. Lynch; Philip A. Gale; Jonathan L. Sessler","Calix[4]pyrroles Containing Deep Cavities and Fixed Walls. Synthesis, Structural Studies, and Anion Binding Properties of the Isomeric Products Derived from the Condensation of p-Hydroxyacetophenone and Pyrrole","Journal of the American Chemical Society","1999","121","","11020","11021","10.1021/ja993195n","","","0.71073","MoKα","","0.0787","0.049","","0.1141","0.0991","","","","1.03","1.068","1.068","","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116607","10.882","0.0005","20.205","0.0006","19.74","0.0006","90","","105.134","0.002","90","","4189.7","0.3","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C50 H52 N4 O6 -","- C50 H51 N4 O6 -","- C200 H204 N16 O24 -","4","1","","Pavel Anzenbacher; Karolina Jursíková; Vincent M. Lynch; Philip A. Gale; Jonathan L. Sessler","Calix[4]pyrroles Containing Deep Cavities and Fixed Walls. Synthesis, Structural Studies, and Anion Binding Properties of the Isomeric Products Derived from the Condensation of p-Hydroxyacetophenone and Pyrrole","Journal of the American Chemical Society","1999","121","","11020","11021","10.1021/ja993195n","","","0.71073","MoKα","","0.1005","0.0582","","0.1288","0.1107","","","","1.079","1.152","1.152","","","","","has coordinates,has disorder","178937","2020-10-21","18:00:00",""
"4116608","9.453","0.0003","14.998","0.0005","14.672","0.0005","90","","102.922","0.002","90","","2027.46","0.12","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C50 H52 N4 O4 -","- C50 H52 N4 O6 -","- C100 H104 N8 O12 -","2","0.5","","Pavel Anzenbacher; Karolina Jursíková; Vincent M. Lynch; Philip A. Gale; Jonathan L. Sessler","Calix[4]pyrroles Containing Deep Cavities and Fixed Walls. Synthesis, Structural Studies, and Anion Binding Properties of the Isomeric Products Derived from the Condensation of p-Hydroxyacetophenone and Pyrrole","Journal of the American Chemical Society","1999","121","","11020","11021","10.1021/ja993195n","","","0.71073","MoKα","","0.0845","0.0486","","0.1152","0.0985","","","","0.985","1.031","1.031","","","","","has coordinates","178937","2020-10-21","18:00:00",""
"4116609","11.1593","0.0004","11.2873","0.0004","25.7805","0.0007","90","","92.901","0.002","90","","3243.11","0.19","153","2","153","2","","","","","","","","5","P 1 n 1","P -2yac","7","","","","- C70 H95 F N6 O6 -","- C70 H95 F N6 O6 -","- C140 H190 F2 N12 O12 -","2","1","","Pavel Anzenbacher; Karolina Jursíková; Vincent M. Lynch; Philip A. Gale; Jonathan L. Sessler","Calix[4]pyrroles Containing Deep Cavities and Fixed Walls. Synthesis, Structural Studies, and Anion Binding Properties of the Isomeric Products Derived from the Condensation of p-Hydroxyacetophenone and Pyrrole","Journal of the American Chemical Society","1999","121","","11020","11021","10.1021/ja993195n","","","0.71073","MoKα","","0.1389","0.0785","","0.1751","0.1492","","","","1.063","1.152","1.152","","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116610","10.435","0.002","20.878","0.003","24.207","0.003","68.4","0.1","89.1","0.1","82.8","0.1","4862","4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","Ac-TOAC-(Aib)2-TOAC-Aib-OtBu dihydrate","","- C38 H71 N7 O11 -","- C38 H71 N7 O11 -","- C152 H284 N28 O44 -","4","2","","Alessandra Polese; D. Joe Anderson; Glenn Millhauser; Fernando Formaggio; Marco Crisma; Fernando Marchiori; Claudio Toniolo","First Interchain Peptide Interaction Detected by ESR in Fully Synthetic, Template-Assisted, Two-Helix Bundles","Journal of the American Chemical Society","1999","121","","11071","11078","10.1021/ja992079h","","","1.54178","CuKα","","0.1749","0.0834","","","0.2063","0.2472","","","","","","0.896","","","","has coordinates,has disorder","178937","2020-10-21","18:00:00",""
"4116611","17.7526","0.0003","21.1054","0.0004","17.8629","0.0002","90","","104.505","0.001","90","","6479.47","0.18","173","2","173","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- Ca H100 N13 O134 P5 W30 -","- Ca O147 P5 W30 -","- Ca2 O294 P10 W60 -","2","0.5","","Kee-Chan Kim; Michael T. Pope; Gennaro J. Gama; Michael H. Dickman","Slow Proton Exchange in Aqueous Solution. Consequences of Protonation and Hydration within the Central Cavity of Preyssler Anion Derivatives, [|M(H2O)|@P5W30O110]n-","Journal of the American Chemical Society","1999","121","","11164","11170","10.1021/ja992105b","","","0.71073","MoKα","","0.1132","0.084","","","0.2179","0.2382","","","","","","1.052","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116612","17.4987","0.0002","21.5054","0.0003","17.5497","0.0001","90","","104.808","0.001","90","","6384.9","0.12","173","2","173","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- Ca H94 K5 O153 P5 W30 -","- Ca K5 O153 P5 W30 -","- Ca2 K10 O306 P10 W60 -","2","0.5","","Kee-Chan Kim; Michael T. Pope; Gennaro J. Gama; Michael H. Dickman","Slow Proton Exchange in Aqueous Solution. Consequences of Protonation and Hydration within the Central Cavity of Preyssler Anion Derivatives, [|M(H2O)|@P5W30O110]n-","Journal of the American Chemical Society","1999","121","","11164","11170","10.1021/ja992105b","","","0.71073","MoKα","","0.0862","0.0589","","","0.1463","0.1632","","","","","","1.036","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116613","16.9079","0.0006","20.9669","0.0007","17.8737","0.0006","90","","113.786","0.001","90","","5798.1","0.3","173","2","173","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- H50 K3 O131 P5 U W30 -","- K3 O131 P5 U W30 -","- K6 O262 P10 U2 W60 -","2","0.5","","Kee-Chan Kim; Michael T. Pope; Gennaro J. Gama; Michael H. Dickman","Slow Proton Exchange in Aqueous Solution. Consequences of Protonation and Hydration within the Central Cavity of Preyssler Anion Derivatives, [|M(H2O)|@P5W30O110]n-","Journal of the American Chemical Society","1999","121","","11164","11170","10.1021/ja992105b","","","0.71073","MoKα","","0.1002","0.0703","","","0.1524","0.1664","","","","","","1.108","","","","has coordinates","178937","2020-10-21","18:00:00",""
"4116614","17.6012","0.0008","28.1222","0.0013","24.6158","0.0011","90","","109.311","0.001","90","","11498.9","0.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- H69 K5 O141 P5 W30 Y -","- K5.1 O141 P5 W30 Y -","- K20.4 O564 P20 W120 Y4 -","4","0.5","","Kee-Chan Kim; Michael T. Pope; Gennaro J. Gama; Michael H. Dickman","Slow Proton Exchange in Aqueous Solution. Consequences of Protonation and Hydration within the Central Cavity of Preyssler Anion Derivatives, [|M(H2O)|@P5W30O110]n-","Journal of the American Chemical Society","1999","121","","11164","11170","10.1021/ja992105b","","","0.71073","MoKα","","0.1041","0.0843","","","0.1719","0.1837","","","","","","1.266","","","","has coordinates","178937","2020-10-21","18:00:00",""
"4116615","17.464","0.004","17.766","0.003","23.51","0.003","97.351","0.011","98.298","0.008","112.133","0.018","6552","2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- H112 N14 Na O138.5 P5 W30 -","- Na O152.5 P5 W30 -","- Na2 O305 P10 W60 -","2","1","","Kee-Chan Kim; Michael T. Pope; Gennaro J. Gama; Michael H. Dickman","Slow Proton Exchange in Aqueous Solution. Consequences of Protonation and Hydration within the Central Cavity of Preyssler Anion Derivatives, [|M(H2O)|@P5W30O110]n-","Journal of the American Chemical Society","1999","121","","11164","11170","10.1021/ja992105b","","","0.71073","MoKα","","0.0851","0.0564","","","0.1214","0.1346","","","","","","1.097","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116616","17.5255","0.0001","21.0554","0.0002","35.5201","0.0003","90","","104.142","0.001","90","","12709.9","0.19","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- H96 N12 O134 P5 W30 Y -","- O146 P5 W30 Y -","- O584 P20 W120 Y4 -","4","1","","Kee-Chan Kim; Michael T. Pope; Gennaro J. Gama; Michael H. Dickman","Slow Proton Exchange in Aqueous Solution. Consequences of Protonation and Hydration within the Central Cavity of Preyssler Anion Derivatives, [|M(H2O)|@P5W30O110]n-","Journal of the American Chemical Society","1999","121","","11164","11170","10.1021/ja992105b","","","0.71073","MoKα","","0.0939","0.0627","","","0.1428","0.1593","","","","","","1.067","","","","has coordinates","178937","2020-10-21","18:00:00",""
"4116617","10.98","0.01","4.862","0.002","17.72","0.01","90","","97.93","0.09","90","","936.9","1.1","210.2","","210.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C10 H12 N O2 -","- C10 H12 N O2 -","- C40 H48 N4 O8 -","4","1","","Akikazu Matsumoto; Toru Odani; Masaaki Chikada; Kazuki Sada; Mikiji Miyata","Crystal-Lattice Controlled Photopolymerization of Di(benzylammonium) (Z,Z)-Muconates","Journal of the American Chemical Society","1999","121","","11122","11129","10.1021/ja992558g","","","0.7107","MoKα","","0.1149","0.1149","","","0.3131","0.3131","","","","","","1.226","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116618","11.033","0.002","4.936","0.0008","18.011","0.004","90","","95.055","0.005","90","","977","0.3","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H11 Cl N O2 -","- C10 H11 Cl N O2 -","- C40 H44 Cl4 N4 O8 -","4","1","","Akikazu Matsumoto; Toru Odani; Masaaki Chikada; Kazuki Sada; Mikiji Miyata","Crystal-Lattice Controlled Photopolymerization of Di(benzylammonium) (Z,Z)-Muconates","Journal of the American Chemical Society","1999","121","","11122","11129","10.1021/ja992558g","","","0.7107","MoKα","","0.0983","0.0983","","","0.2727","0.2727","","","","","","1.155","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116619","8.614","0.002","13.731","0.004","8.795","0.003","90","","103.06","0.02","90","","1013.4","0.5","296.2","","296.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C11 H14 N O2 -","- C11 H14 N O2 -","- C44 H56 N4 O8 -","4","1","","Akikazu Matsumoto; Toru Odani; Masaaki Chikada; Kazuki Sada; Mikiji Miyata","Crystal-Lattice Controlled Photopolymerization of Di(benzylammonium) (Z,Z)-Muconates","Journal of the American Chemical Society","1999","121","","11122","11129","10.1021/ja992558g","","","0.7107","MoKα","","0.0444","0.0444","","","0.1263","0.1263","","","","","","1.159","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116620","8.594","0.0006","11.638","0.001","11.158","0.001","90","","110.433","0.002","90","","1045.77","0.15","296.2","","296.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C11 H14 N O3 -","- C11 H14 N O3 -","- C44 H56 N4 O12 -","4","1","","Akikazu Matsumoto; Toru Odani; Masaaki Chikada; Kazuki Sada; Mikiji Miyata","Crystal-Lattice Controlled Photopolymerization of Di(benzylammonium) (Z,Z)-Muconates","Journal of the American Chemical Society","1999","121","","11122","11129","10.1021/ja992558g","","","0.7107","MoKα","","0.0469","0.0469","","","0.1543","0.1543","","","","","","1.131","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116621","9.366","0.003","10.858","0.004","5.599","0.003","98.043","0.007","98.117","0.006","97.42","0.02","551.7","0.4","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C11 H14 N O3 -","- C11 H14 N O3 -","- C22 H28 N2 O6 -","2","1","","Akikazu Matsumoto; Toru Odani; Masaaki Chikada; Kazuki Sada; Mikiji Miyata","Crystal-Lattice Controlled Photopolymerization of Di(benzylammonium) (Z,Z)-Muconates","Journal of the American Chemical Society","1999","121","","11122","11129","10.1021/ja992558g","","","0.7107","MoKα","","0.1647","0.1647","","","0.4025","0.4025","","","","","","1.722","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116622","21.598","0.006","6.139","0.002","21.58","0.02","90","","112.02","0.05","90","","2653","3","197.2","","197.2","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C24 H28 N2 O6 -","- C24 H28 N2 O6 -","- C96 H112 N8 O24 -","4","1","","Akikazu Matsumoto; Toru Odani; Masaaki Chikada; Kazuki Sada; Mikiji Miyata","Crystal-Lattice Controlled Photopolymerization of Di(benzylammonium) (Z,Z)-Muconates","Journal of the American Chemical Society","1999","121","","11122","11129","10.1021/ja992558g","","","0.7107","MoKα","","0.1166","0.1166","","","0.2975","0.2975","","","","","","1.248","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116623","19.173","0.003","19.173","0.003","17.416","0.004","90","","90","","120","","5544.5","1.8","293","2","293","2","","","","","","","","6","R 3 2 :H","R 3 2""","155","","","","- C72 H61 Cd3 Cl2 N9 O15 -","- C72 H61 Cd3 Cl1.98 N9 O14.92 -","- C216 H183 Cd9 Cl5.94 N27 O44.76 -","3","0.166667","","Wenbin Lin; Zhiyong Wang; Ling Ma","A Novel Octupolar Metal-Organic NLO Material Based on a Chiral 2D Coordination Network","Journal of the American Chemical Society","1999","121","","11249","11250","10.1021/ja9928327","","","0.71073","MoKα","","0.0493","0.0266","","","0.0596","0.0651","","","","","","0.976","","","","has coordinates,has disorder","178937","2020-10-21","18:00:00",""
"4116624","11.516","0.002","11.715","0.004","17.833","0.005","75.18","0.03","79.67","0.02","87.3","0.02","2288.1","1.1","198","2","198","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H55 Cl4 N7 O4 S -","- C44 H51 N7 O4 S -","- C88 H102 N14 O8 S2 -","2","1","","Jonathan L. Sessler; Daniel Seidel; Vincent Lynch","Synthesis of [28]Heptaphyrin(1.0.0.1.0.0.0) and [32]Octaphyrin(1.0.0.0.1.0.0.0) via a Directed Oxidative Ring Closure: The First Expanded Porphyrins Containing a Quaterpyrrole Subunit","Journal of the American Chemical Society","1999","121","","11257","11258","10.1021/ja992934x","","","0.71073","MoKα","","0.1555","0.0821","","0.2101","0.196","","","","1.028","1.555","1.555","","","","","has coordinates","178937","2020-10-21","18:00:00",""
"4116625","10.712","0.0003","13.327","0.0003","18.162","0.0006","92.146","0.002","103.245","0.0015","104.125","0.002","2435.51","0.12","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H52 Cl2 N8 O2 -","- C52 H66 Cl2 N8 O2 -","- C104 H132 Cl4 N16 O4 -","2","1","","Jonathan L. Sessler; Daniel Seidel; Vincent Lynch","Synthesis of [28]Heptaphyrin(1.0.0.1.0.0.0) and [32]Octaphyrin(1.0.0.0.1.0.0.0) via a Directed Oxidative Ring Closure: The First Expanded Porphyrins Containing a Quaterpyrrole Subunit","Journal of the American Chemical Society","1999","121","","11257","11258","10.1021/ja992934x","","","0.71073","MoKα","","0.1571","0.1013","","0.2416","0.2263","","","","1.601","1.934","1.934","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4116626","7.902","0.002","8.256","0.003","8.859","0.003","78.4","0.02","76.73","0.02","87.96","0.03","551","0.3","298","2","298","2","","","","","","","","5","P 1","P 1","1","","","","- C24 H23 N O5 S -","- C24 H23 N O5 S -","- C24 H23 N O5 S -","1","1","","Miguel A. Miranda; Agustin Lahoz; Ramón Martínez-Máñez; Francisco Boscá; José V. Castell; Julia Pérez-Prieto","Enantioselective Discrimination in the Intramolecular Quenching of an Excited Aromatic Ketone by a Ground-State Phenol","Journal of the American Chemical Society","1999","121","","11569","11570","10.1021/ja990823s","","","0.71073","MoKα","","0.0624","0.0327","","0.1365","0.091","","","","0.89","0.878","0.878","","","","","has coordinates","178937","2020-10-21","18:00:00",""
"4116627","8.056","0.005","8.326","0.005","8.751","0.006","77.78","0.05","78.13","0.05","89.88","0.05","560.9","0.6","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C24 H23 N O5 S -","- C24 H23 N O5 S -","- C24 H23 N O5 S -","1","1","","Miguel A. Miranda; Agustin Lahoz; Ramón Martínez-Máñez; Francisco Boscá; José V. Castell; Julia Pérez-Prieto","Enantioselective Discrimination in the Intramolecular Quenching of an Excited Aromatic Ketone by a Ground-State Phenol","Journal of the American Chemical Society","1999","121","","11569","11570","10.1021/ja990823s","","","0.71073","MoKα","","0.0532","0.049","","0.1319","0.1271","","","","1.117","1.124","1.124","","","","","has coordinates","178937","2020-10-21","18:00:00",""
"4116628","7.889","0.005","8.294","0.005","8.727","0.005","79.7","0.05","74.71","0.04","87.15","0.05","541.9","0.6","298","2","298","2","","","","","","","","5","P 1","P 1","1","","","","- C23 H21 N O5 S -","- C24 H23 N O5 S -","- C24 H23 N O5 S -","1","1","","Miguel A. Miranda; Agustin Lahoz; Ramón Martínez-Máñez; Francisco Boscá; José V. Castell; Julia Pérez-Prieto","Enantioselective Discrimination in the Intramolecular Quenching of an Excited Aromatic Ketone by a Ground-State Phenol","Journal of the American Chemical Society","1999","121","","11569","11570","10.1021/ja990823s","","","0.71073","MoKα","","0.0319","0.0297","","0.0874","0.0835","","","","0.815","0.8","0.8","","","","","has coordinates","178937","2020-10-21","18:00:00",""
"4116629","6.41","0.004","11.37","0.004","9.627","0.005","90","","108","0.04","90","","667.3","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans-bis(4-nitrophenyl)tetrafluorosulfurane","","- C12 H8 F4 N2 O4 S -","- C12 H8 F4 N2 O4 S -","- C24 H16 F8 N4 O8 S2 -","2","0.5","","Peer Kirsch; Matthias Bremer; Annette Kirsch; Jens Osterodt","Bis(4-nitrophenyl)tetrafluorosulfuranes: Synthesis, Isomerization and Structural Characterization","Journal of the American Chemical Society","1999","121","","11277","11280","10.1021/ja9915495","","","0.71073","MoKα","","0.0807","0.0431","","","0.0941","0.1015","","","","","","0.789","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116630","17.481","0.006","9.892","0.003","14.524","0.005","90","","123.879","0.007","90","","2085.1","1.2","160","2","160","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Pt(dmpp)~2~","","","- C14 H36 P4 Pt -","- C14 H36 P4 Pt -","- C56 H144 P16 Pt4 -","4","0.5","","Douglas E. Berning; Bruce C. Noll; Daniel L. DuBois","Relative Hydride, Proton, and Hydrogen Atom Transfer Abilities of [HM(diphosphine)2]PF6 Complexes (M = Pt, Ni)","Journal of the American Chemical Society","1999","121","","11432","11447","10.1021/ja991888y","","","0.71073","MoKα","","0.0223","0.0218","","","0.0508","0.051","","","","","","1.113","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116631","17.7374","0.0002","9.064","","17.9013","0.0002","90","","96.187","0.001","90","","2861.26","0.05","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[(dmpe)~2~Ni^II^][PF~6~]~2~^.^CH~3~NO~2~","","","- C13 H35 F12 N Ni O2 P6 -","- C13 H35 F12.06 N Ni O2 P6 -","- C52 H140 F48.24 N4 Ni4 O8 P24 -","4","1","","Douglas E. Berning; Bruce C. Noll; Daniel L. DuBois","Relative Hydride, Proton, and Hydrogen Atom Transfer Abilities of [HM(diphosphine)2]PF6 Complexes (M = Pt, Ni)","Journal of the American Chemical Society","1999","121","","11432","11447","10.1021/ja991888y","","","0.71073","MoKα","","0.0434","0.0315","","","0.0744","0.0805","","","","","","1.047","","","","has coordinates,has disorder","178937","2020-10-21","18:00:00",""
"4116632","17.7301","0.0002","10.9129","0.0001","15.7799","0.0001","90","","90","","90","","3053.2","0.05","162","2","162","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C20 H50 B2 F8 Ni O P4 -","- C20 H50 B2 F8 Ni O P4 -","- C80 H200 B8 F32 Ni4 O4 P16 -","4","0.5","","Douglas E. Berning; Bruce C. Noll; Daniel L. DuBois","Relative Hydride, Proton, and Hydrogen Atom Transfer Abilities of [HM(diphosphine)2]PF6 Complexes (M = Pt, Ni)","Journal of the American Chemical Society","1999","121","","11432","11447","10.1021/ja991888y","","","0.71073","MoKα","","0.0438","0.0316","","","0.0671","0.0731","","","","","","0.914","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116633","9.8371","0.0013","16.764","0.003","14.8801","0.0018","90","","101.136","0.007","90","","2407.7","0.6","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H36 B2 F8 Ni P4 -","- C14 H36 B2 F8 Ni P4 -","- C56 H144 B8 F32 Ni4 P16 -","4","1","","Douglas E. Berning; Bruce C. Noll; Daniel L. DuBois","Relative Hydride, Proton, and Hydrogen Atom Transfer Abilities of [HM(diphosphine)2]PF6 Complexes (M = Pt, Ni)","Journal of the American Chemical Society","1999","121","","11432","11447","10.1021/ja991888y","","","0.71073","MoKα","","0.0354","0.0286","","","0.0672","0.0716","","","","","","1.034","","","","has coordinates,has disorder","301833","2025-08-20","15:23:00",""
"4116634","17.5851","0.0017","9.313","0.001","18.412","0.003","90","","94.269","0.006","90","","3007","0.7","141","2","141","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C15.61 H39.73 F12 N0.27 O0.53 P6 Pt -","- C15.6 H39.735 F12 N0.2665 O0.534 P6 Pt -","- C62.4 H158.94 F48 N1.066 O2.136 P24 Pt4 -","4","1","","Douglas E. Berning; Bruce C. Noll; Daniel L. DuBois","Relative Hydride, Proton, and Hydrogen Atom Transfer Abilities of [HM(diphosphine)2]PF6 Complexes (M = Pt, Ni)","Journal of the American Chemical Society","1999","121","","11432","11447","10.1021/ja991888y","","","0.71073","MoKα","","0.0412","0.0332","","","0.0771","0.0805","","","","","","1.047","","","","has coordinates,has disorder","178937","2020-10-21","18:00:00",""
"4116635","19.9406","0.0004","9.0706","0.0002","16.7066","0.0003","90","","97.49","","90","","2995.99","0.1","170","2","170","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[Ni(dmpe)~2~(CH~3~CN)](BF~4~)~2~","","","- C16 H38 F12 N2 Ni P6 -","- C16 H38 F12 N2 Ni P6 -","- C64 H152 F48 N8 Ni4 P24 -","4","1","","Douglas E. Berning; Bruce C. Noll; Daniel L. DuBois","Relative Hydride, Proton, and Hydrogen Atom Transfer Abilities of [HM(diphosphine)2]PF6 Complexes (M = Pt, Ni)","Journal of the American Chemical Society","1999","121","","11432","11447","10.1021/ja991888y","","","0.71073","MoKα","","0.1062","0.056","","","0.1074","0.1349","","","","","","1.144","","","","has coordinates,has disorder","301833","2025-08-20","15:23:00",""
"4116636","10.7503","0.0012","14.2268","0.0019","17.8531","0.0015","93.236","0.006","92.155","0.006","92.39","0.005","2721.6","0.5","169","2","169","2","","","","","","","","7","P -1","-P 1","2","[Ni(dmpp)~2~(CH~3~CN)](BF~4~)~2~","","","- C16 H39 B2 F8 N Ni P4 -","- C16 H38.747 B2 F8 N Ni P4 -","- C64 H154.988 B8 F32 N4 Ni4 P16 -","4","2","","Douglas E. Berning; Bruce C. Noll; Daniel L. DuBois","Relative Hydride, Proton, and Hydrogen Atom Transfer Abilities of [HM(diphosphine)2]PF6 Complexes (M = Pt, Ni)","Journal of the American Chemical Society","1999","121","","11432","11447","10.1021/ja991888y","","","0.71073","MoKα","","0.0899","0.0528","","","0.1142","0.1336","","","","","","1.021","","","","has coordinates,has disorder","178937","2020-10-21","18:00:00",""
"4116637","17.5777","0.0017","9.5357","0.0011","14.7122","0.0016","90","","123.458","0.005","90","","2057.4","0.4","152","2","152","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Ni(dmpp)~2~","","","- C14 H36 Ni P4 -","- C14 H36 Ni P4 -","- C56 H144 Ni4 P16 -","4","0.5","","Douglas E. Berning; Bruce C. Noll; Daniel L. DuBois","Relative Hydride, Proton, and Hydrogen Atom Transfer Abilities of [HM(diphosphine)2]PF6 Complexes (M = Pt, Ni)","Journal of the American Chemical Society","1999","121","","11432","11447","10.1021/ja991888y","","","0.71073","MoKα","","0.0638","0.0442","","","0.0793","0.0874","","","","","","1.463","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116638","12.442","0.0006","18.635","0.0007","28.37","0.001","90","0","90","0","90","0","6577.8","0.5","120","","","","","","","","","","Local laboratory","4","P 21 21 21","P 2ac 2ab","19","","","","- C45 H108 Ge3 Si7 -","- C45 H108 Ge3 Si7 -","- C180 H432 Ge12 Si28 -","4","1","","Akira Sekiguchi; Norihisa Fukaya; Masaaki Ichinohe; Nozomi Takagi; Shigeru Nagase","Synthesis of Unsymmetrically Substituted Cyclotrigermenes and the First Example of Cis Configuration around the GeGe Double Bond","Journal of the American Chemical Society","1999","121","","11587","11588","10.1021/ja9923080","","","0.71073","xray","","","0.064","","","0.142","","","","","4.933","4.933","","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116639","26.387","0.002","17.4364","0.001","13.8016","0.0012","90","","101.65","0.0015","90","","6219.2","0.8","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","o-NHAcSR","","","- C70 H66 Fe N9 O6 S -","- C70 H66 Fe N9 O6 S -","- C280 H264 Fe4 N36 O24 S4 -","4","1","","Noriyuki Suzuki; Tsunehiko Higuchi; Yasuteru Urano; Kazuya Kikuchi; Hidehiro Uekusa; Yuji Ohashi; Takeshi Uchida; Teizo Kitagawa; Tetsuo Nagano","Novel Iron Porphyrin-Alkanethiolate Complex with Intramolecular NH...S Hydrogen Bond: Synthesis, Spectroscopy, and Reactivity","Journal of the American Chemical Society","1999","121","","11571","11572","10.1021/ja992511v","","","1.54184","CuKα","","0.2092","0.0541","","","0.1131","0.1364","","","","","","0.698","","","","has coordinates,has disorder","178937","2020-10-21","18:00:00",""
"4116640","18.831","0.002","18.831","0.002","13.075","0.002","90","0.01","90","0.01","90","0.01","4636.5","1","153","5","153","5","","","","","","","","6","P 4","P 4","75","","","","- C37 H52.5 Nd O6.5 Se4.5 Yb -","- C37 H50 Nd O6.5 Se4.5 Yb -","- C148 H200 Nd4 O26 Se18 Yb4 -","4","1","","Deborah Freedman; Safak Sayan; Thomas J. Emge; Mark Croft; John G. Brennan","Heterovalent Clusters: Ln4Se(SePh)8 (Ln4= Sm4, Yb4, Sm2Yb2, Nd2Yb2)","Journal of the American Chemical Society","1999","121","","11713","11719","10.1021/ja991437d","","","0.71073","MoKα","","0.1763","0.0811","","","0.2079","0.2332","","","","","","1.265","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116641","18.544","0.003","18.544","0.003","24.015","0.004","90","0.02","90","0.02","90","0.02","8258","2","153","5","153","5","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C17 H22.5 O2.5 Se2.25 Sm -","- C17 H20 O2.5 Se2.25 Sm -","- C272 H320 O40 Se36 Sm16 -","16","1","","Deborah Freedman; Safak Sayan; Thomas J. Emge; Mark Croft; John G. Brennan","Heterovalent Clusters: Ln4Se(SePh)8 (Ln4= Sm4, Yb4, Sm2Yb2, Nd2Yb2)","Journal of the American Chemical Society","1999","121","","11713","11719","10.1021/ja991437d","","","0.71073","MoKα","","0.1796","0.0637","","","0.1131","0.1292","","","","","","0.957","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116642","18.289","0.003","18.289","0.003","24.299","0.014","90","0.02","90","0.02","90","0.02","8128","5","153","5","153","5","","","","","","","","5","P 4/n c c :2","-P 4a 2ac","130","","","","- C17 H22.5 O2.5 Se2.25 Yb -","- C17 H20 O2.5 Se2.25 Yb -","- C272 H320 O40 Se36 Yb16 -","16","1","","Deborah Freedman; Safak Sayan; Thomas J. Emge; Mark Croft; John G. Brennan","Heterovalent Clusters: Ln4Se(SePh)8 (Ln4= Sm4, Yb4, Sm2Yb2, Nd2Yb2)","Journal of the American Chemical Society","1999","121","","11713","11719","10.1021/ja991437d","","","0.71073","MoKα","","0.1358","0.0569","","","0.1195","0.1341","","","","","","0.991","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116643","18.493","0.003","18.493","0.003","24.172","0.006","90","0.02","90","0.02","90","0.02","8267","3","153","5","153","5","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","","","","- C17 H22.5 O2.5 Se2.25 Sm0.61 Yb0.39 -","- C17 H22.5 O2.5 Se2.25 Sm0.6 Yb0.4 -","- C272 H360 O40 Se36 Sm9.6 Yb6.4 -","16","1","","Deborah Freedman; Safak Sayan; Thomas J. Emge; Mark Croft; John G. Brennan","Heterovalent Clusters: Ln4Se(SePh)8 (Ln4= Sm4, Yb4, Sm2Yb2, Nd2Yb2)","Journal of the American Chemical Society","1999","121","","11713","11719","10.1021/ja991437d","","","0.71073","MoKα","","0.0744","0.0363","","","0.0733","0.0836","","","","","","1.061","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116644","18.465","0.003","18.465","0.003","24.1","0.006","90","0.02","90","0.02","90","0.02","8217","3","153","5","153","5","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","","","","- C17 H22.5 Nd0.5 O2.5 Se2.25 Yb0.5 -","- C17 H20 Nd0.548 O2.5 Se2.25 Yb0.452 -","- C272 H320 Nd8.768 O40 Se36 Yb7.232 -","16","1","","Deborah Freedman; Safak Sayan; Thomas J. Emge; Mark Croft; John G. Brennan","Heterovalent Clusters: Ln4Se(SePh)8 (Ln4= Sm4, Yb4, Sm2Yb2, Nd2Yb2)","Journal of the American Chemical Society","1999","121","","11713","11719","10.1021/ja991437d","","","0.71073","MoKα","","0.1618","0.0445","","","0.0554","0.0636","","","","","","0.989","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4116645","33.092","0.001","10.215","0.0002","28.944","0.002","90","","103.282","0.003","90","","9522.4","0.8","213","2","213","2","","","","","","","synthesized","6","C 1 2/c 1","-C 2yc","15","","Bis(trans-dichloro-bis(4-tert-butylpyridine))-di-molybdenum (II), D2-isomer, acetone solvate","","- C39 H58 Cl4 Mo2 N4 O -","- C39 H56.5 Cl4 Mo2 N4 O -","- C312 H452 Cl32 Mo16 N32 O8 -","8","1","","F. Albert Cotton; Evgeny V. Dikarev; Jiande Gu; Santiago Herrero; Barbara Modec","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 5. Experimental and Theoretical Study of the Rotation Conformational Preferences of Mo2Cl4(R-py)4 (R-py = Substituted Pyridine) Molecules","Journal of the American Chemical Society","1999","121","","11758","11761","10.1021/ja992445x","","","0.71073","MoKα","","0.0446","0.0401","","0.1103","0.1028","","","","1.102","1.092","1.092","","","","","has coordinates,has disorder","178937","2020-10-21","18:00:00",""
"4116646","11.6996","0.001","12.3935","0.0011","15.8708","0.0013","90","","113.34","0.007","90","","2112.9","0.3","150","","150","","","","","","","","see text","8","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 B Br F4 N2 O Pt -","- C19 H26 B Br F4 N2 O Pt -","- C76 H104 B4 Br4 F16 N8 O4 Pt4 -","4","1","","Albrecht, Martin; Gossage, Robert A.; Spek, Anthony L.; van Koten, Gerard","Metal-Mediated C-C Bond Making and Breaking: First Direct Evidence for a Reversible Migration of a Benzyl Group along a Metal-Carbon Bond","Journal of the American Chemical Society","1999","121","50","11898","11899","10.1021/ja992494+","","","0.71073","MoKα","","0.0359","0.0273","","","0.0622","0.0649","","","","","","1.062","","","","has coordinates","270162","2021-10-29","12:03:03",""
"4116647","13.336","0.011","14.275","0.009","14.095","0.008","90","","106.81","0.05","90","","2569","3","188","2","188","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H34 N4 O2 Ti -","- C28 H34 N4 O2 Ti -","- C112 H136 N16 O8 Ti4 -","4","1","","Dietrich P. Steinhuebel; Stephen J. Lippard","Synthesis of Unsymmetrical Diolate, Oxametallacyclopentene, Amido-Alkoxide and Thiolato-Alkoxide Complexes Using Dialkyl and Diaryl Titanium Aminotroponiminate Complexes: A Route to Unsymmetrical Vicinal Diols","Journal of the American Chemical Society","1999","121","","11762","11772","10.1021/ja992662y","","","0.71073","MoKα","","0.142","0.0745","","","0.1096","0.1305","","","","","","1.038","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116648","16.222","0.002","15.4521","0.0016","11.8922","0.0017","90","","91.811","0.013","90","","2979.5","0.6","188","2","188","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H38 N4 O2 Ti -","- C34 H38 N4 O2 Ti -","- C136 H152 N16 O8 Ti4 -","4","1","","Dietrich P. Steinhuebel; Stephen J. Lippard","Synthesis of Unsymmetrical Diolate, Oxametallacyclopentene, Amido-Alkoxide and Thiolato-Alkoxide Complexes Using Dialkyl and Diaryl Titanium Aminotroponiminate Complexes: A Route to Unsymmetrical Vicinal Diols","Journal of the American Chemical Society","1999","121","","11762","11772","10.1021/ja992662y","","","0.71073","MoKα","","0.0446","0.0349","","","0.0928","0.0976","","","","","","1.049","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116649","10.384","0.003","13.028","0.004","13.305","0.005","118.1","0.02","92.91","0.04","110.73","0.02","1432.5","1","188","2","188","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H34 N4 O2 Ti -","- C32 H34 N4 O2 Ti -","- C64 H68 N8 O4 Ti2 -","2","1","","Dietrich P. Steinhuebel; Stephen J. Lippard","Synthesis of Unsymmetrical Diolate, Oxametallacyclopentene, Amido-Alkoxide and Thiolato-Alkoxide Complexes Using Dialkyl and Diaryl Titanium Aminotroponiminate Complexes: A Route to Unsymmetrical Vicinal Diols","Journal of the American Chemical Society","1999","121","","11762","11772","10.1021/ja992662y","","","0.71073","MoKα","","0.1618","0.0868","","","0.168","0.2031","","","","","","1.016","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116650","13.233","0.004","13.823","0.004","13.863","0.003","60.514","0.015","88.656","0.016","87.332","0.017","2205","1.1","188","2","188","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H51 N5 O3 S Ti -","- C51 H51 N5 O3 S Ti -","- C102 H102 N10 O6 S2 Ti2 -","2","1","","Dietrich P. Steinhuebel; Stephen J. Lippard","Synthesis of Unsymmetrical Diolate, Oxametallacyclopentene, Amido-Alkoxide and Thiolato-Alkoxide Complexes Using Dialkyl and Diaryl Titanium Aminotroponiminate Complexes: A Route to Unsymmetrical Vicinal Diols","Journal of the American Chemical Society","1999","121","","11762","11772","10.1021/ja992662y","","","0.71073","MoKα","","0.1215","0.0595","","","0.1577","0.184","","","","","","0.963","","","","has coordinates","301833","2025-08-20","15:23:00",""
"4116651","10.9698","0.0007","13.1873","0.0009","14.63","0.0009","115.08","0.001","94.619","0.001","109.801","0.002","1740","0.2","188","2","188","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H44 N4 O S Ti -","- C40 H44 N4 O S Ti -","- C80 H88 N8 O2 S2 Ti2 -","2","1","","Dietrich P. Steinhuebel; Stephen J. Lippard","Synthesis of Unsymmetrical Diolate, Oxametallacyclopentene, Amido-Alkoxide and Thiolato-Alkoxide Complexes Using Dialkyl and Diaryl Titanium Aminotroponiminate Complexes: A Route to Unsymmetrical Vicinal Diols","Journal of the American Chemical Society","1999","121","","11762","11772","10.1021/ja992662y","","","0.71073","MoKα","","0.0999","0.0526","","","0.1331","0.1503","","","","","","1.006","","","","has coordinates","178937","2020-10-21","18:00:00",""
"4116652","12.5029","0.0002","13.0424","0.0004","18.9793","0.0005","81.7009","0.001","88.3043","0.0015","84.2634","0.0015","3046.8","0.13","298","2","298","2","","","","","","","chemical synthesis","6","P -1","-P 1","2","Fe(oximate)TDCPP.chlorobenzene.0.5heptane","(fluorenoneoximato)iron(III)[5,10,15,20-tetrakis(2,6-dichlorophenyl)porphyrin]. chlorobenzene.0.5heptane","","- C66.5 H41 Cl9 Fe N5 O -","- C57 H28 Cl8 Fe N5 O -","- C114 H56 Cl16 Fe2 N10 O2 -","2","1","","Wang, Charles C.-Y.; M. Ho, Douglas; Groves, John T.","Models of Nitric Oxide Synthase: Iron(III) Porphyrin-Catalyzed Oxidation of Fluorenone Oxime to Nitric Oxide and Fluorenone","Journal of the American Chemical Society","1999","121","51","12094","12103","10.1021/ja992373+","","","0.71073","MoKα","","0.1155","0.0571","","0.1681","0.149","","","","1.068","1.325","1.325","","","","","has coordinates","270161","2021-10-29","11:58:41",""
"4116653","9.8776","0.0006","11.9206","0.0006","17.4262","0.0012","90","","101.55","0.003","90","","2010.3","0.2","298","2","298","2","","","","","","","chemical synthesis","4","P 1 21/n 1","-P 2yn","14","","O-(9-nitro-9-fluorenyl)fluorenone oxime","","- C26 H16 N2 O3 -","- C26 H16 N2 O3 -","- C104 H64 N8 O12 -","4","1","","Wang, Charles C.-Y.; M. Ho, Douglas; Groves, John T.","Models of Nitric Oxide Synthase: Iron(III) Porphyrin-Catalyzed Oxidation of Fluorenone Oxime to Nitric Oxide and Fluorenone","Journal of the American Chemical Society","1999","121","51","12094","12103","10.1021/ja992373+","","","0.71073","MoKα","","0.0772","0.0569","","0.1529","0.1407","","","","1.092","1.203","1.203","","","","","has coordinates,has disorder","270161","2021-10-29","11:58:43",""
"4116654","15.53","0.02","18.45","0.01","24.71","0.01","107.73","0.04","101.23","0.05","101.55","0.06","6354","10","193","","193","","","","","","","","?","8","P -1","-P 1","2","","","","- C94 H182 Cl2 Li6 O20 S4 Si4 Ti4 -","- C94 H182 Cl2 Li6 O20 S4 Si4 Ti4 -","- C188 H364 Cl4 Li12 O40 S8 Si8 Ti8 -","2","1","","Jürgen F. K. Müller; Markus Neuburger; Hans-Peter Weber","Structure Determination of a Lithiated Titanium-Sulfone","Journal of the American Chemical Society","1999","121","","12212","12213","10.1021/ja993048p","","","1.5418","CuKα","","","0.1082","","","0.1259","","","","","1.0586","1.0586","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321716","12.203","0.002","19.187","0.002","14.181","0.002","90","","91.13","0.01","90","","3319.7","0.8","301.2","","298","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H47 Cl Co O9 P3 Ru -","- C25 H47 Cl Co O9 P3 Ru -","- C100 H188 Cl4 Co4 O36 P12 Ru4 -","4","1","","Wa-Hung Leung; Eddie Y. Y. Chan; Wing-Tak Wong","Synthesis and Electrochemistry of Ruthenium Complexes with an Oxygen Tripod Ligand","Inorganic Chemistry","1999","38","","136","143","10.1021/ic980196s","","","0.7107","MoKalpha","","","0.043","","","0.0589","","","","","3.947","3.947","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321717","12.95","0.001","18.688","0.002","17.141","0.002","90","","100.2","0.02","90","","4082.7","0.8","298","","298.2","","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C29 H58 B Co F4 N O9 P3 Ru -","- C29 H58 B Co F4 N O9 P3 Ru -","- C116 H232 B4 Co4 F16 N4 O36 P12 Ru4 -","4","1","","Wa-Hung Leung; Eddie Y. Y. Chan; Wing-Tak Wong","Synthesis and Electrochemistry of Ruthenium Complexes with an Oxygen Tripod Ligand","Inorganic Chemistry","1999","38","","136","143","10.1021/ic980196s","","","0.7107","MoKalpha","","","0.0404","","","0.0479","","","","","1.799","1.799","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321718","13.09","0.002","18.112","0.003","17.502","0.001","90","","96.904","0.009","90","","4119.4","1","298.2","","298","","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C32 H56 B Co F4 N O9 P3 Ru -","- C32 H56 B Co F4 N O9 P3 Ru -","- C128 H224 B4 Co4 F16 N4 O36 P12 Ru4 -","4","1","","Wa-Hung Leung; Eddie Y. Y. Chan; Wing-Tak Wong","Synthesis and Electrochemistry of Ruthenium Complexes with an Oxygen Tripod Ligand","Inorganic Chemistry","1999","38","","136","143","10.1021/ic980196s","","","0.7107","MoKalpha","","","0.0398","","","0.0461","","","","","1.852","1.852","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321719","13.686","0.002","14.733","0.004","12.445","0.002","109.05","0.02","90.02","0.01","89.39","0.02","2371.8","0.9","301.2","","298","","","","","","","","","8","P -1","-P 1","2","","","","- C36 H54 B Co F4 O12 P4 Ru -","- C36 H52 B Co F4 O12 P4 Ru -","- C72 H104 B2 Co2 F8 O24 P8 Ru2 -","2","1","","Wa-Hung Leung; Eddie Y. Y. Chan; Wing-Tak Wong","Synthesis and Electrochemistry of Ruthenium Complexes with an Oxygen Tripod Ligand","Inorganic Chemistry","1999","38","","136","143","10.1021/ic980196s","","","0.7107","MoKalpha","","","0.048","","","0.0551","","","","","2.273","2.273","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321720","20.003","0.003","14.155","0.002","10.061","0.002","110.7","0.01","90.73","0.01","104.23","0.01","2567.4","0.8","293.2","","293.2","","","","","","","","","8","P -1","-P 1","2","","","","- C44.5 H47 Cl N4 O2 P2 Ru2 S8 -","- C44.25 H2 Cl0.5 N4 O2 P2 Ru2 S8 -","- C88.5 H4 Cl N8 O4 P4 Ru4 S16 -","2","1","","Takashi Furuhashi; Masaki Kawano; Yoshihiro Koide; Ryosuke Somazawa; Kazuko Matsumoto","Structural Studies of the Hydrazine and Ammine Complexes of the Dinuclear Ruthenium Polysulfide Complexes","Inorganic Chemistry","1999","38","","109","114","10.1021/ic9804115","","","0.7107","MoKα","","0.1103","0.0547","","0.097","0.0753","","","","1.486","1.138","1.138","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321721","30.481","0.007","12.455","0.002","15.463","0.003","90","","113.9","0.02","90","","5367","2","293.2","","293.2","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C44.5 H49 Cl N4 O2 P2 Ru2 S10 -","- C44 N4 O2 P2 Ru2 S10 -","- C176 N16 O8 P8 Ru8 S40 -","4","0.5","","Takashi Furuhashi; Masaki Kawano; Yoshihiro Koide; Ryosuke Somazawa; Kazuko Matsumoto","Structural Studies of the Hydrazine and Ammine Complexes of the Dinuclear Ruthenium Polysulfide Complexes","Inorganic Chemistry","1999","38","","109","114","10.1021/ic9804115","","","0.7107","MoKα","","0.2334","0.0724","","0.1756","0.097","","","","2.149","1.132","1.132","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321722","26.278","0.005","8.835","0.002","20.655","0.004","90","","120.73","0.03","90","","4122","1.9","293","2","293","2","","","","","","","synthesized","6","C 1 2/c 1","-C 2yc","15","","Bis([bis(3,5-dimethylpyrazol-1-yl) (dimethylamino)methane]copper(II)perchlorate Bis(dichloromethane)","","- C28 H46 Cl6 Cu N10 O8 -","- C28 H46 Cl6 Cu N10 O8 -","- C112 H184 Cl24 Cu4 N40 O32 -","4","0.5","","Robert T. Stibrany; Spencer Knapp; Joseph A. Potenza; Harvey J. Schugar","Product of a DMF Aminalization, Bis[bis(3,5-dimethylpyrazol-1-yl)(dimethylamino)methane]copper(II) Perchlorate-Bis(dichloromethane)","Inorganic Chemistry","1999","38","","132","135","10.1021/ic980903h","","","0.71073","MoKα","","0.0716","0.0492","","0.1371","0.1221","","","","1.038","1.062","1.062","","","","","has coordinates,has disorder","179320","2020-10-21","18:00:00",""
"4321723","11.4222","0.0005","16.7303","0.0008","27.772","0.001","90","","97.325","0.001","90","","5263.8","0.4","203","","193","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C46 H35 B Cl2 F24 O4 P Re -","- C46 H33 B Cl2 F24 O4 P Re -","- C184 H132 B4 Cl8 F96 O16 P4 Re4 -","4","1","","Jean Huhmann-Vincent; Brian L. Scott; Gregory J. Kubas","Rhenium Complexes with Weakly Coordinating Solvent Ligands, cis-[Re(PR3)(CO)4(L)][BArF], L = CH2Cl2, Et2O, NC5F5: Decomposition to Chloride-Bridged Dimers in CH2Cl2 Solution","Inorganic Chemistry","1999","38","","115","124","10.1021/ic980912q","","","0.71073","MoKα","","0.0619","0.0441","","0.1174","0.1105","","","","1.268","1.35","1.35","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321724","14.1056","0.0008","14.286","0.0008","14.7448","0.0007","94.555","0.001","109.249","0.001","100.458","0.001","2727.3","0.3","193","","193","","","","","","","","","8","P -1","-P 1","2","","","","- C50 H33 B F29 N O4 P Re -","- C50 H33 B F29 N O4 P Re -","- C100 H66 B2 F58 N2 O8 P2 Re2 -","2","1","","Jean Huhmann-Vincent; Brian L. Scott; Gregory J. Kubas","Rhenium Complexes with Weakly Coordinating Solvent Ligands, cis-[Re(PR3)(CO)4(L)][BArF], L = CH2Cl2, Et2O, NC5F5: Decomposition to Chloride-Bridged Dimers in CH2Cl2 Solution","Inorganic Chemistry","1999","38","","115","124","10.1021/ic980912q","","","0.71073","MoKα","","0.0596","0.0476","","0.1276","0.1199","","","","1.114","1.132","1.132","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321725","25.803","0.002","8.672","0.001","15.578","0.002","90","","92.254","0.007","90","","3483.1","0.7","193","","193","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C13 H21 Cl O4 P Re -","- C13 H21 Cl O4 P Re -","- C104 H168 Cl8 O32 P8 Re8 -","8","1","","Jean Huhmann-Vincent; Brian L. Scott; Gregory J. Kubas","Rhenium Complexes with Weakly Coordinating Solvent Ligands, cis-[Re(PR3)(CO)4(L)][BArF], L = CH2Cl2, Et2O, NC5F5: Decomposition to Chloride-Bridged Dimers in CH2Cl2 Solution","Inorganic Chemistry","1999","38","","115","124","10.1021/ic980912q","","","0.71073","MoKα","","0.0523","0.0429","","0.1135","0.1057","","","","0.969","0.977","0.977","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321726","9.115","0.001","11.203","0.001","23.195","0.002","90","","93.589","0.006","90","","2363.9","0.4","193","","193","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H30 Cl O4 P Re -","- C22 H30 Cl O4 P Re -","- C88 H120 Cl4 O16 P4 Re4 -","4","1","","Jean Huhmann-Vincent; Brian L. Scott; Gregory J. Kubas","Rhenium Complexes with Weakly Coordinating Solvent Ligands, cis-[Re(PR3)(CO)4(L)][BArF], L = CH2Cl2, Et2O, NC5F5: Decomposition to Chloride-Bridged Dimers in CH2Cl2 Solution","Inorganic Chemistry","1999","38","","115","124","10.1021/ic980912q","","","0.71073","MoKα","","0.0454","0.0348","","0.0892","0.0829","","","","0.896","0.914","0.914","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321727","13.048","0.002","16.348","0.002","19.496","0.004","92.52","0.01","96.58","0.01","100.24","0.01","4056.7","1.2","193","","193","","","","","","","","","8","P -1","-P 1","2","","","","- C76 H46 B Cl F24 O10 P2 Re2 -","- C76 H42 B Cl F24 O10 P2 Re2 -","- C152 H84 B2 Cl2 F48 O20 P4 Re4 -","2","1","","Jean Huhmann-Vincent; Brian L. Scott; Gregory J. Kubas","Rhenium Complexes with Weakly Coordinating Solvent Ligands, cis-[Re(PR3)(CO)4(L)][BArF], L = CH2Cl2, Et2O, NC5F5: Decomposition to Chloride-Bridged Dimers in CH2Cl2 Solution","Inorganic Chemistry","1999","38","","115","124","10.1021/ic980912q","","","0.71073","MoKα","","0.1189","0.0665","","0.1715","0.1483","","","","1.179","1.298","1.298","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321728","13.4105","0.0002","18.0091","0.0003","18.9398","0.0003","91.776","0.001","108.642","0.001","103.47","0.001","4187.27","0.12","193","","193","","","","","","","","","8","P -1","-P 1","2","","","","- C76 H72 B Cl F24 O8 P2 Re2 -","- C76 H54 B Cl F24 O8 P2 Re2 -","- C152 H108 B2 Cl2 F48 O16 P4 Re4 -","2","1","","Jean Huhmann-Vincent; Brian L. Scott; Gregory J. Kubas","Rhenium Complexes with Weakly Coordinating Solvent Ligands, cis-[Re(PR3)(CO)4(L)][BArF], L = CH2Cl2, Et2O, NC5F5: Decomposition to Chloride-Bridged Dimers in CH2Cl2 Solution","Inorganic Chemistry","1999","38","","115","124","10.1021/ic980912q","","","0.71073","MoKα","","0.0615","0.0525","","0.1539","0.1441","","","","1.732","1.774","1.774","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321729","10.521","0.004","32.325","0.005","17.277","0.003","90","","96.34","0.02","90","","5840","3","23","","23","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C48 H54 Cl5 Ir N2 P2 S8 W2 -","- C192 H216 Cl20 Ir4 N8 P8 S32 W8 -","- C192 H216 Cl20 Ir4 N8 P8 S32 W8 -","","","","Tomotake Ikada; Shigeki Kuwata; Yasushi Mizobe; Masanobu Hidai","Syntheses and Structures of Mixed-Metal Sulfido Clusters Containing Incomplete Cubane-Type M2M'S4 and Cubane-Type M2M'2S4 Cores (M = Mo, W; M' = Rh, Ir)","Inorganic Chemistry","1999","38","","64","69","10.1021/ic981035r","","","0.7107","MoKalpha","","","0.071","","","0.068","","","","","1.9","1.9","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321730","26.312","0.004","10.847","0.004","32.9","0.003","90","","111.274","0.008","90","","8750","4","23","","23","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C26.5 H45 Cl3 Mo2 N2 Rh2 S8 -","- C220 H352 Cl40 Mo16 N16 Rh16 S64 -","- C220 H352 Cl40 Mo16 N16 Rh16 S64 -","","","","Tomotake Ikada; Shigeki Kuwata; Yasushi Mizobe; Masanobu Hidai","Syntheses and Structures of Mixed-Metal Sulfido Clusters Containing Incomplete Cubane-Type M2M'S4 and Cubane-Type M2M'2S4 Cores (M = Mo, W; M' = Rh, Ir)","Inorganic Chemistry","1999","38","","64","69","10.1021/ic981035r","","","0.7107","MoKalpha","","","0.049","","","0.052","","","","","4.35","4.35","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321731","15.62","0.003","15.62","0.003","18.649","0.002","90","","90","","90","","4550.1","1.3","130","2","130","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C49 H38 Cl2 Fe N6 O7 -","- C49 H37.6 Cl2 Fe N6 O7 -","- C196 H150.4 Cl8 Fe4 N24 O28 -","4","0.25","","Mary K. Ellison; Charles E. Schulz; W. Robert Scheidt","Syntheses, Characterization, and Structural Studies of Several (Nitro)(nitrosyl)iron(III) Porphyrinates: [Fe(Porph)(NO2)(NO)]","Inorganic Chemistry","1999","38","","100","108","10.1021/ic981162n","","","0.71073","MoKα","","0.0855","0.0592","","0.1818","0.1539","","","","1.116","1.118","1.118","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321732","18.094","0.003","18.094","0.003","18.939","0.004","90","","90","","90","","6200","2","130","2","130","2","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","","","","- C70 H69 Cl Fe N10 O7 -","- C70 H69 Cl Fe N9.575 O6.135 -","- C280 H276 Cl4 Fe4 N38.3 O24.54 -","4","0.25","","Mary K. Ellison; Charles E. Schulz; W. Robert Scheidt","Syntheses, Characterization, and Structural Studies of Several (Nitro)(nitrosyl)iron(III) Porphyrinates: [Fe(Porph)(NO2)(NO)]","Inorganic Chemistry","1999","38","","100","108","10.1021/ic981162n","","","0.71073","MoKα","","0.1178","0.0888","","","0.2147","0.2371","","","","","","1.069","","","","has coordinates,has disorder","179320","2020-10-21","18:00:00",""
"4321733","18.1172","0.0015","18.1172","0.0015","19.0838","0.0008","90","","90","","90","","6263.9","0.8","130","2","130","2","","","","","","","","6","P 4/n c c :2","-P 4a 2ac","130","","","","- C70 H69 Cl Fe N10 O7 -","- C70 H69 Cl Fe N10 O7 -","- C280 H276 Cl4 Fe4 N40 O28 -","4","0.25","","Mary K. Ellison; Charles E. Schulz; W. Robert Scheidt","Syntheses, Characterization, and Structural Studies of Several (Nitro)(nitrosyl)iron(III) Porphyrinates: [Fe(Porph)(NO2)(NO)]","Inorganic Chemistry","1999","38","","100","108","10.1021/ic981162n","","","0.71073","MoKα","","0.1038","0.0901","","0.1956","0.1896","","","","1.179","1.244","1.244","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321734","16.1559","0.0005","18.692","0.0008","19.7779","0.001","90","","90.971","0.006","90","","5971.8","0.4","130","2","130","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C64 H64 Fe N10 O7 -","- C64 H64 Fe N10 O7 -","- C256 H256 Fe4 N40 O28 -","4","0.5","","Mary K. Ellison; Charles E. Schulz; W. Robert Scheidt","Syntheses, Characterization, and Structural Studies of Several (Nitro)(nitrosyl)iron(III) Porphyrinates: [Fe(Porph)(NO2)(NO)]","Inorganic Chemistry","1999","38","","100","108","10.1021/ic981162n","","","0.71073","MoKα","","0.0582","0.0469","","0.127","0.1174","","","","1.03","1.043","1.043","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321735","12.7764","0.001","27.192","0.002","19.1716","0.0008","90","","105.063","0.005","90","","6431.7","0.8","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C71 H72 Fe N10 O7 -","- C71 H71.4 Fe N10 O7 -","- C284 H285.6 Fe4 N40 O28 -","4","1","","Mary K. Ellison; Charles E. Schulz; W. Robert Scheidt","Syntheses, Characterization, and Structural Studies of Several (Nitro)(nitrosyl)iron(III) Porphyrinates: [Fe(Porph)(NO2)(NO)]","Inorganic Chemistry","1999","38","","100","108","10.1021/ic981162n","","","0.71073","MoKα","","0.0625","0.0477","","0.1154","0.1078","","","","1.067","1.099","1.099","","","","","has coordinates,has disorder","179320","2020-10-21","18:00:00",""
"4321736","10.9234","0.0001","15.8804","0.0002","20.7466","0.0002","90","","90","","90","","3598.87","0.07","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1-methylimidazole-ethylcobaloxime","trans-bis(Dimethylglyoximato)-ethyl-1-methylimidazole-cobalt(iii)","","- C14 H25 Co N6 O4 -","- C14 H25 Co N6 O4 -","- C112 H200 Co8 N48 O32 -","8","1","","Scott J. Moore; Rene J. Lachicotte; Sharon T. Sullivan; Luigi G. Marzilli","Use of 13C-1H NMR Coupling Constants To Assess the Binding of Imidazole Ring Ligands to Metals","Inorganic Chemistry","1999","38","","383","390","10.1021/ic980519k","","","0.71073","MoKα","","0.0601","0.0475","","0.1075","0.1024","","","","1.173","1.198","1.198","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321737","9.1481","0.0001","11.4177","0.0002","16.2156","0.0001","90","","96.78","","90","","1681.88","0.04","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1-methylimidazole-methylcobaloxime","trans-bis(Dimethylglyoximato)-methyl-1-methylimidazole-cobalt(iii)","","- C13 H23 Co N6 O4 -","- C13 H23 Co N6 O4 -","- C52 H92 Co4 N24 O16 -","4","1","","Scott J. Moore; Rene J. Lachicotte; Sharon T. Sullivan; Luigi G. Marzilli","Use of 13C-1H NMR Coupling Constants To Assess the Binding of Imidazole Ring Ligands to Metals","Inorganic Chemistry","1999","38","","383","390","10.1021/ic980519k","","","0.71073","MoKα","","0.0528","0.0414","","0.1094","0.1047","","","","1.026","1.096","1.096","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321738","9.8297","0.0001","11.1519","0.0001","16.1352","0.0002","90","","90","","90","","1768.74","0.03","183","2","183","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","1-methylimidazole-cyanomethylcobaloxime","trans-bis(Dimethylglyoximato)-cyanomethyl-1-methylimidazole-cobalt(iii)","","- C14 H22 Co N7 O4 -","- C14 H22 Co N7 O4 -","- C56 H88 Co4 N28 O16 -","4","1","","Scott J. Moore; Rene J. Lachicotte; Sharon T. Sullivan; Luigi G. Marzilli","Use of 13C-1H NMR Coupling Constants To Assess the Binding of Imidazole Ring Ligands to Metals","Inorganic Chemistry","1999","38","","383","390","10.1021/ic980519k","","","0.71073","MoKα","","0.0304","0.0272","","0.0724","0.071","","","","0.86","0.879","0.879","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321739","8.9783","0.0015","9.0136","0.0015","11.48","0.003","86.059","0.018","84.022","0.017","68.483","0.012","859.1","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","1-methylimidazole-chlorocobaloxime","trans-bis(Dimethylglyoximato)-chloro-1-methylimidazole-cobalt(iii)","","- C12 H20 Cl Co N6 O4 -","- C12 H20 Cl Co N6 O4 -","- C24 H40 Cl2 Co2 N12 O8 -","2","1","","Scott J. Moore; Rene J. Lachicotte; Sharon T. Sullivan; Luigi G. Marzilli","Use of 13C-1H NMR Coupling Constants To Assess the Binding of Imidazole Ring Ligands to Metals","Inorganic Chemistry","1999","38","","383","390","10.1021/ic980519k","","","0.71073","MoKα","","0.0454","0.041","","","0.1318","0.1378","","","","","","1.166","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321740","14.463","0.002","11.974","0.001","31.179","0.003","90","","101.564","0.008","90","","5290","1","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Tris[(2,4,6-tri-t-butylphenyl)amido]indium(III)","","- C54 H90 In N3 -","- C54 H90 In N3 -","- C216 H360 In4 N12 -","4","1","","Joel S. Silverman; Claire J. Carmalt; Alan H. Cowley; Robert D. Culp; Richard A. Jones; Brian G. McBurnett","Synthesis and Structural Characterization of Some Monomeric Group 13 Amides","Inorganic Chemistry","1999","38","","296","300","10.1021/ic980619q","","","0.71073","MoKα","","0.1369","0.079","","0.2167","0.1944","","","","1.583","1.842","1.842","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4321741","11.569","0.002","22.13","0.006","24.92","0.005","100.6","0.02","102.8","0.02","90.25","0.02","6109","2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","{Tris[(2,6-di-isopropylphenyl)amido]}gallium(III)pyridine","","- C41 H59 Ga N4 -","- C41 H59 Ga N4 -","- C246 H354 Ga6 N24 -","6","3","","Joel S. Silverman; Claire J. Carmalt; Alan H. Cowley; Robert D. Culp; Richard A. Jones; Brian G. McBurnett","Synthesis and Structural Characterization of Some Monomeric Group 13 Amides","Inorganic Chemistry","1999","38","","296","300","10.1021/ic980619q","","","0.71073","MoKα","","0.2618","0.0621","","0.1266","0.0818","","","","0.992","1.159","1.159","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321742","10.966","0.001","12.787","0.002","16.8609","0.0012","87.558","0.007","85.739","0.007","72.38","0.008","2246.6","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","{Tris[(2,6-di-isopropylphenyl)amido]}indium(III)dipyridine","","- C46 H64 In N5 -","- C46 H64 In N5 -","- C92 H128 In2 N10 -","2","1","","Joel S. Silverman; Claire J. Carmalt; Alan H. Cowley; Robert D. Culp; Richard A. Jones; Brian G. McBurnett","Synthesis and Structural Characterization of Some Monomeric Group 13 Amides","Inorganic Chemistry","1999","38","","296","300","10.1021/ic980619q","","","0.71073","MoKα","","0.0946","0.0527","","0.1038","0.09","","","","1.069","1.116","1.116","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321743","15.078","0.004","28.954","0.006","31.74","0.009","90","","99.54","0.03","90","","13665","6","173","","173","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C102 H202 Al N O24 Si16 -","- C102 H202 Al N O24 Si16 -","- C408 H808 Al4 N4 O96 Si64 -","4","1","","Frank T. Edelmann; Yurii K. Gun'ko; Stephan Giessmann; Falk Olbrich; Klaus Jacob","Silsesquioxane Chemistry: Synthesis and Structure of the Novel Anionic Aluminosilsesquioxane [HNEt3][{Cy7Si7O9(OSiMe3)O2}2Al].C6H14 (Cy = c-C6H11)","Inorganic Chemistry","1999","38","","210","211","10.1021/ic9808100","","","0.71073","MoKα","","0.1949","0.0886","","","0.2018","0.2599","","","","","","1.01","","","","has coordinates","301838","2025-08-20","22:17:33",""
"4321744","10.465","0.001","16.395","0.001","20.241","0.001","90","","90","","90","","3472.8","0.4","150","0.2","150","0.2","","","","","","","hydrothermal synthesis","6","P b n m","-P 2c 2ab","62","","","","- C3 H16 Mo5 N2 O28 U3 -","- C3 H12 Mo5 N2 O28 U3 -","- C12 H48 Mo20 N8 O112 U12 -","4","0.5","","P. Shiv Halasyamani; Robin J. Francis; Susan M. Walker; Dermot O'Hare","New Layered Uranium(VI) Molybdates: Syntheses and Structures of (NH~3~(CH~2~)~3~NH~3~)(H~3~O)~2~(UO~2~)~3~(MoO~4~)~5~, C(NH~2~)~3~(OH)(MoO~4~), (C~4~H~12~N~2~)(UO~2~)(MoO~4~)~2~, and (C~5~H~14~N~2~)(UO~2~)(MoO~4~)~2.H~2~O","Inorganic Chemistry","1999","38","","271","279","10.1021/ic980836r","","","0.71073","MoKα","","0.0476","0.0449","","0.1359","0.1341","","","","1.063","1.088","1.088","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321745","15.411","0.001","7.086","0.001","18.108","0.001","90","","113.125","0.003","90","","1818.5","0.3","150","0.2","150","0.2","","","","","","","hydrothermal synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H14 Mo2 N6 O14 U2 -","- C2 H12 Mo2 N6 O14 U2 -","- C8 H48 Mo8 N24 O56 U8 -","4","1","","P. Shiv Halasyamani; Robin J. Francis; Susan M. Walker; Dermot O'Hare","New Layered Uranium(VI) Molybdates: Syntheses and Structures of (NH~3~(CH~2~)~3~NH~3~)(H~3~O)~2~(UO~2~)~3~(MoO~4~)~5~, C(NH~2~)~3~(OH)(MoO~4~), (C~4~H~12~N~2~)(UO~2~)(MoO~4~)~2~, and (C~5~H~14~N~2~)(UO~2~)(MoO~4~)~2.H~2~O","Inorganic Chemistry","1999","38","","271","279","10.1021/ic980836r","","","0.71073","MoKα","","0.0351","0.0325","","0.0798","0.0768","","","","1.253","1.245","1.245","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321746","7.096","0.001","8.388","0.001","11.634","0.001","97.008","0.003","96.454","0.003","110.456","0.003","634.94","0.13","150","0.2","150","0.2","","","","","","","hydrothermal synthesis","6","P -1","-P 1","2","","","","- C4 H12 Mo2 N2 O10 U -","- C4 H12 Mo2 N2 O10 U -","- C8 H24 Mo4 N4 O20 U2 -","2","1","","P. Shiv Halasyamani; Robin J. Francis; Susan M. Walker; Dermot O'Hare","New Layered Uranium(VI) Molybdates: Syntheses and Structures of (NH~3~(CH~2~)~3~NH~3~)(H~3~O)~2~(UO~2~)~3~(MoO~4~)~5~, C(NH~2~)~3~(OH)(MoO~4~), (C~4~H~12~N~2~)(UO~2~)(MoO~4~)~2~, and (C~5~H~14~N~2~)(UO~2~)(MoO~4~)~2.H~2~O","Inorganic Chemistry","1999","38","","271","279","10.1021/ic980836r","","","0.71073","MoKα","","0.0359","0.0357","","0.0987","0.0986","","","","1.184","1.188","1.188","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321747","12.697","0.001","13.247","0.001","17.793","0.001","90","","90","","90","","2992.7","0.4","150","0.2","150","0.2","","","","","","","hydrothermal synthesis","6","P b c a","-P 2ac 2ab","61","","","","- C5 H16 Mo2 N2 O11 U -","- C5 H14 Mo2 N2 O11 U -","- C40 H112 Mo16 N16 O88 U8 -","8","1","","P. Shiv Halasyamani; Robin J. Francis; Susan M. Walker; Dermot O'Hare","New Layered Uranium(VI) Molybdates: Syntheses and Structures of (NH~3~(CH~2~)~3~NH~3~)(H~3~O)~2~(UO~2~)~3~(MoO~4~)~5~, C(NH~2~)~3~(OH)(MoO~4~), (C~4~H~12~N~2~)(UO~2~)(MoO~4~)~2~, and (C~5~H~14~N~2~)(UO~2~)(MoO~4~)~2.H~2~O","Inorganic Chemistry","1999","38","","271","279","10.1021/ic980836r","","","0.71073","MoKα","","0.0487","0.0476","","0.119","0.1186","","","","1.415","1.432","1.432","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321748","12.052","0.002","18.487","0.004","21.039","0.005","68.95","0.02","86.12","0.02","78.637","0.013","4289","1.7","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C63.5 H88 B3 Cl9 Mo3 N18 O7 -","- C63 H80 B3 Cl9 Mo3 N18 O7 -","- C126 H160 B6 Cl18 Mo6 N36 O14 -","2","1","","Van Ân Ung; Samantha M. Couchman; John C. Jeffery; Jon A. McCleverty; Michael D. Ward; Federico Totti; Dante Gatteschi","Electrochemical and Magnetic Exchange Interactions in Trinuclear Chain Complexes Containing Oxo-Mo(V) Fragments as a Function of the Topology of the Bridging Ligand","Inorganic Chemistry","1999","38","","365","369","10.1021/ic980934c","","","0.71073","MoKα","","0.1994","0.0876","","0.2634","0.1994","","","","1.011","1.188","1.188","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321749","14.1611","0.0001","21.6122","0.0001","21.1463","0.0003","90","","98.677","0.001","90","","6397.8","0.11","183","2","183","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C39 H98.5 Cl Mo2 N12 O2.25 Si6 V -","- C39 H92 Cl Mo2 N12 O2.25 Si6 V -","- C156 H368 Cl4 Mo8 N48 O9 Si24 V4 -","4","1","","Myra B. O'Donoghue; William M. Davis; Richard R. Schrock; William M. Reiff","Heterobimetallic Dinitrogen Complexes That Contain the {[N3N]Mo-NN}- Ligand","Inorganic Chemistry","1999","38","","243","252","10.1021/ic9811188","","","0.71073","MoKα","","0.108","0.066","","0.1705","0.141","","","","1.085","1.165","1.165","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321750","16.415","0.0003","18.5686","0.0004","19.8964","0.0004","90","","100.259","0.001","90","","5967.5","0.2","183","2","183","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C32 H88 Cl2 Mo2 N12 O0.5 Si6 Zr -","- C32 H80.588 Cl2 Mo2 N12 O0.5 Si6 Zr -","- C128 H322.352 Cl8 Mo8 N48 O2 Si24 Zr4 -","4","1","","Myra B. O'Donoghue; William M. Davis; Richard R. Schrock; William M. Reiff","Heterobimetallic Dinitrogen Complexes That Contain the {[N3N]Mo-NN}- Ligand","Inorganic Chemistry","1999","38","","243","252","10.1021/ic9811188","","","0.71073","MoKα","","0.0986","0.0559","","0.1835","0.1322","","","","1.056","1.028","1.028","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321751","9.091","0.0012","30.527","0.004","11.903","0.002","90","","93.78","0.02","90","","3296.1","0.8","297","2","297","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","bis(μ-di-t-butylphosphido)-(di-t-butylphosphine)-carbonyl-di-platinum(i)","","","- C25 H55 O P3 Pt2 -","- C25 H55 O P3 Pt2 -","- C100 H220 O4 P12 Pt8 -","4","1","","Piero Leoni; Giuseppina Chiaradonna; Marco Pasquali; Fabio Marchetti","Dinuclear Phosphido-Bridged Derivatives of Platinum(I). Synthesis and Characterization of [Pt2(μ-PBut2)2(PBut2H)(L)] [L = PBut2R (R = H, Li, n-Heptyl), CO, η2-CS2]","Inorganic Chemistry","1999","38","","253","259","10.1021/ic9811392","","","0.71073","MoKα","","0.0676","0.0378","","0.0965","0.0826","","","","1.053","1.095","1.095","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321752","25.93","0.006","35.876","0.009","16.334","0.005","90","","90","","90","","15195","7","293.2","","293.2","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C48 H108 Au N3 Sn2 Te6 -","- C50 H108 Au N3 Sn2 Te6 -","- C400 H864 Au8 N24 Sn16 Te48 -","8","1","","Chwanchin Wang; Robert C. Haushalter","Synthesis and Structural Characterization of (n-Bu4N)3AuSn2Te6","Inorganic Chemistry","1999","38","","595","597","10.1021/ic980198c","","","0.7107","MoKalpha","","","0.0615","","","0.0812","","","","","3.465","3.465","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321753","33.128","0.012","16.252","0.005","17.185","0.007","90","","109.24","0.05","90","","8736","6","200","2","200","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C38 H43 Cl4 I2 N2 P Ru S3 -","- C38 H43 Cl4 I2 N2 P Ru S3 -","- C304 H344 Cl32 I16 N16 P8 Ru8 S24 -","8","1","","Dieter Sellmann; Jürgen Utz; Frank W. Heinemann","Transition-Metal Complexes with Sulfur Ligands. 132.1 Electron-Rich Fe and Ru Complexes with [MN~2~S~3~] Cores Containing the New Pentadentate Ligand 'N~2~H~2~S~3~'^2-^ (= 2,2'-Bis(2-mercaptophenylamino)diethyl Sulfide(2-))","Inorganic Chemistry","1999","38","","459","466","10.1021/ic980383q","","","0.71073","MoKα","","0.0498","0.0361","","0.0904","0.0876","","","","0.881","1.007","1.007","","","","","has coordinates,has disorder","179320","2020-10-21","18:00:00",""
"4321754","8.136","0.008","11.406","0.015","19.871","0.018","90","","95.36","0.07","90","","1836","3","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H18 Fe N2 O S3 -","- C17 H18 Fe N2 O S3 -","- C68 H72 Fe4 N8 O4 S12 -","4","1","","Dieter Sellmann; Jürgen Utz; Frank W. Heinemann","Transition-Metal Complexes with Sulfur Ligands. 132.1 Electron-Rich Fe and Ru Complexes with [MN~2~S~3~] Cores Containing the New Pentadentate Ligand 'N~2~H~2~S~3~'^2-^ (= 2,2'-Bis(2-mercaptophenylamino)diethyl Sulfide(2-))","Inorganic Chemistry","1999","38","","459","466","10.1021/ic980383q","","","0.71073","MoKα","","0.0641","0.0415","","0.1424","0.1099","","","","1.059","1.086","1.086","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321755","10.537","0.003","24.437","0.007","14.531","0.007","90","","102.35","0.03","90","","3655","2","200","2","200","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C33 H55 N2 O2 P Ru S3 -","- C33 H55 N2 O2 P Ru S3 -","- C132 H220 N8 O8 P4 Ru4 S12 -","4","1","","Dieter Sellmann; Jürgen Utz; Frank W. Heinemann","Transition-Metal Complexes with Sulfur Ligands. 132.1 Electron-Rich Fe and Ru Complexes with [MN~2~S~3~] Cores Containing the New Pentadentate Ligand 'N~2~H~2~S~3~'^2-^ (= 2,2'-Bis(2-mercaptophenylamino)diethyl Sulfide(2-))","Inorganic Chemistry","1999","38","","459","466","10.1021/ic980383q","","","0.71073","MoKα","","0.091","0.0429","","0.0889","0.0823","","","","0.716","0.984","0.984","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321756","11.398","0.001","6.7021","0.0009","12.6595","0.0006","90","","96.022","0.005","90","","961.73","0.16","296.2","","296.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 K S2 -","- C8 H7 K S2 -","- C32 H28 K4 S8 -","4","1","","Shinzi Kato; Nobuyuki Kitaoka; Osamu Niyomura; Yuka Kitoh; Takahiro Kanda; Masahiro Ebihara","Heavy Alkali Metal Arenedithiocarboxylates: A Facile Synthesis, Dimeric Structure, and Nonbonding Interaction between the Metals and Aromatic Ring Carbons","Inorganic Chemistry","1999","38","","496","506","10.1021/ic9808089","","","0.7107","MoKα","","","0.0353","","","0.0437","","","","","1.648","1.648","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321757","16.768","0.002","21.617","0.002","10.929","0.002","90","","90","","90","","3961.5","0.9","296.2","","296.2","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C8 H7 Rb S2 -","- C8 H7 Rb S2 -","- C128 H112 Rb16 S32 -","16","0.5","","Shinzi Kato; Nobuyuki Kitaoka; Osamu Niyomura; Yuka Kitoh; Takahiro Kanda; Masahiro Ebihara","Heavy Alkali Metal Arenedithiocarboxylates: A Facile Synthesis, Dimeric Structure, and Nonbonding Interaction between the Metals and Aromatic Ring Carbons","Inorganic Chemistry","1999","38","","496","506","10.1021/ic9808089","","","0.7107","MoKα","","0","0","","0.1086","0","0.0367","","","2.088","","","1.468","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321758","17.346","0.001","21.891","0.002","10.931","0.002","90","","90","","90","","4150.7","0.9","173.2","","173.2","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","","","- C8 H7 Cs S2 -","- C8 H7 Cs S2 -","- C128 H112 Cs16 S32 -","16","0.5","","Shinzi Kato; Nobuyuki Kitaoka; Osamu Niyomura; Yuka Kitoh; Takahiro Kanda; Masahiro Ebihara","Heavy Alkali Metal Arenedithiocarboxylates: A Facile Synthesis, Dimeric Structure, and Nonbonding Interaction between the Metals and Aromatic Ring Carbons","Inorganic Chemistry","1999","38","","496","506","10.1021/ic9808089","","","0.7107","MoKα","","0","0","","","0","0.0322","","","","","","1.463","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321759","18.727","0.004","10.5","0.002","4.2192","0.0008","89.98","0.01","90.01","0.02","90.02","0.01","829.6","0.3","296.2","","296.2","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C9 H11 Na O2 S2 -","- C8 H7 Na0.355 S2 -","- C32 H28 Na1.42 S8 -","4","1","","Shinzi Kato; Nobuyuki Kitaoka; Osamu Niyomura; Yuka Kitoh; Takahiro Kanda; Masahiro Ebihara","Heavy Alkali Metal Arenedithiocarboxylates: A Facile Synthesis, Dimeric Structure, and Nonbonding Interaction between the Metals and Aromatic Ring Carbons","Inorganic Chemistry","1999","38","","496","506","10.1021/ic9808089","","","0.7107","MoKα","","0","0","","","0","0.0664","","","","","","2.705","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321760","16.392","0.002","9.318","0.003","27.493","0.002","90","","100.074","0.009","90","","4134.6","1.5","296.2","","296.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H57 N3 S6 -","- C36 H57 N3 S6 -","- C144 H228 N12 S24 -","4","1","","Shinzi Kato; Nobuyuki Kitaoka; Osamu Niyomura; Yuka Kitoh; Takahiro Kanda; Masahiro Ebihara","Heavy Alkali Metal Arenedithiocarboxylates: A Facile Synthesis, Dimeric Structure, and Nonbonding Interaction between the Metals and Aromatic Ring Carbons","Inorganic Chemistry","1999","38","","496","506","10.1021/ic9808089","","","0.7107","MoKα","","","0.0563","","","0.0558","","","","","2.009","2.009","","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321761","10.481","0.002","18.243","0.002","7.474","0.002","90","","90","","90","","1429.1","0.5","296.2","","296.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H19 N O S2 -","- C12 H19 N O S2 -","- C48 H76 N4 O4 S8 -","4","1","","Shinzi Kato; Nobuyuki Kitaoka; Osamu Niyomura; Yuka Kitoh; Takahiro Kanda; Masahiro Ebihara","Heavy Alkali Metal Arenedithiocarboxylates: A Facile Synthesis, Dimeric Structure, and Nonbonding Interaction between the Metals and Aromatic Ring Carbons","Inorganic Chemistry","1999","38","","496","506","10.1021/ic9808089","","","0.7107","MoKα","","0","0","","","0","0.0365","","","","","","1.339","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321762","31.02","0.008","4.12","0.01","11.907","0.007","90","","97.44","0.04","90","","1509","4","296.2","","296.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C7 H5 K O S -","- C7 H5 K O S -","- C56 H40 K8 O8 S8 -","8","1","","Osamu Niyomura; Shinzi Kato; Takahiro Kanda","Facile Synthesis and Structure of Heavy Alkali Metal Thiocarboxylates: Structural Comparison with the Selenium and Tellurium Isologues","Inorganic Chemistry","1999","38","","507","518","10.1021/ic9808091","","","0.7107","MoKα","","0","0","","","0","0.038","","","","","","2.86","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321763","8.401","0.001","7.126","0.001","15.144","0.001","90","","98.866","0.009","90","","895.77","0.18","296.2","","296.2","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C8 H7 K O2 S -","- C8 H7 K O2 S -","- C32 H28 K4 O8 S4 -","4","1","","Osamu Niyomura; Shinzi Kato; Takahiro Kanda","Facile Synthesis and Structure of Heavy Alkali Metal Thiocarboxylates: Structural Comparison with the Selenium and Tellurium Isologues","Inorganic Chemistry","1999","38","","507","518","10.1021/ic9808091","","","0.7107","MoKα","","0.0318","0.0318","","","0.0408","0.0408","","","","","","1.735","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321764","20.858","0.002","10.88","0.002","7.743","0.002","90","","90","","90","","1757.2","0.6","193.2","","193.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H7 K O2 S -","- C8 H7 K O2 S -","- C64 H56 K8 O16 S8 -","8","1","","Osamu Niyomura; Shinzi Kato; Takahiro Kanda","Facile Synthesis and Structure of Heavy Alkali Metal Thiocarboxylates: Structural Comparison with the Selenium and Tellurium Isologues","Inorganic Chemistry","1999","38","","507","518","10.1021/ic9808091","","","0.7107","MoKα","","0.0454","0.0454","","","0.0478","0.0478","","","","","","1.228","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321765","8.433","0.003","29.298","0.003","7.395","0.003","90","","90","","90","","1827.1","1","193.2","","193.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C8 H7 O2 Rb S -","- C8 H7 O2 Rb S -","- C64 H56 O16 Rb8 S8 -","8","1","","Osamu Niyomura; Shinzi Kato; Takahiro Kanda","Facile Synthesis and Structure of Heavy Alkali Metal Thiocarboxylates: Structural Comparison with the Selenium and Tellurium Isologues","Inorganic Chemistry","1999","38","","507","518","10.1021/ic9808091","","","0.7107","MoKα","","0.0346","0.0346","","","0.0362","0.0361","","","","","","1.105","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321766","11.3264","0.0009","13.671","0.001","8.371","0.001","90","","90","","90","","1296.2","0.2","296.2","","296.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H19 N O2 S -","- C12 H19 N O2 S -","- C48 H76 N4 O8 S4 -","4","1","","Osamu Niyomura; Shinzi Kato; Takahiro Kanda","Facile Synthesis and Structure of Heavy Alkali Metal Thiocarboxylates: Structural Comparison with the Selenium and Tellurium Isologues","Inorganic Chemistry","1999","38","","507","518","10.1021/ic9808091","","","0.7107","MoKα","","0.0352","0.0352","","","0.0358","0.0358","","","","","","1.643","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321767","11.983","0.002","9.064","0.002","12.882","0.002","90","","95.53","0.01","90","","1392.7","0.4","296.2","","296.2","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C12 H16 F3 N O S -","- C12 H16 F3 N O S -","- C48 H64 F12 N4 O4 S4 -","4","1","","Osamu Niyomura; Shinzi Kato; Takahiro Kanda","Facile Synthesis and Structure of Heavy Alkali Metal Thiocarboxylates: Structural Comparison with the Selenium and Tellurium Isologues","Inorganic Chemistry","1999","38","","507","518","10.1021/ic9808091","","","0.7107","MoKα","","0.0487","0.0487","","","0.0584","0.0584","","","","","","1.865","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321768","8.597","0.004","7.106","0.004","15.104","0.006","90","","100.36","0.04","90","","907.7","0.8","193.2","","193.2","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C8 H7 K O2 Se -","- C8 H7 K O2 Se -","- C32 H28 K4 O8 Se4 -","4","1","","Osamu Niyomura; Shinzi Kato; Takahiro Kanda","Facile Synthesis and Structure of Heavy Alkali Metal Thiocarboxylates: Structural Comparison with the Selenium and Tellurium Isologues","Inorganic Chemistry","1999","38","","507","518","10.1021/ic9808091","","","0.7107","MoKα","","0","0","","","0","0.041","","","","","","1.83","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321769","5.546","0.002","7.854","0.002","23.336","0.008","89.99","0.03","93.18","0.04","89.98","0.03","1014.9","0.6","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 O2 Rb Te -","- C8 H7 O2 Rb Te -","- C32 H28 O8 Rb4 Te4 -","4","1","","Osamu Niyomura; Shinzi Kato; Takahiro Kanda","Facile Synthesis and Structure of Heavy Alkali Metal Thiocarboxylates: Structural Comparison with the Selenium and Tellurium Isologues","Inorganic Chemistry","1999","38","","507","518","10.1021/ic9808091","","","0.7107","MoKα","","0.0758","0.0758","","","0.1671","0.1671","","","","","","2.062","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321770","5.975","0.003","14.517","0.002","10.617","0.003","90","","92.74","0.03","90","","919.9","0.5","296.2","","296.2","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C8 H7 Cl O Te -","- C8 H7 Cl O Te -","- C32 H28 Cl4 O4 Te4 -","4","1","","Shinzi Kato; Osamu Niyomura; Shohou Nakaiida; Yasuyuki Kawahara; Takahiro Kanda; Ryo Yamada; Shinya Hori","First Isolation and Characterization of Sodium and Potassium Tellurocarboxylates: Structural Analysis of Te-Alkyl Telluroester","Inorganic Chemistry","1999","38","","519","530","10.1021/ic980815x","","","0.7107","MoKα","","","0.0326","","","0.0459","","","","","1.705","1.705","","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321771","7.6015","0.0008","20.12","0.008","19.07","0.006","90","","90","","90","","2916.6","1.5","213","2","213","2","","","","","","","synthesized","5","P b c n","-P 2n 2ab","60","","Bis(dichloro-bis(diethylphosphine))-di-molybdenum (II), 1,3,6,8-isomer","","- C16 H44 Cl4 Mo2 P4 -","- C16 H44 Cl4 Mo2 P4 -","- C64 H176 Cl16 Mo8 P16 -","4","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4","Inorganic Chemistry","1999","38","","490","495","10.1021/ic980972w","","","0.71073","MoKα","","0.0407","0.0345","","0.0827","0.0783","","","","1.094","1.111","1.111","","","","","has coordinates,has disorder","179320","2020-10-21","18:00:00",""
"4321772","12.396","0.001","12.396","0.001","21.96","0.002","90","","90","","120","","2922.3","0.4","293","2","293","2","","","","","","","synthesized","5","P 64 2 2","P 64 2 (0 0 2)","181","","Tetrachloro-tetrakis(bis(dimethylphosphino)methane-P)- -di-molybdenum(II)","","- C20 H56 Cl4 Mo2 P8 -","- C20 H56 Cl4 Mo2 P8 -","- C60 H168 Cl12 Mo6 P24 -","3","0.25","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4","Inorganic Chemistry","1999","38","","490","495","10.1021/ic980972w","","","1.54184","CuKα","","0.0373","0.0335","","0.0918","0.0891","","","","1.088","1.096","1.096","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321773","12.699","0.002","12.699","0.002","16.015","0.004","90","","90","","90","","2582.7","0.9","173","2","173","2","","","","","","","synthesized","5","I -4","I -4","82","","Bis(μ2-bis(dimethylphosphino)methane-P,P')-tetrachloro- -di-molybdenum(II), hexane solvate","","- C13 H35 Cl4 Mo2 P4 -","- C13 H35 Cl4 Mo2 P4 -","- C52 H140 Cl16 Mo8 P16 -","4","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4","Inorganic Chemistry","1999","38","","490","495","10.1021/ic980972w","","","0.71073","MoKα","","0.0496","0.0308","","0.0866","0.0785","","","","1.053","1.102","1.102","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321774","18.03","0.001","14.5108","0.0007","23.221","0.001","90","","112.778","0.004","90","","5601.5","0.5","213","2","213","2","","","","","","","synthesized","5","P 1 21/n 1","-P 2yn","14","","Bis(μ2-bis(diphenylphosphino)methane-P,P')-tetrachloro- -di-molybdenum(II), dichloromethane solvate","","- C52 H48 Cl8 Mo2 P4 -","- C52 H44 Cl8 Mo2 P4 -","- C208 H176 Cl32 Mo8 P16 -","4","1","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 2. Reactions of Mo2Cl4(NHEt2)4 with Monodentate and Bidentate Phosphines. New Type of Compounds Mo2Cl4(diphosphine)4","Inorganic Chemistry","1999","38","","490","495","10.1021/ic980972w","","","0.71073","MoKα","","0.0624","0.058","","0.1657","0.1587","","","","1.102","1.107","1.107","","","","","has coordinates,has disorder","179320","2020-10-21","18:00:00",""
"4321775","6.92","0.005","8.797","0.005","7.053","0.002","90","","115.49","0.03","90","","387.6","0.4","200","","200","","","","","","","","","4","P 1 2/m 1","-P 2y","10","","","","- C6 H22 B10 Si2 -","- C6 H22 B10 Si2 -","- C6 H22 B10 Si2 -","1","0.25","","Francis M. de Rege; Jeremy D. Kassebaum; Brian L. Scott; Kent D. Abney; Gary J. Balaich","Synthesis, Structure, and Reactivity of 1,2-(1',1',2',2'-Tetramethyldisilane-1',2')carborane","Inorganic Chemistry","1999","38","","486","489","10.1021/ic980992y","","","0.71073","MoKα","","0.1261","0.064","","0.1443","0.1189","","","","1.088","1.248","1.248","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321776","13.126","0.001","14.355","0.005","8.472","0.001","90","","90","","90","","1596.3","0.6","198","","198","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C6 H22 B10 O Si2 -","- C6 H22 B10 O Si2 -","- C24 H88 B40 O4 Si8 -","4","0.5","","Francis M. de Rege; Jeremy D. Kassebaum; Brian L. Scott; Kent D. Abney; Gary J. Balaich","Synthesis, Structure, and Reactivity of 1,2-(1',1',2',2'-Tetramethyldisilane-1',2')carborane","Inorganic Chemistry","1999","38","","486","489","10.1021/ic980992y","","","0.71073","MoKα","","0.0731","0.0448","","0.1181","0.1054","","","","1.162","1.244","1.244","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321777","21.224","0.005","10.7537","0.0008","22.723","0.005","90","","116.76","0.01","90","","4630.8","1.6","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C18 H37 Co Fe N11 Na O4 -","- C18 H29 Co Fe N11 Na O4 -","- C108 H174 Co6 Fe6 N66 Na6 O24 -","6","3","","Paul V. Bernhardt; Manuel Martinez","The First Structurally Characterized Discrete Dinuclear μ-Cyano Hexacyanoferrate Complex","Inorganic Chemistry","1999","38","","424","425","10.1021/ic981019u","","","0.71073","MoKα","","0.1928","0.0923","","0.3227","0.2453","","","","1.017","1.155","1.155","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321778","13.594","0.001","23.177","0.002","16.351","0.001","90","","104.59","0.01","90","","4985.6","0.7","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","magnesium tri(tert-butyl)silylphosphandiide","","- C13 H28 Mg P Si -","- C13 H28 Mg P Si -","- C156 H336 Mg12 P12 Si12 -","12","3","","Matthias Westerhausen; Mathias Krofta; Arno Pfitzner","Synthesis and Structure of Solvent-Free Hexameric Magnesium Tri(tert-butyl)silylphosphandiide","Inorganic Chemistry","1999","38","","598","599","10.1021/ic9810485","","","0.71073","MoKα","","0.0896","0.0756","","0.2263","0.2139","","","","1.062","1.122","1.122","","","","","has coordinates,has disorder","179320","2020-10-21","18:00:00",""
"4321779","12.526","0.004","16.551","0.006","14.75","0.004","90","","113.46","0.02","90","","2805.2","1.6","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H72 Ca2 N4 O20 -","- C50 H72 Ca2 N4 O20 -","- C100 H144 Ca4 N8 O40 -","2","0.5","","Norikazu Ueyama; Jiro Takeda; Yusuke Yamada; Akira Onoda; Taka-aki Okamura; Akira Nakamura","Dinuclear Calcium Complexes with Intramolecularly NH...O Hydrogen-Bonded Dicarboxylate Ligands","Inorganic Chemistry","1999","38","","475","478","10.1021/ic981055t","","","0.7107","MoKα","","","0.0594","","","0.0688","","","","","1.843","1.843","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321780","9.763","0.003","10.255","0.004","11.607","0.006","114.01","0.04","95.03","0.03","95.23","0.03","1047.1","0.8","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H52 Fe2 N4 O4 S6 -","- C36 H52 Fe2 N4 O4 S6 -","- C36 H52 Fe2 N4 O4 S6 -","1","0.5","","Dieter Sellmann; Jürgen Utz; Frank W. Heinemann","Transition-Metal Complexes with Sulfur Ligands. 132.1 Electron-Rich Fe and Ru Complexes with [MN~2~S~3~] Cores Containing the New Pentadentate Ligand 'N~2~H~2~S~3~'^2-^ (= 2,2'-Bis(2-mercaptophenylamino)diethyl Sulfide(2-))","Inorganic Chemistry","1999","38","","459","466","10.1021/ic980383q","","","0.71073","MoKα","","0.0435","0.036","","0.1052","0.1026","","","","1.081","1.183","1.183","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321781","10.4886","0.0005","10.706","0.001","11.487","0.001","108.784","0.008","108.887","0.006","95.139","0.006","1128.07","0.18","293.2","","293.2","","","","","","","","","7","P -1","-P 1","2","","","","- C17 H27 Cl N4 Ni O5 S2 -","- C17 H27 Cl N4 Ni O5 S2 -","- C34 H54 Cl2 N8 Ni2 O10 S4 -","2","1","","Sudeep Bhattacharyya; Timothy J. R. Weakley; Muktimoy Chaudhury","Nickel(II) in an N4S Donor Environment: An Unprecedented Alcoholysis Reaction through the Activation of a Carbon-Nitrogen Single Bond","Inorganic Chemistry","1999","38","","633","638","10.1021/ic9703888","","","0.7107","MoKalpha","","","0.0418","","","0.0541","","","","","2.688","2.688","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321782","8.875","0.002","18.629","0.002","15.399","0.002","90","","91.37","0.02","90","","2545.2","0.7","294.2","","294.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H33 Cl N4 Ni O5 S2 -","- C20 H33 Cl N4 Ni O5 S2 -","- C80 H132 Cl4 N16 Ni4 O20 S8 -","4","1","","Sudeep Bhattacharyya; Timothy J. R. Weakley; Muktimoy Chaudhury","Nickel(II) in an N4S Donor Environment: An Unprecedented Alcoholysis Reaction through the Activation of a Carbon-Nitrogen Single Bond","Inorganic Chemistry","1999","38","","633","638","10.1021/ic9703888","","","0.7107","MoKalpha","","","0.0486","","","0.0529","","","","","2.663","2.663","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321783","60.2","0.006","14.977","0.002","19.066","0.003","90","","98.367","0.014","90","","17007","4","173","2","173","2","","","","","","","","10","C 1 2/c 1","-C 2yc","15","","","","- C74 H69 Au3 Cl10 F6 Fe N O6 P3 S3 -","- C74 H65 Au3 Cl10 F6 Fe N O6 P3 S3 -","- C592 H520 Au24 Cl80 F48 Fe8 N8 O48 P24 S24 -","8","1","","Eva M. Barranco; M. Concepción Gimeno; Peter G. Jones; Antonio Laguna; M. Dolores Villacampa","Synthesis of the Ferrocene Derivative FcCHN(CH~2~)~2~SH [Fc = (η5-C~5~H~5~)Fe(η5-C~5~H~4~)]: Reactivity toward (Phosphine)gold(I) Cations","Inorganic Chemistry","1999","38","","702","706","10.1021/ic980379e","","","0.71073","MoKα","","0.1192","0.052","","0.105","0.0918","","","","0.776","0.977","0.977","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321784","8.119","0.002","9.243","0.003","12.822","0.004","76.15","0.03","89.39","0.03","69.63","0.03","873","0.5","220","2","220","2","","","","","","","see experimental","7","P -1","-P 1","2","","","","- C14 H15 F6 N2 O2 P Pt -","- C14 H15 F6 N2 O2 P Pt -","- C28 H30 F12 N4 O4 P2 Pt2 -","2","1","","Dirk Steinborn; Michael Gerisch; Clemens Bruhn; Julian A. Davies","Synthesis and Characterization of Intermolecular Hydrogen Bond Stabilized Acyl(hydroxycarbene)platinum(II) Complexes","Inorganic Chemistry","1999","38","","680","683","10.1021/ic9805170","","","0.71073","MoKα","","0.0351","0.0339","","0.0829","0.0822","","","","1.099","1.122","1.122","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321785","21.147","0.006","14.3547","0.0015","23.036","0.004","90","","116.78","0.02","90","","6243","2","220","2","220","2","","","","","","","see experimental","7","P 1 21/a 1","-P 2yab","14","","","","- C28 H29 F6 N4 O4 P Pt2 -","- C28 H29 F6 N4 O4 P Pt2 -","- C224 H232 F48 N32 O32 P8 Pt16 -","8","2","","Dirk Steinborn; Michael Gerisch; Clemens Bruhn; Julian A. Davies","Synthesis and Characterization of Intermolecular Hydrogen Bond Stabilized Acyl(hydroxycarbene)platinum(II) Complexes","Inorganic Chemistry","1999","38","","680","683","10.1021/ic9805170","","","0.71073","MoKα","","0.0574","0.0363","","0.0845","0.0767","","","","0.936","1.007","1.007","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321786","13.813","0.003","16.641","0.004","15.722","0.004","90","","96.73","0.02","90","","3589","1.5","220","2","220","2","","","","","","","see experimental","7","I 1 2/a 1","-I 2ya","15","","","","- C31 H35 F6 N4 O5 P Pt2 -","- C31 H35 F6 N4 O5 P Pt2 -","- C124 H140 F24 N16 O20 P4 Pt8 -","4","0.5","","Dirk Steinborn; Michael Gerisch; Clemens Bruhn; Julian A. Davies","Synthesis and Characterization of Intermolecular Hydrogen Bond Stabilized Acyl(hydroxycarbene)platinum(II) Complexes","Inorganic Chemistry","1999","38","","680","683","10.1021/ic9805170","","","0.71073","MoKα","","0.048","0.0394","","0.0984","0.0946","","","","1.089","1.146","1.146","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321787","9.638","0.005","9.715","0.005","7.237","0.004","90.96","0.01","105.72","0.01","119.74","0.01","557","0.5","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H32 Al N5 O16 -","- C12 H31 Al N5 O16 -","- C12 H31 Al N5 O16 -","1","0.5","","M. Matzapetakis; C. P. Raptopoulou; A. Terzis; A. Lakatos; T. Kiss; A. Salifoglou","Synthesis, Structural Characterization, and Solution Behavior of the First Mononuclear, Aqueous Aluminum Citrate Complex","Inorganic Chemistry","1999","38","","618","619","10.1021/ic9806131","","","0.71073","MoKα","","0.0706","0.0498","","0.164","0.1477","","","","1.068","1.12","1.12","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321788","6.886","0.003","6.886","0.003","8.3","0.002","90","","90","","90","","393.6","0.3","153.2","","153.2","","","","","","","","hydro(solvo)thermal synthesis","7","P 4/m m m","-P 4 2","123","","","","- C12 H14 Cu F4 N6 O3 W -","- C9.36 Cu0.06 F1.64 N1.26 O0.66 W0.06 -","- C9.36 Cu0.06 F1.64 N1.26 O0.66 W0.06 -","1","0.0625","","Kevin R. Heier; Alexander J. Norquist; P. Shiv Halasyamani; Angel Duarte; Charlotte L. Stern; Kenneth R. Poeppelmeier","The Polar [WO2F4]2- Anion in the Solid State","Inorganic Chemistry","1999","38","","762","767","10.1021/ic980863h","","","0.7107","MoKα","","0.038","0.038","","0.041","","0.041","","","3.514","","","3.51","","","","has coordinates","134363","2020-10-21","18:00:00",""
"4321789","9.834","0.002","11.871","0.005","15.368","0.008","90","","106.833","0.003","90","","1717.2","1.2","298","1","293","1","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","{[Cu(CH2(C6H4-4-NH2)2)(CH2(COOH)2)Cl]Cl}2","","- C16 H18 Cl2 Cu N2 O4 -","- C16 H18 Cl2 Cu N2 O4 -","- C64 H72 Cl8 Cu4 N8 O16 -","4","1","","Yugen Zhang; Masayoshi Nishiura; Li Jianmin; Deng Wei; Tsuneo Imamoto","New Maze-Type Network Assembled by Copper(II) and 4,4'-Diaminodiphenylmethane: {[Cu(C13H14N2)(C3H4O4)Cl]Cl}2","Inorganic Chemistry","1999","38","","825","827","10.1021/ic980911y","","","0.71073","MoKα","","0.089","0.089","","0.125","0.125","","","","","5.26","5.26","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321790","9.172","0.002","10.844","0.002","11.648","0.002","90","","90","","90","","1158.5","0.4","193","2","193","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","anti-ReO(CACAH2)","","","- C7 H11 N2 O4 Re S2 -","- C7 H11 N2 O4 Re S2 -","- C28 H44 N8 O16 Re4 S8 -","4","1","","Hing C. Wong; Raymond Coogan; Francesco P. Intini; Giovanni Natile; Luigi G. Marzilli","New Steric Hindrance Approach Employing the Hybrid Ligand 2-Aminomethylpiperidine for Diminishing Dynamic Motion Problems of Platinum Anticancer Drug Adducts Containing Guanine Derivatives","Inorganic Chemistry","1999","38","","777","787","10.1021/ic980987u","","","0.71073","MoKα","","0.0151","0.0147","","0.0358","0.0353","","","","0.36","0.359","0.359","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321791","10.6811","0.0002","10.9709","0.0002","37.5134","0.0005","90","","90","","90","","4395.87","0.13","193","2","193","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","syn-ReO(PACAH2) 0.67H2O","","","- C9 H16.33 N2 O4.67 Re S2 -","- C9 H16.3333 N2 O4.66667 Re S2 -","- C108 H196 N24 O56 Re12 S24 -","12","3","","Hing C. Wong; Raymond Coogan; Francesco P. Intini; Giovanni Natile; Luigi G. Marzilli","New Steric Hindrance Approach Employing the Hybrid Ligand 2-Aminomethylpiperidine for Diminishing Dynamic Motion Problems of Platinum Anticancer Drug Adducts Containing Guanine Derivatives","Inorganic Chemistry","1999","38","","777","787","10.1021/ic980987u","","","0.71073","MoKα","","0.029","0.0248","","0.0453","0.0443","","","","0.992","1.004","1.004","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321792","27.5207","0.0003","18.4345","0.0003","22.1614","0.0003","90","","102.433","0.001","90","","10979.5","0.3","162","2","162","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50.25 H93.5 Cl0.5 Co N6 O2.5 -","- C50.25 H91.5 Cl0.5 Co N6 O2.35 -","- C402 H732 Cl4 Co8 N48 O18.8 -","8","2","","Steven Arzberger; Jake Soper; Oren P. Anderson; Agnete la Cour; Mark Wicholas","Synthesis and Structure of an Air-Stable, Free-Radical Cobalt(III) Semiquinone Complex","Inorganic Chemistry","1999","38","","757","761","10.1021/ic981052g","","","0.71073","MoKα","","0.1663","0.098","","0.2902","0.2491","","","","1.003","1.174","1.174","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321793","13.065","0.002","13.626","0.003","14.043","0.003","114.47","0.03","97.67","0.03","90.34","0.03","2249.9","1","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C88 H123 Cl2 Fe2 N11 Ni O8 S6 -","- C88 H108 Cl2 Fe2 N11 Ni O8 S6 -","- C88 H108 Cl2 Fe2 N11 Ni O8 S6 -","1","0.5","","Thorsten Glaser; Frank Kesting; Thomas Beissel; Eckhard Bill; Thomas Weyhermüller; Wolfram Meyer-Klaucke; Karl Wieghardt","Spin-Dependent Delocalization in Three Isostructural Complexes [LFeNiFeL]2+/3+/4+ (L = 1,4,7-(4-tert-Butyl-2-mercaptobenzyl)-1,4,7-triazacyclononane)","Inorganic Chemistry","1999","38","","722","732","10.1021/ic9811289","","","0.71073","MoKα","","0.0746","0.0545","","0.1506","0.1402","","","","1.084","1.137","1.137","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321794","13.155","0.002","14.747","0.002","16.237","0.003","114.2","0.02","96.57","0.02","98.86","0.02","2783.2","1","100","2","100","2","","","","","","","","8","P -1","-P 1","2","","","","- C102 H156 Cl3 Fe2 N6 Ni O20 S6 -","- C102 H156 Cl3 Fe2 N6 Ni O20 S6 -","- C102 H156 Cl3 Fe2 N6 Ni O20 S6 -","1","0.5","","Thorsten Glaser; Frank Kesting; Thomas Beissel; Eckhard Bill; Thomas Weyhermüller; Wolfram Meyer-Klaucke; Karl Wieghardt","Spin-Dependent Delocalization in Three Isostructural Complexes [LFeNiFeL]2+/3+/4+ (L = 1,4,7-(4-tert-Butyl-2-mercaptobenzyl)-1,4,7-triazacyclononane)","Inorganic Chemistry","1999","38","","722","732","10.1021/ic9811289","","","0.71073","MoKα","","0.07","0.0517","","0.1397","0.1256","","","","1.053","1.091","1.091","","","","","has coordinates,has disorder","179320","2020-10-21","18:00:00",""
"4321795","9.951","0.001","8.072","0.001","7.075","0.001","90","","90","","90","","568.3","0.12","293.2","","293.2","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- K2 N2 O5 S -","- K2 N2 O5 S -","- K8 N8 O20 S4 -","4","0.5","","John Reglinski; David R. Armstrong; Katherine Sealey; Mark D. Spicer","N-Nitrosohydroxylamine-N-sulfonate: A Redetermination of Its X-ray Crystal Structure and an Analysis of Its formation from NO and SO32- Using Ab Initio Molecular Orbital Calculations","Inorganic Chemistry","1999","38","","733","737","10.1021/ic981173g","","","0.7107","MoKalpha","","0.0372","0.0299","","0.038","0.0324","","","","","2.543","2.543","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321796","15.177","0.004","28.17","0.008","17.21","0.006","90","","90","","90","","7358","4","298","","298","","","","","","","","","6","C c m m","-C 2c 2c","63","","","","- C49 H84 Cl2 Cu2 N10 O14 -","- C49 H80 Cl2 Cu2 N10 O13.92 -","- C196 H320 Cl8 Cu8 N40 O55.68 -","4","0.25","","Carla Bazzicalupi; Andrea Bencini; Antonio Bianchi; Vieri Fusi; Enrique Garcia-España; Claudia Giorgi; José M. Llinares; José Antonio Ramirez; Barbara Valtancoli","Molecular Recognition of Long Dicarboxylate/Dicarboxylic Species via Supramolecular/Coordinative Interactions with Ditopic Receptors. Crystal Structure of {[Cu2L(H2O)2]-Pimelate}(ClO4)2","Inorganic Chemistry","1999","38","","620","621","10.1021/ic9812151","","","0.71069","MoKα","","0.2597","0.1138","","0.435","0.2863","","","","0.974","1.196","1.196","","","","","has coordinates","179320","2020-10-21","18:00:00",""
"4321797","8.9041","0.0006","19.6838","0.0012","14.3184","0.0009","90","","106.523","0.001","90","","2405.9","0.3","293","","293","","","","","","","","","7","P 1 21 1","P 2yb","4","","4b","","- C54 H49 N O4 P2 Pt S -","- C55 H49 N O5 P2 Pt S -","- C110 H98 N2 O10 P4 Pt2 S2 -","2","1","","Jennifer J. Becker; Peter S. White; Michel R. Gagné","Synthesis and Characterization of Chiral Platinum(II) Sulfonamides: (dppe)Pt(NN) and (dppe)Pt(NO) Complexes","Inorganic Chemistry","1999","38","","798","801","10.1021/ic981287s","","","0.7093","MolybdenumKα","","0.039","0.034","","0.045","0.036","","","","","2.07","2.07","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321798","13.5266","0.0008","14.9709","0.0009","21.9952","0.0013","90","","90","","90","","4454.1","0.5","293","","293","","","","","","","","","9","P 21 21 21","P 2ac 2ab","19","","2a","","- C43 H38 Cl2 F6 N2 O4 P2 Pt S2 -","- C43 H38 Cl2 F6 N2 O4 P2 Pt S2 -","- C172 H152 Cl8 F24 N8 O16 P8 Pt4 S8 -","4","1","","Jennifer J. Becker; Peter S. White; Michel R. Gagné","Synthesis and Characterization of Chiral Platinum(II) Sulfonamides: (dppe)Pt(NN) and (dppe)Pt(NO) Complexes","Inorganic Chemistry","1999","38","","798","801","10.1021/ic981287s","","","0.7093","MolybdenumKα","","0.032","0.029","","0.025","0.025","","","","","1.66","1.66","","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321799","11.339","0.002","11.339","0.002","30.489","0.006","90","","90","","90","","3920.1","1.2","153.2","","153.2","","","","","","","","hydro(solvo)thermal synthesis","7","I 41 2 2","I 4bw 2bw","98","","","","- C30 H32 Cu F8 N6 O4 W2 -","- C28 H18 Cu0.25 F7 N4 O3 W -","- C112 H72 Cu F28 N16 O12 W4 -","4","0.25","","Kevin R. Heier; Alexander J. Norquist; P. Shiv Halasyamani; Angel Duarte; Charlotte L. Stern; Kenneth R. Poeppelmeier","The Polar [WO2F4]2- Anion in the Solid State","Inorganic Chemistry","1999","38","","762","767","10.1021/ic980863h","","","0.7107","MoKα","","0.0364","0.036","","0.029","","0.029","","","1.461","","","1.46","","","","has coordinates","134363","2020-10-21","18:00:00",""
"4321800","9.745","0.001","9.745","0.001","16.565","0.003","90","","90","","90","","1573.1","0.4","153","","153.2","","","","","","","","hydro(solvo)thermal synthesis","7","I 4/m c m","-I 4 2c","140","","","","- C12 H14 Cu F4 N6 O3 W -","- C10 Cu0.125 F1.75 N2.5 O0.875 W0.125 -","- C40 Cu0.5 F7 N10 O3.5 W0.5 -","4","0.125","","Kevin R. Heier; Alexander J. Norquist; P. Shiv Halasyamani; Angel Duarte; Charlotte L. Stern; Kenneth R. Poeppelmeier","The Polar [WO2F4]2- Anion in the Solid State","Inorganic Chemistry","1999","38","","762","767","10.1021/ic980863h","","","0.7107","MoKα","","0.0381","0.038","","0.043","","0.043","","","3.145","","","3.15","","","","has coordinates","134363","2020-10-21","18:00:00",""
"4321801","17.8819","0.0003","6.919","0.0001","8.6972","0.0001","90","","96.72","0.001","90","","1068.67","0.03","298","","298","","","","","","","","synthesis","4","P 1 21/c 1","-P 2ybc","14","","N-phenylpiperazine/copper(I) cyanide complex","","- C11 H14 Cu N3 -","- C11 H14 Cu N3 -","- C44 H56 Cu4 N12 -","4","1","","Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton","Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines","Inorganic Chemistry","1999","38","","984","991","10.1021/ic970226b","","","0.71073","MoKalpha","","","0.028","","","0.038","","","","","1.5","1.5","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321802","9.439","0.003","10.561","0.002","8.87","0.003","90","","98.32","0.03","90","","874.9","0.4","297","","297","","","","","","","","systhesis","4","C 1 2/c 1","-C 2yc","15","","copper(I) cyanide/piperazine complex","","- C6 H10 Cu2 N4 -","- C4 H10 Cu2 N6 -","- C16 H40 Cu8 N24 -","4","0.5","","Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton","Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines","Inorganic Chemistry","1999","38","","984","991","10.1021/ic970226b","","","0.71073","MoKalpha","","","0.029","","","0.032","","","","","1.27","1.27","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321803","20.573","0.009","8.354","0.002","15.989","0.006","90","","133.7","","90","","1986.7","1.2","297","","297","","","","","","","","synthesis","4","C 1 2/c 1","-C 2yc","15","","copper(I) cyanide/hydrogen cyanide/piperazine complex","","- C7 H11 Cu2 N5 -","- C7 H11 Cu2 N5 -","- C56 H88 Cu16 N40 -","8","1","","Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton","Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines","Inorganic Chemistry","1999","38","","984","991","10.1021/ic970226b","","","0.71073","MoKalpha","","","0.043","","","0.039","","","","","1.26","1.26","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321804","8.669","0.003","5.55","0.001","10.456","0.002","90","","106.8","0.02","90","","481.6","0.2","297","","297","","","","","","","","synthesis","4","P 1 21/a 1","-P 2yab","14","","copper(I) cyanide/1,4-butanediamine complex","","- C6 H12 Cu2 N4 -","- C6 H12 Cu2 N4 -","- C12 H24 Cu4 N8 -","2","0.5","","Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton","Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines","Inorganic Chemistry","1999","38","","984","991","10.1021/ic970226b","","","0.71073","MoKalpha","","","0.028","","","0.031","","","","","1.13","1.13","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321805","16.297","0.003","26.267","0.003","16.296","0.002","90","","90.2","0.01","90","","6975.8","1.7","298","","23","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H32 Cd3 N6 O8 S6 -","- C22 H32 Cd3 N6 O8 S6 -","- C176 H256 Cd24 N48 O64 S48 -","8","1","","Hong Zhang; Ximin Wang; H. Zhu; W. Xiao; Kecong Zhang; Boon K. Teo","Anisotropic Templating Effect in the Formation of Two-Dimensional Anionic Cadmium-Thiocyanate Coordination Solids [(12C4)2Cd][Cd2(SCN)6] and [(12C4)2Cd][Cd3(SCN)8] with Checkerboard and Herringbone Patterns, Respectively","Inorganic Chemistry","1999","38","","886","892","10.1021/ic980387v","","","0.7107","MoKalpha","","","0.039","","","0.041","","","","","2.97","2.97","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321806","11.723","0.0004","16.5951","0.0006","27.8526","0.001","90","","90","","90","","5418.6","0.3","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C54 H56 Cl8 Fe2 N2 P2 Ru -","- C54 H56 Cl8 Fe2 N2 P2 Ru -","- C216 H224 Cl32 Fe8 N8 P8 Ru4 -","4","1","","Jeong-Ho Song; Dong-Jei Cho; Sang-Jin Jeon; Yong-Hoon Kim; Tae-Jeong Kim; Jong Hwa Jeong","Synthesis of Chiral C2-Symmetric Bisferrocenyldiamines. X-ray Crystal Structure of Ru(2)Cl2.2CHCl3 (2 = N1,N2-Bis{(R)-1-[(S)-2-(diphenylphosphino)]ferrocenylethyl}- N1,N2-dimethyl-1,2-ethanediamine)","Inorganic Chemistry","1999","38","","893","896","10.1021/ic980433r","","","0.71073","MoKα","","0.059","0.0548","","","0.1233","0.1257","","","","","","1.089","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321807","5.579","0.001","13.918","0.001","18.737","0.002","111.41","","96.55","0.01","91.12","0.01","1342.7","0.3","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","","","- C4 H11 B N2 -","- C4 H11 B N2 -","- C32 H88 B8 N16 -","8","4","","Wendy C. Andersen; Daniel R. Mitchell; Kenneth J. H. Young; Xianhui Bu; Vincent M. Lynch; Hermann A. Mayer; William C. Kaska","The Synthesis, X-ray Crystal Structure, and Molecular Structure of Rhenium Tetra-carbonylbromidetrimethylamineisocyanoborane","Inorganic Chemistry","1999","38","","1024","1027","10.1021/ic980697d","","","0.71073","MoKα","","0.3054","0.094","","0.19","0.1146","","","","1.018","1.374","1.374","","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321808","12.624","0.004","14.24","0.02","27.312","0.003","92.35","0.03","91.655","0.015","90.28","0.05","4903","7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C88 H112 Cl2 N10 O2 P2 Pt4 -","- C88 H108 Cl2 N10 O2 P2 Pt4 -","- C176 H216 Cl4 N20 O4 P4 Pt8 -","2","1","","Tianle Zhang; Marc Drouin; Pierre D. Harvey","Preparation, Characterization, and Luminescence Properties of a 58-Electron Linear Pt4 Cluster, [Pt4(dmb)4(PPh3)2]2+ (dmb = 1,8-Diisocyano-p-menthane), and Its Diphosphine Polymers","Inorganic Chemistry","1999","38","","957","963","10.1021/ic9807947","","","1.5406","CuKa","","0.0822","0.0738","","","0.2097","0.2199","","","","","","1.018","","","","has coordinates,has disorder","179321","2020-10-21","18:00:00",""
"4321809","13.268","0.001","29.472","0.001","18.765","0.001","90","","95.93","","90","","7298.5","0.7","100","2","100","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C88.66 H57.66 Cl1.98 N9 O Ru -","- C88 H57 N9 O Ru -","- C352 H228 N36 O4 Ru4 -","4","1","","Enzo Alessio; Silvano Geremia; Stefano Mestroni; Elisabetta Iengo; Ivana Srnova; Miroslav Slouf","Solution and Solid State Structure of a Canted, Side-to-Face, Bis(porphyrin) Adduct","Inorganic Chemistry","1999","38","","869","875","10.1021/ic980816p","","","0.8","synchrotron","","0.0474","0.0392","","","0.1214","0.1325","","","","","","1.043","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321810","9.942","0.002","7.454","0.002","10.297","0.003","90","0.03","111.27","0.02","90","0.03","711.1","0.3","125","2","125","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Methyl-fluoromethylidene-oxonium-hexafluoroantimonate","","- C2 H4 F7 O Sb -","- C2 H4 F7 O Sb -","- C8 H16 F28 O4 Sb4 -","4","1","","Rolf Minkwitz; Stefan Reinemann; Oliver Blecher; Hans Hartl; Irene Brüdgam","Halogenated Carboxonium Salts: Preparation and Structural Analysis","Inorganic Chemistry","1999","38","","844","847","10.1021/ic981212o","","","0.71073","MoKα","","0.0516","0.0471","","0.1515","0.1446","","","","1.196","1.218","1.218","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321811","5.97","0.003","12.019","0.005","10.994","0.005","90","0.03","92.59","0.03","90","0.03","788.1","0.6","125","2","125","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Methyl-chloromethylidene-oxonium-hexafluoroantimonate","","- C2 H4 Cl F6 O Sb -","- C2 H4 Cl F6 O Sb -","- C8 H16 Cl4 F24 O4 Sb4 -","4","1","","Rolf Minkwitz; Stefan Reinemann; Oliver Blecher; Hans Hartl; Irene Brüdgam","Halogenated Carboxonium Salts: Preparation and Structural Analysis","Inorganic Chemistry","1999","38","","844","847","10.1021/ic981212o","","","0.71073","MoKα","","0.0439","0.0419","","0.1372","0.1344","","","","1.141","1.146","1.146","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321812","8.714","0.003","8.714","0.003","8.083","0.004","90","","90","","120","","531.5","0.4","297","","297","","","","","","","","systhesis","4","P 63","P 6c","173","","hydrogen cyanide/copper(I) cyanide/diazobicyclooctane complex","","- C9 H13 Cu2 N5 -","- C9 H6 Cu2 N5 -","- C18 H12 Cu4 N10 -","2","0.333333","","Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton","Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines","Inorganic Chemistry","1999","38","","984","991","10.1021/ic970226b","","","0.71073","MoKalpha","","","0.03","","","0.038","","","","","1.76","1.76","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321813","8.812","0.003","9.631","0.002","7.266","0.003","90","","113.4","0.03","90","","565.9","0.3","297","","297","","","","","","","","synthesis","4","C 1 2/m 1","-C 2y","12","","copper(I) cyanide/dimethylpiperazine complex","","- C8 H14 Cu2 N4 -","- C6 H18 Cu2 N6 -","- C12 H36 Cu4 N12 -","2","0.25","","Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton","Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines","Inorganic Chemistry","1999","38","","984","991","10.1021/ic970226b","","","0.71073","MoKalpha","","","0.033","","","0.039","","","","","1.35","1.35","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321814","11.889","0.004","33.38","0.008","9.012","0.003","90","","90","","90","","3576.5","1.9","297","","297","","","","","","","","synthesis","4","C m c 21","C 2c -2","36","","N,N,N',N'-tetramethylethylenediamine/copper(I) cyanide complex","","- C8 H16 Cu2 N4 -","- C8 H16 Cu2 N4 -","- C96 H192 Cu24 N48 -","12","1.5","","Fred B. Stocker; Teodora P. Staeva; Chad M. Rienstra; Doyle Britton","Crystal Structures of a Series of Complexes Produced by Reaction of Copper(I) Cyanide with Diamines","Inorganic Chemistry","1999","38","","984","991","10.1021/ic970226b","","","0.71073","MoKalpha","","","0.068","","","0.057","","","","","1.4","1.4","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321815","11.604","0.007","11.366","0.007","15.736","0.004","90","","92.84","0.03","90","","2072.9","1.9","23","","23","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H32 Cd4 N8 O8 S8 -","- C23 H32 Cd3 N8 O8 S8 -","- C46 H64 Cd6 N16 O16 S16 -","2","0.5","","Hong Zhang; Ximin Wang; H. Zhu; W. Xiao; Kecong Zhang; Boon K. Teo","Anisotropic Templating Effect in the Formation of Two-Dimensional Anionic Cadmium-Thiocyanate Coordination Solids [(12C4)2Cd][Cd2(SCN)6] and [(12C4)2Cd][Cd3(SCN)8] with Checkerboard and Herringbone Patterns, Respectively","Inorganic Chemistry","1999","38","","886","892","10.1021/ic980387v","","","0.7107","MoKα","","","0.03","","","0.031","","","","","1.19","1.19","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321816","9.435","0.007","17.917","0.011","15.449","0.01","90","","106.77","0.06","90","","2501","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 Cl3 La N4 Ni O3 -","- C23 H24 Cl3 La N4 Ni O3 -","- C92 H96 Cl12 La4 N16 Ni4 O12 -","4","1","","Jerzy Lisowski; Przemysław Starynowicz","Heterodinuclear Macrocyclic Complexes Containing Both Nickel(II) and Lanthanide(III) Ions","Inorganic Chemistry","1999","38","","1351","1355","10.1021/ic971416p","","","0.71073","MoKα","","0.0422","0.0299","","0.0645","0.0627","","","","2.574","2.749","2.749","","","","","has coordinates,has disorder","179321","2020-10-21","18:00:00",""
"4321817","10.5429","0.0004","11.6345","0.0005","11.7303","0.0005","110.116","0.001","100.445","0.001","104.339","0.001","1251.58","0.09","296","","296","","","","","","","","","6","P -1","-P 1","2","[In4(4,4'-bipy)3(HPO4)4(H2PO4)4].4H2O","","","- C30 H44 In4 N6 O36 P8 -","- C30 In4 N6 O36 P8 -","- C30 In4 N6 O36 P8 -","1","0.5","","Kwang-Hwa Lii; Yuh-Feng Huang","Synthesis and Structures of [In4(4,4'-bipy)3(HPO4)4(H2PO4)4].4H2O and In4(4,4'-bipy)3(HPO4)4(H2PO4)4, Indium Phosphates with a Pillared Layer Structure","Inorganic Chemistry","1999","38","","1348","1350","10.1021/ic9715106","","","0.71073","MoKα","","0.0867","0.0517","","0.1163","0.1034","","","","1.048","1.119","1.119","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321818","10.431","0.0002","11.4723","0.0002","11.7779","0.0002","112.263","0.001","99.093","0.001","102.318","0.001","1229.06","0.04","296","","296","","","","","","","","","6","P -1","-P 1","2","[In4(4,4'-bipy)3(HPO4)4(H2PO4)4]","","","- C30 H36 In4 N6 O32 P8 -","- C30 In4 N6 O32 P8 -","- C30 In4 N6 O32 P8 -","1","0.5","","Kwang-Hwa Lii; Yuh-Feng Huang","Synthesis and Structures of [In4(4,4'-bipy)3(HPO4)4(H2PO4)4].4H2O and In4(4,4'-bipy)3(HPO4)4(H2PO4)4, Indium Phosphates with a Pillared Layer Structure","Inorganic Chemistry","1999","38","","1348","1350","10.1021/ic9715106","","","0.71073","MoKα","","0.1087","0.0702","","0.1864","0.1661","","","","1.007","1.119","1.119","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321819","16.6579","0.0001","12.6628","0.0002","22.552","0.0003","90","","96.42","0.01","90","","4727.19","0.14","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H42 In P3 S3 -","- C54 H42 In P3 S3 -","- C216 H168 In4 P12 S12 -","4","1","","Paulo Pérez-Lourido; Jaime Romero; José Arturo García-Vázquez; Antonio Sousa; Kevin Maresca; Jon Zubieta","Synthesis and Characterization of Indium Compounds with Phosphinothiol Ligands. The Crystal and Molecular Structures of [In{2-(Ph2P)C6H4S}3], [In{2-(Ph2P)-6-(Me3Si)C6H3S}2{2-(Ph2PO)-6-(Me3Si)C6H3S}], and [NMe4][In{PhP(C6H4S-2)2}2].CH3CN","Inorganic Chemistry","1999","38","","1293","1298","10.1021/ic980282s","","","0.71073","MoKα","","","0.0579","","0.1522","0.1392","","","","1.03","1.107","1.107","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321820","13.0052","0.0002","11.224","0.0002","14.307","0.0003","90","","93.19","0.001","90","","2085.16","0.07","298","2","298","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C42 H41 In N2 P2 S4 -","- C42 H41 In N2 P2 S4 -","- C84 H82 In2 N4 P4 S8 -","2","1","","Paulo Pérez-Lourido; Jaime Romero; José Arturo García-Vázquez; Antonio Sousa; Kevin Maresca; Jon Zubieta","Synthesis and Characterization of Indium Compounds with Phosphinothiol Ligands. The Crystal and Molecular Structures of [In{2-(Ph2P)C6H4S}3], [In{2-(Ph2P)-6-(Me3Si)C6H3S}2{2-(Ph2PO)-6-(Me3Si)C6H3S}], and [NMe4][In{PhP(C6H4S-2)2}2].CH3CN","Inorganic Chemistry","1999","38","","1293","1298","10.1021/ic980282s","","","0.71073","MoKα","","0.0381","0.0352","","0.0929","0.0869","","","","1.122","1.1","1.1","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321821","11.027","0.001","14.226","0.004","16.143","0.002","87.19","0.02","73.42","0.01","80.47","0.01","2393.6","0.8","293","2","293","2","","","","","","","synthesis","7","P -1","-P 1","2","\5-Cyclodiphosphazanes","","","- C40 H37 Br Cl8 N3 O7 P3 -","- C40 H37 Br Cl8 N3 O7 P3 -","- C80 H74 Br2 Cl16 N6 O14 P6 -","2","1","","Natesan Thirupathi; Setharampattu S. Krishnamurthy; Munirathinam Nethaji","Oxidative Addition of Tetrachloro-1,2-benzoquinone to λ3-Cyclotriphosphazanes. An Unusual Ring Contraction-Rearrangement","Inorganic Chemistry","1999","38","","1093","1098","10.1021/ic980459i","","","0.71073","MoKa","","0.1929","0.0784","","0.1934","0.1369","","","","1.13","1.243","1.243","","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321822","14.2168","0.0014","14.354","0.0017","18.679","0.002","81.101","0.01","67.763","0.009","89.107","0.009","3482","0.7","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H15 Cd K O3 -","- C16.875 H27.75 Cd0.25 K0.25 O2.375 -","- C135 H222 Cd2 K2 O19 -","8","4","","Donald J. Darensbourg; Sharon A. Niezgoda; Jennifer D. Draper; Joseph H. Reibenspies","trigonal-Planar Zinc(II) and Cadmium(II) Tris(phenoxide) Complexes","Inorganic Chemistry","1999","38","","1356","1359","10.1021/ic9805325","","","0.71073","MoKα","","0.093","0.0675","","","0.168","0.1791","","","","","","1.381","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321823","10.55","0.002","15.763","0.003","16.353","0.003","83.94","0.03","79.975","0.015","83.97","0.03","2652.6","0.9","160","2","160","2","","","","","","","","7","P -1","-P 1","2","","bis-(mu!2$-pyrazolate-N,N')-carbonyl-iodo-trimethylphosphite-rhodium(ii))","","- C14 H24 I2 N4 O8 P2 Rh2 -","- C14 H24 I2 N4 O8 P2 Rh2 -","- C56 H96 I8 N16 O32 P8 Rh8 -","4","2","","Cristina Tejel; Marta Bordonaba; Miguel A. Ciriano; Andrew J. Edwards; William Clegg; Fernando J. Lahoz; Luis A. Oro","Oxidative-Addition Reactions of Diiodine to Dinuclear Rhodium Pyrazolate Complexes","Inorganic Chemistry","1999","38","","1108","1117","10.1021/ic980650s","","","0.71073","MoKα","","0.0834","0.0494","","","0.104","0.118","","","","","","1.016","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321824","11.3869","0.0009","16.2642","0.0013","16.5072","0.0014","95.34","0.002","96.41","0.002","110.191","0.002","2822.8","0.4","160","2","160","2","","","","","","","","7","P -1","-P 1","2","","(mu!2$-pyrazolate-N,N')-(mu!2$-carbonyl)-(carbonyl-iodo-tritolylphosphine rhodium(iii))-(iodo-tritolylphosphine-rhodium(iii)) diethylether solvate","","- C52 H53 I2 N4 O2.5 P2 Rh2 -","- C52 H53 I2 N4 O2.5 P2 Rh2 -","- C104 H106 I4 N8 O5 P4 Rh4 -","2","1","","Cristina Tejel; Marta Bordonaba; Miguel A. Ciriano; Andrew J. Edwards; William Clegg; Fernando J. Lahoz; Luis A. Oro","Oxidative-Addition Reactions of Diiodine to Dinuclear Rhodium Pyrazolate Complexes","Inorganic Chemistry","1999","38","","1108","1117","10.1021/ic980650s","","","0.71073","MoKα","","0.0885","0.0504","","","0.1131","0.1289","","","","","","1.019","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321825","11.8522","0.0005","13.4689","0.0006","25.3911","0.0011","90","","90","","90","","4053.3","0.3","160","2","160","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","(mu!2$-iodo)-bis(mu!2$-pyrazolate-N,N')-bis(carbonyl-iodo-dimethyl phenylphosphine-rhodium(iii)) pentaiodide","","- C24 H28 I8 N4 O2 P2 Rh2 -","- C24 H28 I8 N4 O2 P2 Rh2 -","- C96 H112 I32 N16 O8 P8 Rh8 -","4","1","","Cristina Tejel; Marta Bordonaba; Miguel A. Ciriano; Andrew J. Edwards; William Clegg; Fernando J. Lahoz; Luis A. Oro","Oxidative-Addition Reactions of Diiodine to Dinuclear Rhodium Pyrazolate Complexes","Inorganic Chemistry","1999","38","","1108","1117","10.1021/ic980650s","","","0.71073","MoKα","","0.0437","0.0359","","","0.0856","0.0896","","","","","","1.047","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321826","29.7648","0.0003","14.6496","0.0001","21.762","0.0003","90","","123.397","0.001","90","","7922.27","0.17","298","2","298","2","","","","","","","","8","C 1 c 1","C -2yc","9","[PPN]~2~[Fe~3~(CO)~9~(μ~3~,η^2^-SO~2~)]","Di-(Bis-triphenylphosphonium iminium)(nona-carbonyl-μ~3~,η^2^-sulfur dioxide tri-ferrate)","","- C81.5 H61 Cl Fe3 N2 O11 P4 S -","- C81.5 H61 Cl Fe3 N2 O11 P4 S -","- C326 H244 Cl4 Fe12 N8 O44 P16 S4 -","4","1","","Randal W. Eveland; Casey C. Raymond; T. E. Albrecht-Schmitt; Duward F. Shriver","New SO~2~ Iron-Containing Cluster Compounds [PPN]~2~[Fe~3~(CO)~9~(μ~3~,η^2^-SO~2~)], [PPN]~2~[Fe~3~(CO)~8~(μ-SO2)μ~3~-S], [PPN]~2~[Fe~3~(CO)~8~(μ-SO~2~)(μ~3~-CCO)], and [PPN]~2~[Fe~2~(CO)~6~(μ-SO~2~)~2~] From Heterometal Precursors.","Inorganic Chemistry","1999","38","","1282","1287","10.1021/ic980762j","","","0.71073","MoKα","","0.0656","0.0505","","0.125","0.118","","","","1.432","1.51","1.51","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321827","10.0295","0.0005","26.3564","0.0013","14.1032","0.0007","90","","94.6914","0.001","90","","3715.6","0.3","153","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","[PPN]~2~[Fe~2~(CO)~6~(μ-SO~2~)~2~]","Di-(Bis-triphenylphosphonium iminium)(hexacarbonyl μ-sulfur dioxide diferrate)","","- C80 H63 Fe2 N3 O10 P4 S2 -","- C80 H63 Fe2 N3 O10 P4 S2 -","- C160 H126 Fe4 N6 O20 P8 S4 -","2","1","","Randal W. Eveland; Casey C. Raymond; T. E. Albrecht-Schmitt; Duward F. Shriver","New SO~2~ Iron-Containing Cluster Compounds [PPN]~2~[Fe~3~(CO)~9~(μ~3~,η^2^-SO~2~)], [PPN]~2~[Fe~3~(CO)~8~(μ-SO2)μ~3~-S], [PPN]~2~[Fe~3~(CO)~8~(μ-SO~2~)(μ~3~-CCO)], and [PPN]~2~[Fe~2~(CO)~6~(μ-SO~2~)~2~] From Heterometal Precursors.","Inorganic Chemistry","1999","38","","1282","1287","10.1021/ic980762j","","","0.71069","MoKα","","0.0889","0.0663","","","0.1717","0.1825","","","","","","0.996","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321828","8.187","0.005","17.193","0.004","10.9","0.003","90","","109.68","0.04","90","","1444.7","1.1","295","","295","","","","","","","","?","6","P 1 21/m 1","-P 2yb","11","","","","- C27 H40 B F4 Ir O6 -","- C27 B F4 Ir O6 -","- C54 B2 F8 Ir2 O12 -","2","0.5","","H. Amouri; J. Vaissermann; M. N. Rager; Y. Besace","Unusual Me-O Bond Cleavage in a Metalated Crown-Ether: X-ray Molecular Structure of (5-Methoxy-4,6-dimethyl-1,3-xylylene-2-one)-15 Crown-4 Complex of Pentamethylcyclopentadienyl Iridium","Inorganic Chemistry","1999","38","","1211","1215","10.1021/ic980811s","","","0.71069","MoKα","","","0.0356","","","0.0433","","","","","3.8","3.8","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321829","15.415","0.005","9.616","0.006","21.659","0.004","90","","109.91","0.02","90","","3019","2","296.2","","296.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H30 Ag3 N S6 W2 -","- C21 H30 Ag3 N S6 W2 -","- C84 H120 Ag12 N4 S24 W8 -","4","1","","Jian-Ping Lang; Kazuyuki Tatsumi","Aggregation of the Half-Sandwich Trisulfido Complex of Tungsten with Silver Ions: Synthesis of a Cyanide-Bridged Helical Polymer {[(η5-C5Me5)WS3]2Ag3(CN)}∞and a Cyclic Cluster [(η5-C5Me5)WS3Ag]4","Inorganic Chemistry","1999","38","","1364","1367","10.1021/ic980883j","","","0.7107","MoKα","","0","0","","","0","0.0542","","","","","","1.526","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321830","17.824","0.005","17.824","0.005","8.558","0.003","90","","90","","90","","2718.8","1.4","296.2","","296.2","","","","","","","","","5","P -4 21 c","P -4 2n","114","","","","- C10 H15 Ag S3 W -","- C10 H15 Ag S3 W -","- C80 H120 Ag8 S24 W8 -","8","1","","Jian-Ping Lang; Kazuyuki Tatsumi","Aggregation of the Half-Sandwich Trisulfido Complex of Tungsten with Silver Ions: Synthesis of a Cyanide-Bridged Helical Polymer {[(η5-C5Me5)WS3]2Ag3(CN)}∞and a Cyclic Cluster [(η5-C5Me5)WS3Ag]4","Inorganic Chemistry","1999","38","","1364","1367","10.1021/ic980883j","","","0.7107","MoKα","","0","0","","","0","0.0732","","","","","","2.45","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321831","30.4228","0.0007","18.372","0.0005","32.3758","0.0008","90","","95.857","0.001","90","","18001.3","0.8","198","2","198","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H162 As24 Cl6 S52 Zn16 -","- C56 H162 As24 Cl6 S52 Zn16 -","- C224 H648 As96 Cl24 S208 Zn64 -","4","1","","Alberto Albinati; Maurizio Casarin; Chiara Maccato; Luciano Pandolfo; Andrea Vittadini","Experimental and Theoretical Investigation of the Molecular and Electronic Structure of [Zn4(μ4-S){μ-S2As(CH3)2}6] and [Cd4(μ4-S){μ-S2As(CH3)2}6]: Two Possible Molecular Models of Extended Metal Chalcogenide Semiconductors","Inorganic Chemistry","1999","38","","1145","1152","10.1021/ic980914a","","","0.71073","MoKα","","0.0702","0.0424","","","0.1074","0.1305","","","","","","0.866","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321832","10.907","0.003","6.0677","0.0013","21.62","0.005","90","","90.542","0.004","90","","1430.8","0.6","120","2","293","2","","","","","","","Hydrothermal reaction of copper (I) bromide, copper(II) bromide, and (2,2')-dipyridyl","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H9 Br3 Cu3 N2 O -","- C10 H9 Br3 Cu3 N2 O -","- C40 H36 Br12 Cu12 N8 O4 -","4","1","","Robert P. Hammond; Michael Cavaluzzi; Robert C. Haushalter; Jon A. Zubieta","Investigations of the Copper Bromide-2,2'-Dipyridyl System: Hydrothermal Synthesis and Structural Characterization of Molecular Cu3Br4(C10H8N2)2, One-Dimensional CuBr2(C10H8N2), and Two-Dimensional [Cu2(OH)2(C10H8N2)2][Cu4Br6]","Inorganic Chemistry","1999","38","","1288","1292","10.1021/ic980997v","","","0.71073","MoKα","","0.0622","0.037","","0.0786","0.0718","","","","0.986","1.064","1.064","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321833","10.604","0.002","11.642","0.003","11.688","0.003","61.965","0.005","68.346","0.005","69.523","0.005","1156","0.5","120","2","120","2","","","","","","","Hydrothermal reaction of copper (I) bromide, copper(II) bromide, and (2,2')-dipyridyl","5","P -1","-P 1","2","","","","- C20 H16 Br4 Cu3 N4 -","- C20 H16 Br4 Cu3 N4 -","- C40 H32 Br8 Cu6 N8 -","2","1","","Robert P. Hammond; Michael Cavaluzzi; Robert C. Haushalter; Jon A. Zubieta","Investigations of the Copper Bromide-2,2'-Dipyridyl System: Hydrothermal Synthesis and Structural Characterization of Molecular Cu3Br4(C10H8N2)2, One-Dimensional CuBr2(C10H8N2), and Two-Dimensional [Cu2(OH)2(C10H8N2)2][Cu4Br6]","Inorganic Chemistry","1999","38","","1288","1292","10.1021/ic980997v","","","0.71073","MoKα","","0.0582","0.0408","","0.0947","0.0877","","","","1.051","1.092","1.092","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321834","16.766","0.004","9.287","0.002","7.392","0.002","90","","110.536","0.006","90","","1077.8","0.5","120","2","120","2","","","","","","","Hydrothermal reaction of copper (I) bromide, copper(II) bromide, and (2,2')-dipyridyl","5","C 1 2/c 1","-C 2yc","15","","","","- C5 H4 Br Cu0.5 N -","- C5 H4 Br Cu0.5 N -","- C40 H32 Br8 Cu4 N8 -","8","1","","Robert P. Hammond; Michael Cavaluzzi; Robert C. Haushalter; Jon A. Zubieta","Investigations of the Copper Bromide-2,2'-Dipyridyl System: Hydrothermal Synthesis and Structural Characterization of Molecular Cu3Br4(C10H8N2)2, One-Dimensional CuBr2(C10H8N2), and Two-Dimensional [Cu2(OH)2(C10H8N2)2][Cu4Br6]","Inorganic Chemistry","1999","38","","1288","1292","10.1021/ic980997v","","","0.71073","MoKα","","0.0423","0.0351","","0.089","0.0861","","","","1.035","1.074","1.074","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321835","12.516","0.002","21.327","0.003","22.764","0.003","90","","98.281","0.013","90","","6013","1.5","130","2","130","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C57 H56 Cl11 N4 O4 Zn -","- C57 H48 Cl11 N4 O4 Zn -","- C228 H192 Cl44 N16 O16 Zn4 -","4","1","","Noëlle Ehlinger; W. Robert Scheidt","Structure and Apparent Reactivity of the π-Cation Radical Derivatives of Zinc and Copper 5,10,15,20-Tetra(2,6-dichlorophenyl)porphyrinate","Inorganic Chemistry","1999","38","","1316","1321","10.1021/ic981041n","","","0.71073","MoKα","","0.098","0.0742","","","0.1834","0.2033","","","","","","1.053","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321836","14.7625","0.0018","12.22","0.002","33.672","0.005","90","","90","","90","","6074.4","1.5","130","2","130","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C64 H36 Cl12 Cu N4 O4 S2 -","- C64 H36 Cl12 Cu N4 O4 S2 -","- C256 H144 Cl48 Cu4 N16 O16 S8 -","4","1","","Noëlle Ehlinger; W. Robert Scheidt","Structure and Apparent Reactivity of the π-Cation Radical Derivatives of Zinc and Copper 5,10,15,20-Tetra(2,6-dichlorophenyl)porphyrinate","Inorganic Chemistry","1999","38","","1316","1321","10.1021/ic981041n","","","0.71073","MoKα","","0.2084","0.1185","","","0.2137","0.2656","","","","","","1.09","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321837","9.941","0.002","11.615","0.002","14.34","0.003","99.11","0.03","103.27","0.03","106.61","0.03","1499.1","0.7","130","2","130","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H48 Cl8 I4 N4 O4 Zn -","- C60 H48 Cl8 I4 N4 O4 Zn -","- C60 H48 Cl8 I4 N4 O4 Zn -","1","0.5","","Noëlle Ehlinger; W. Robert Scheidt","Structure and Apparent Reactivity of the π-Cation Radical Derivatives of Zinc and Copper 5,10,15,20-Tetra(2,6-dichlorophenyl)porphyrinate","Inorganic Chemistry","1999","38","","1316","1321","10.1021/ic981041n","","","0.71073","MoKα","","0.2453","0.1178","","","0.254","0.3356","","","","","","1.013","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321838","22.384","0.004","13.827","0.004","22.186","0.003","90","","90.7","0.02","90","","6866","3","293","2","293","2","","","","","","","","7","C 1 2 1","C 2y","5","","bis[tris(2,2'-bipyridine)osmium(II)] [hexacyanochromate(III)] chloride octahydrate","","- C66 H48 Cl Cr N18 O8 Os2 -","- C66 H48 Cl Cr N18 O8 Os2 -","- C264 H192 Cl4 Cr4 N72 O32 Os8 -","4","1","","Takuhiro Otsuka; Naoto Takahashi; Naoki Fujigasaki; Akiko Sekine; Yuji Ohashi; Youkoh Kaizu","Crystal Structure and Energy Transfer in Double-Complex Salts Composed of Tris(2,2'-bipyridine)ruthenium(II) or Tris(2,2'-bipyridine)osmium(II) and Hexacyanochromate(III)","Inorganic Chemistry","1999","38","","1340","1347","10.1021/ic9810541","","","0.71073","MoKα","","0.0812","0.0788","","0.2075","0.193","","","","1.072","1.072","1.072","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321839","13.8831","0.0001","16.7261","0.0002","18.7014","0.0002","110.234","0.0004","97.9111","0.0006","102.531","0.0006","3868.89","0.07","298","2","298","2","","","","","","","","8","P -1","-P 1","2","","","","- C75 H63 F3 Mn4 N O19 P6 S -","- C75 H63 F3 Mn4 N O19 P6 S -","- C150 H126 F6 Mn8 N2 O38 P12 S2 -","2","1","","Wolfgang F. Ruettinger; Douglas M. Ho; G. Charles Dismukes","Protonation and Dehydration Reactions of the Mn4O4L6 Cubane and Synthesis and Crystal Structure of the Oxidized Cubane [Mn4O4L6]+: A Model for the Photosynthetic Water Oxidizing Complex","Inorganic Chemistry","1999","38","","1036","1037","10.1021/ic981145y","","","0.71074","MoKα","","0.0604","0.0403","","0.1155","0.094","","","","1.041","0.984","0.984","","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321840","13.773","0.002","8.245","0.002","13.861","0.002","90","","110.1","0.01","90","","1478.2","0.5","20","","20","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 Cl2 Cu N4 O -","- C48 H56 Cl8 Cu4 N16 O4 -","- C48 H56 Cl8 Cu4 N16 O4 -","","","","Naohide Matsumoto; Yuri Motoda; Toshihiro Matsuo; Toshio Nakashima; Nazzareno Re; Francoise Dahan; Jean-Pierre Tuchagues","pH-Dependent Monomer \λeftarrow→Oligomer Interconversion of Copper(II) Complexes with N-(2-R-imidazol-4-ylmethylidene)-2-aminoethylpyridine (R = Methyl, Phenyl)","Inorganic Chemistry","1999","38","","1165","1173","10.1021/ic981158b","","","0.7107","MoKalpha","","","0.029","","","0.033","","","","","4.28","4.28","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321841","7.6659","0.0007","16.2872","0.001","14.1033","0.001","90","","95.058","0.007","90","","1754","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H16 Cl2 Cu N4 -","- C17 H16 Cl2 Cu N4 -","- C68 H64 Cl8 Cu4 N16 -","4","1","","Naohide Matsumoto; Yuri Motoda; Toshihiro Matsuo; Toshio Nakashima; Nazzareno Re; Francoise Dahan; Jean-Pierre Tuchagues","pH-Dependent Monomer \λeftarrow→Oligomer Interconversion of Copper(II) Complexes with N-(2-R-imidazol-4-ylmethylidene)-2-aminoethylpyridine (R = Methyl, Phenyl)","Inorganic Chemistry","1999","38","","1165","1173","10.1021/ic981158b","","","0.71073","MoKα","","0.0387","0.0222","","0.0647","0.0572","","","","1.038","1.044","1.044","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321842","15.177","0.003","15.747","0.003","14.128","0.003","100.06","0.02","110.37","0.02","63.54","0.01","2833","1.1","293.2","","293.2","","","","","","","","","6","P -1","-P 1","2","","","","- C17 H17 Cl Cu N4 O5 -","- C17 H15 Cl Cu N4 O4.33 -","- C102 H90 Cl6 Cu6 N24 O25.98 -","6","3","","Naohide Matsumoto; Yuri Motoda; Toshihiro Matsuo; Toshio Nakashima; Nazzareno Re; Francoise Dahan; Jean-Pierre Tuchagues","pH-Dependent Monomer \λeftarrow→Oligomer Interconversion of Copper(II) Complexes with N-(2-R-imidazol-4-ylmethylidene)-2-aminoethylpyridine (R = Methyl, Phenyl)","Inorganic Chemistry","1999","38","","1165","1173","10.1021/ic981158b","","","0.7107","MoKα","","0.0568","0.0568","","","0.0873","0.0873","","","","","","1.236","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321843","29.812","0.005","29.812","0.005","11.484","0.003","90","","90","","120","","8839","3","293","2","293","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C17 H15 Cu F6 N4 P -","- C17 H15 Cu F6 N4 P -","- C306 H270 Cu18 F108 N72 P18 -","18","1","","Naohide Matsumoto; Yuri Motoda; Toshihiro Matsuo; Toshio Nakashima; Nazzareno Re; Francoise Dahan; Jean-Pierre Tuchagues","pH-Dependent Monomer ←→ Oligomer Interconversion of Copper(II) Complexes with N-(2-R-imidazol-4-ylmethylidene)-2-aminoethylpyridine (R = Methyl, Phenyl)","Inorganic Chemistry","1999","38","","1165","1173","10.1021/ic981158b","","","0.71073","MoKα","","0.0436","0.0363","","0.0672","0.0624","","","","1.064","1.095","1.095","","","","","has coordinates","301838","2025-08-20","22:17:34",""
"4321844","19.433","0.002","15.312","0.002","29.156","0.002","90","","98.841","0.01","90","","8572.5","1.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C64 H104 N10 O8 Pd4 -","- C64.004 H96 N10 O8 Pd4 -","- C256.016 H384 N40 O32 Pd16 -","4","1","","Tianle Zhang; Marc Drouin; Pierre D. Harvey","Preparation, Spectroscopic Characterization, and Theoretical Study of the [Pd4(dmb)4(PPh3)2]Cl2 Complex (dmb = 1,8-Diisocyano-p-menthane) and Its Organometallic Polymer {[Pd4(dmb)5](CH3CO2)2}n: The First Examples of 58-Electron Linear Pd4 Clusters","Inorganic Chemistry","1999","38","","1305","1315","10.1021/ic9811594","","","1.5406","CuKα","","0.1655","0.0957","","","0.2931","0.3399","","","","","","1.232","","","","has coordinates,has disorder","179321","2020-10-21","18:00:00",""
"4321845","13.314","0.002","13.49","0.002","14.645","0.002","108.267","0.01","104.834","0.01","101.221","0.01","2303.8","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H44 Cl0.5 N12 Pd -","- C40.46 H30.32 Cl0.5 N12 Pd -","- C80.92 H60.64 Cl N24 Pd2 -","2","1","","Tianle Zhang; Marc Drouin; Pierre D. Harvey","Preparation, Spectroscopic Characterization, and Theoretical Study of the [Pd4(dmb)4(PPh3)2]Cl2 Complex (dmb = 1,8-Diisocyano-p-menthane) and Its Organometallic Polymer {[Pd4(dmb)5](CH3CO2)2}n: The First Examples of 58-Electron Linear Pd4 Clusters","Inorganic Chemistry","1999","38","","1305","1315","10.1021/ic9811594","","","1.5406","","","0.1192","0.0739","","","0.1961","0.2241","","","","","","1.002","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321846","9.5662","0.0005","20.5522","0.0016","13.9733","0.0013","90","","121.29","0.006","90","","2347.7","0.3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C38 H52 Cu2 N16 O14 -","- C38 H52 Cu2 N16 O14 -","- C76 H104 Cu4 N32 O28 -","2","0.5","","Richard H. Bode; Johan E. Bol; Willem L. Driessen; Frans B. Hulsbergen; Jan Reedijk; Anthony L. Spek","Formation of Dinuclear Copper(II) Complexes from a Macrocycle with Built-in Pyrazole Groups","Inorganic Chemistry","1999","38","","1239","1243","10.1021/ic9811704","","","0.71073","MoKα","","0.1436","0.0664","","","0.1304","0.1507","","","","","","0.922","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321847","10.9305","0.0008","12.326","0.0011","12.583","0.0007","114.528","0.006","93.872","0.005","103.208","0.006","1476.1","0.2","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H56 Cu2 F12 N12 O16 S4 -","- C42 H56 Cu2 F12 N12 O16 S4 -","- C42 H56 Cu2 F12 N12 O16 S4 -","1","0.5","","Richard H. Bode; Johan E. Bol; Willem L. Driessen; Frans B. Hulsbergen; Jan Reedijk; Anthony L. Spek","Formation of Dinuclear Copper(II) Complexes from a Macrocycle with Built-in Pyrazole Groups","Inorganic Chemistry","1999","38","","1239","1243","10.1021/ic9811704","","","0.71073","MoKα","","0.0539","0.0455","","","0.1237","0.1304","","","","","","0.996","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321848","10.132","0.002","13.484","0.003","16.408","0.003","93.85","0.02","101.17","0.02","99.694","0.015","2156.2","0.8","163","","163","","","","","","","","","4","P -1","-P 1","2","","","","- C38 H64 O10 Zr2 -","- C38 H64 O10 Zr2 -","- C76 H128 O20 Zr4 -","2","1","","William J. Evans; Mohammad A. Ansari; Joseph W. Ziller","Synthesis of Zirconium Aryloxide Complexes Containing Pendent Vinyl Groups","Inorganic Chemistry","1999","38","","1160","1164","10.1021/ic981201v","","","0.71073","MoKα","","0.055","0.0413","","0.1086","0.0992","","","","1.056","1.075","1.075","","","","","has coordinates,has disorder","179321","2020-10-21","18:00:00",""
"4321849","12.222","0.002","14.161","0.003","22.54","0.005","99.75","0.03","104.01","0.03","91.6","0.03","3720.7","1.4","158","","158","","","","","","","","","5","P -1","-P 1","2","","","","- C75 H109 N O13 Zr2 -","- C75 H109 N O13 Zr2 -","- C150 H218 N2 O26 Zr4 -","2","1","","William J. Evans; Mohammad A. Ansari; Joseph W. Ziller","Synthesis of Zirconium Aryloxide Complexes Containing Pendent Vinyl Groups","Inorganic Chemistry","1999","38","","1160","1164","10.1021/ic981201v","","","0.71073","MoKα","","0.0951","0.066","","0.1859","0.1614","","","","1.013","1.048","1.048","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:36",""
"4321850","13.933","0.003","14.451","0.004","15.924","0.004","82.06","","65.46","","67.51","","2694","1.2","158","","158","","","","","","","","","5","P -1","-P 1","2","","","","- C100 H130 K4 O23 Zr2 -","- C100 H84 K4 O23 Zr2 -","- C100 H84 K4 O23 Zr2 -","1","0.5","","William J. Evans; Mohammad A. Ansari; Joseph W. Ziller","Synthesis of Zirconium Aryloxide Complexes Containing Pendent Vinyl Groups","Inorganic Chemistry","1999","38","","1160","1164","10.1021/ic981201v","","","0.71073","MoKα","","0.1048","0.0901","","0.2776","0.257","","","","1.063","1.081","1.081","","","","","has coordinates,has disorder","179321","2020-10-21","18:00:00",""
"4321851","5.297","0.003","6.816","0.002","8.028","0.003","108.58","0.01","99.66","0.01","103.29","0.01","258.09","0.19","173","3","173","3","","","","","","","synthesized by J. Grobe and W. Golla","3","P -1","-P 1","2","tetrakis(trifluoromethyl)diphosphane","tetrakis(trifluoromethyl)diphosphane","","- C4 F11 P2 -","- C4 F12 P2 -","- C4 F12 P2 -","1","0.5","","Gerd Becker; Winfried Golla; Joseph Grobe; Karl Wilhelm Klinkhammer; Duc Le Van; Andreas H. Maulitz; Otto Mundt; Heinz Oberhammer; Martin Sachs","Element-Element Bonds. IX.1 Structures of Tetrakis(trifluoromethyl)diphosphane and -diarsane: Experimental and Theoretical Investigations","Inorganic Chemistry","1999","38","","1099","1107","10.1021/ic981218d","","","0.71073","MoKα","","0.0755","0.0721","","0.204","0.1912","","","","1.081","1.088","1.088","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321852","7.695","0.003","7.5","0.003","9.607","0.002","90","","105.26","0.01","90","","534.9","0.3","173","3","173","3","","","","","","","synthesized by J. Grobe and W. Golla","3","P 1 21/c 1","-P 2ybc","14","tetrakis(trifluoromethyl)diarsane","tetrakis(trifluoromethyl)diarsane","","- C4 As2 F12 -","- C4 As2 F12 -","- C8 As4 F24 -","2","0.5","","Gerd Becker; Winfried Golla; Joseph Grobe; Karl Wilhelm Klinkhammer; Duc Le Van; Andreas H. Maulitz; Otto Mundt; Heinz Oberhammer; Martin Sachs","Element-Element Bonds. IX.1 Structures of Tetrakis(trifluoromethyl)diphosphane and -diarsane: Experimental and Theoretical Investigations","Inorganic Chemistry","1999","38","","1099","1107","10.1021/ic981218d","","","0.71073","MoKα","","0.045","0.0422","","0.115","0.1117","","","","1.23","1.298","1.298","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321853","17.528","0.004","18.192","0.004","8.169","0.002","90","","90","","90","","2604.8","1","110","","110","","","","","","","","","7","P 21 21 2","P 2 2ab","18","","","","- C45 H48 F20 Ga Mn O P4 -","- C45 H42 F20 Ga Mn O P4 -","- C90 H84 F40 Ga2 Mn2 O2 P8 -","2","0.5","","Wayne A. King; Brian L. Scott; Juergen Eckert; Gregory J. Kubas","Reversible Displacement of Polyagostic Interactions in 16e [Mn(CO)(R2PC2H4PR2)2]+ by H2, N2, and SO2. Binding and Activation of η2-H2 trans to CO Is Nearly Invariant to Changes in Charge and cis Ligands","Inorganic Chemistry","1999","38","","1069","1084","10.1021/ic981263l","","","0.71073","MoKα","","0.1142","0.0748","","0.1624","0.1463","","","","1.089","1.202","1.202","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321854","12.987","0.002","14.942","0.002","15.622","0.002","105.184","0.006","109.207","0.008","103.632","0.007","2584.8","0.7","197","","197","","","","","","","","","7","P -1","-P 1","2","","","","- C45 H48 F20 Ga Mn O P4 -","- C45 H48 F20 Ga Mn O P4 -","- C90 H96 F40 Ga2 Mn2 O2 P8 -","2","1","","Wayne A. King; Brian L. Scott; Juergen Eckert; Gregory J. Kubas","Reversible Displacement of Polyagostic Interactions in 16e [Mn(CO)(R2PC2H4PR2)2]+ by H2, N2, and SO2. Binding and Activation of η2-H2 trans to CO Is Nearly Invariant to Changes in Charge and cis Ligands","Inorganic Chemistry","1999","38","","1069","1084","10.1021/ic981263l","","","0.71073","MoKα","","0.0696","0.0522","","0.1581","0.1462","","","","1.179","1.235","1.235","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321855","10.224","0.004","32.732","0.027","24.31","0.009","90","","97.69","0.03","90","","8062","8","138","","138","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C178 H100 Cl2 F60 Ga4 Mn2 O2 P8 -","- C178 H96 Cl2 F60 Ga4 Mn2 O2 P8 -","- C356 H192 Cl4 F120 Ga8 Mn4 O4 P16 -","2","0.25","","Wayne A. King; Brian L. Scott; Juergen Eckert; Gregory J. Kubas","Reversible Displacement of Polyagostic Interactions in 16e [Mn(CO)(R2PC2H4PR2)2]+ by H2, N2, and SO2. Binding and Activation of η2-H2 trans to CO Is Nearly Invariant to Changes in Charge and cis Ligands","Inorganic Chemistry","1999","38","","1069","1084","10.1021/ic981263l","","","0.71073","MoKα","","0.1338","0.0798","","0.22","0.1884","","","","1.039","1.143","1.143","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321856","13.966","0.002","13.9663","","33.689","0.003","90","","90","","90","","6571.2","1.1","293.2","","293.2","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C12 H15 Cl Cu N4 O5 -","- C12 H13 Cl Cu N4 O3 -","- C192 H208 Cl16 Cu16 N64 O48 -","16","1","","Naohide Matsumoto; Yuri Motoda; Toshihiro Matsuo; Toshio Nakashima; Nazzareno Re; Francoise Dahan; Jean-Pierre Tuchagues","pH-Dependent Monomer \λeftarrow→Oligomer Interconversion of Copper(II) Complexes with N-(2-R-imidazol-4-ylmethylidene)-2-aminoethylpyridine (R = Methyl, Phenyl)","Inorganic Chemistry","1999","38","","1165","1173","10.1021/ic981158b","","","0.7107","MoKα","","0.0756","0.0756","","","0.0855","0.0855","","","","","","1.902","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321857","10.175","0.002","20.834","0.003","23.765","0.004","90","0.01","90","0.02","90","0.02","5037.8","1.5","293","","293","","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C54 H68 N8 Ni O5 -","- C54 H68 N8 Ni O5 -","- C216 H272 N32 Ni4 O20 -","4","0.5","","Apurba Kumar Patra; Rabindranath Mukherjee","Bivalent, Trivalent, and Tetravalent Nickel Complexes with a Common Tridentate Deprotonated Pyridine Bis-Amide Ligand. Molecular Structures of Nickel(II) and Nickel(IV) and Redox Activity","Inorganic Chemistry","1999","38","","1388","1393","10.1021/ic980672e","","","0.71073","MoK-alpha","","0.212","0.069","","0.058","0.044","","","","1.407","1.99","1.99","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321858","14.874","0.007","13.3","0.004","16.604","0.005","90","0.03","99.68","0.03","90","0.03","3238","2","293","","293","","","","","","","","Synthesized in the laboratory","5","P 1 21/a 1","-P 2yab","14","","","","- C38 H27.5 N6 Ni O4.75 -","- C38 H28 N6 Ni O5 -","- C152 H112 N24 Ni4 O20 -","4","1","","Apurba Kumar Patra; Rabindranath Mukherjee","Bivalent, Trivalent, and Tetravalent Nickel Complexes with a Common Tridentate Deprotonated Pyridine Bis-Amide Ligand. Molecular Structures of Nickel(II) and Nickel(IV) and Redox Activity","Inorganic Chemistry","1999","38","","1388","1393","10.1021/ic980672e","","","0.71073","MoK-alpha","","0.164","0.061","","0.159","0.064","","","","1.984","1.305","1.305","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321859","10.629","0.002","11.204","0.002","11.858","0.002","69.731","0.012","74.412","0.014","71.47","0.012","1235.9","0.4","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H80 O10 Zr2 -","- C40 H80 O10 Zr2 -","- C40 H80 O10 Zr2 -","1","0.5","","Kirsty A. Fleeting; Paul O'Brien; David J. Otway; Andrew J. P. White; David J. Williams; Anthony C. Jones","Studies on Mixed β-Diketonate/Isopropoxide Compounds of Zirconium and Hafnium, the X-ray Single-Crystal Structures of [M2(OPri)6(tmhd)2] (M = Zr, Hf): Some Chemistry Important in the MOCVD of Oxides","Inorganic Chemistry","1999","38","","1432","1437","10.1021/ic980690w","","","0.71073","MoKα","","0.0539","0.0411","","0.1065","0.0975","","","","1.073","1.089","1.089","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:36",""
"4321860","10.5798","0.0011","11.1755","0.0014","11.8443","0.0013","69.369","0.009","74.17","0.009","71.405","0.01","1221.7","0.3","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C40 H80 Hf2 O10 -","- C40 H80 Hf2 O10 -","- C40 H80 Hf2 O10 -","1","0.5","","Kirsty A. Fleeting; Paul O'Brien; David J. Otway; Andrew J. P. White; David J. Williams; Anthony C. Jones","Studies on Mixed β-Diketonate/Isopropoxide Compounds of Zirconium and Hafnium, the X-ray Single-Crystal Structures of [M2(OPri)6(tmhd)2] (M = Zr, Hf): Some Chemistry Important in the MOCVD of Oxides","Inorganic Chemistry","1999","38","","1432","1437","10.1021/ic980690w","","","0.71073","MoKα","","0.0527","0.0402","","0.0984","0.0922","","","","1.03","1.05","1.05","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:36",""
"4321861","8.739","0.004","12.14","0.004","17.207","0.006","90","","103.91","0.03","90","","1772","1.2","566.2","","566.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H58 Cu2 N8 O18 -","- C18 H58 Cu2 N8 O18 -","- C36 H116 Cu4 N16 O36 -","2","0.5","","Peter Comba; Sergey P. Gavrish; Robert W. Hay; Peter Hilfenhaus; Yaroslaw D. Lampeka; Philip Lightfoot; Alexander Peters","Structural Variation of Dinuclear Transition Metal Compounds with a Common Type of Ligand: Solid State and Solution Structures and Model Studies","Inorganic Chemistry","1999","38","","1416","1421","10.1021/ic9807184","","","0.7107","MoKalpha","","","0.0403","","","0.0436","","","","","2.893","2.893","","","","","has coordinates,has Fobs","301838","2025-08-20","22:17:36",""
"4321862","11.3838","0.0002","12.685","0.0003","15.7144","0.0003","96.209","0.001","110.624","0.001","90.382","0.001","2108.88","0.08","148","2","148","2","","","","","","","","9","P -1","-P 1","2","","","","- C33 H38 Cl F12 N5 O P2 Pt2 S3 -","- C33 H38 Cl F12 N5 O P2 Pt2 S3 -","- C66 H76 Cl2 F24 N10 O2 P4 Pt4 S6 -","2","1","","Lyall R. Hanton; Kitty Lee","C-S Bond Cleavage by Chloride in a Thioether N2S2 Complex of Platinum","Inorganic Chemistry","1999","38","","1634","1637","10.1021/ic980781t","","","0.71073","MoKα","","0.0327","0.0245","","","0.0598","0.0617","","","","","","0.992","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321863","21.354","0.01","7.761","0.002","15.508","0.01","90","","119.34","0.05","90","","2240","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- H20 Mo6 N4 O24 Te -","- Mo6 N4 O24 Te -","- Mo24 N16 O96 Te4 -","4","0.5","","Vidyavathy; K. Vidyasagar","Hydrothermal Synthesis and Characterization of Novel One-Dimensional Tellurites of Molybdenum(VI), A4Mo6TeO22.2H2O (A = NH4, Rb)","Inorganic Chemistry","1999","38","","1394","1400","10.1021/ic980957r","","","0.71073","MoKα","","0.0199","0.0187","","0.0551","0.0546","","","","1.295","1.304","1.304","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321864","21.41","0.005","7.757","0.002","15.507","0.007","90","","119.68","0.03","90","","2237.5","1.4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- H4 Mo6 O24 Rb4 Te -","- Mo6 O24 Rb4 Te -","- Mo24 O96 Rb16 Te4 -","4","0.5","","Vidyavathy; K. Vidyasagar","Hydrothermal Synthesis and Characterization of Novel One-Dimensional Tellurites of Molybdenum(VI), A4Mo6TeO22.2H2O (A = NH4, Rb)","Inorganic Chemistry","1999","38","","1394","1400","10.1021/ic980957r","","","0.71073","MoKα","","0.0854","0.0496","","0.1132","0.0926","","","","1.158","1.124","1.124","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321865","16.313","0.005","16.553","0.005","17.068","0.006","108.04","0.02","93.13","0.02","100.268","0.018","4282","2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C80.5 H96.5 Cl7.5 O10 P2 -","- C80.5 H96.5 Cl7.5 O10 P2 -","- C161 H193 Cl15 O20 P4 -","2","1","","Izilda A. Bagatin; Dominique Matt; Holger Thönnessen; Peter G. Jones","Calix[4]arene Ligands with Phosphorus-Containing Groups Tethered at the Upper Rim","Inorganic Chemistry","1999","38","","1585","1591","10.1021/ic980964f","","","0.71073","MoKα","","0.1428","0.0803","","","0.2123","0.2464","","","","","","0.927","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321866","13.833","0.003","14.357","0.003","13.293","0.003","90","","90","","90","","2640","1","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C14 H26 Cl2 N12 O11 Pt -","- C14 H26 Cl2 N12 O11 Pt -","- C56 H104 Cl8 N48 O44 Pt4 -","4","1","","Roland K. O. Sigel; Michal Sabat; Eva Freisinger; Amanda Mower; Bernhard Lippert","Metal-Modified Base Pairs Involving Different Donor Sites of Purine Nucleobases: trans-[a2Pt(7,9-DimeG-N1)(9-EtGH-N7)]2+ and trans-[a2Pt(7,9-DimeG-N1)(9-EtG-N7)]+ (a = NH3 or CH3NH2; 9-EtGH = 9-Ethylguanine; 7,9-DimeG = 7,9-Dimethylguanine). Possible Relevance to Metalated DNA Triplex Structures","Inorganic Chemistry","1999","38","","1481","1490","10.1021/ic981005o","","","0.71069","MoKα","","0.0425","0.027","","0.0645","0.0606","","","","0.955","1.042","1.042","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321867","13.987","0.003","12.582","0.003","15.613","0.003","90","","104.61","0.03","90","","2658.8","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H26 Cl2 N12 O11 Pt -","- C14 H21 Cl2 N12 O11 Pt -","- C56 H84 Cl8 N48 O44 Pt4 -","4","1","","Roland K. O. Sigel; Michal Sabat; Eva Freisinger; Amanda Mower; Bernhard Lippert","Metal-Modified Base Pairs Involving Different Donor Sites of Purine Nucleobases: trans-[a2Pt(7,9-DimeG-N1)(9-EtGH-N7)]2+ and trans-[a2Pt(7,9-DimeG-N1)(9-EtG-N7)]+ (a = NH3 or CH3NH2; 9-EtGH = 9-Ethylguanine; 7,9-DimeG = 7,9-Dimethylguanine). Possible Relevance to Metalated DNA Triplex Structures","Inorganic Chemistry","1999","38","","1481","1490","10.1021/ic981005o","","","0.71069","MoKα","","0.0491","0.0332","","0.0918","0.0821","","","","0.961","1.053","1.053","","","","","has coordinates,has disorder","179321","2020-10-21","18:00:00",""
"4321868","13.886","0.001","14.698","0.001","13.008","0.003","90","","90","","90","","2654.9","0.7","103.2","","103.2","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C16 H28 Cl2 N12 O10 Pt -","- C16 H28 Cl2 N12 O10 Pt -","- C64 H112 Cl8 N48 O40 Pt4 -","4","1","","Roland K. O. Sigel; Michal Sabat; Eva Freisinger; Amanda Mower; Bernhard Lippert","Metal-Modified Base Pairs Involving Different Donor Sites of Purine Nucleobases: trans-[a2Pt(7,9-DimeG-N1)(9-EtGH-N7)]2+ and trans-[a2Pt(7,9-DimeG-N1)(9-EtG-N7)]+ (a = NH3 or CH3NH2; 9-EtGH = 9-Ethylguanine; 7,9-DimeG = 7,9-Dimethylguanine). Possible Relevance to Metalated DNA Triplex Structures","Inorganic Chemistry","1999","38","","1481","1490","10.1021/ic981005o","","","0.7107","MoKalpha","","","0.0341","","","0.0444","","","","","1.528","1.528","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321869","23.296","0.005","10.566","0.002","22.327","0.004","90","","93.73","0.03","90","","5484","1.9","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H33 Cl N12 O9 Pt -","- C16 H27 Cl N12 O9 Pt -","- C128 H216 Cl8 N96 O72 Pt8 -","8","1","","Roland K. O. Sigel; Michal Sabat; Eva Freisinger; Amanda Mower; Bernhard Lippert","Metal-Modified Base Pairs Involving Different Donor Sites of Purine Nucleobases: trans-[a2Pt(7,9-DimeG-N1)(9-EtGH-N7)]2+ and trans-[a2Pt(7,9-DimeG-N1)(9-EtG-N7)]+ (a = NH3 or CH3NH2; 9-EtGH = 9-Ethylguanine; 7,9-DimeG = 7,9-Dimethylguanine). Possible Relevance to Metalated DNA Triplex Structures","Inorganic Chemistry","1999","38","","1481","1490","10.1021/ic981005o","","","0.71069","MoKα","","0.1318","0.0472","","0.0723","0.0563","","","","0.792","1.027","1.027","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321870","11.967","0.003","18.004","0.002","8.74","0.002","102.31","0.01","109.32","0.01","82.08","0.01","1731.5","0.6","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C50 H64 B2 Cl12 Mo2 N14 O6 -","- C50 H64 B2 Cl12 Mo2 N14 O6 -","- C50 H64 B2 Cl12 Mo2 N14 O6 -","1","0.5","","Ferida S. McQuillan; Hongli Chen; Thomas A. Hamor; Christopher J. Jones; Helen A. Jones; R. Peter Sidebotham","Stereoselectivity in the Formation of Metallomacrocycles from [Mo(NO){HB(3,5-Me2C3HN2)3}I2] and Ditopic Proligands: The X-ray Crystal Structures of anti-[[Mo(NO){HB(3,5-Me2C3HN2)3}{1,4-(OCH2)2C6H4}]2.4CHCl3, syn-[Mo(NO){HB(3,5-Me2C3HN2)3}{1,4-(OCH2)2C6H4}]2.2CH2Cl2, and anti-[Mo(NO){HB(3,5-Me2C3HN2)3}{(4-OC6H4)2CH2}]2.2CHCl3.CH2Cl2","Inorganic Chemistry","1999","38","","1555","1562","10.1021/ic981010s","","","0.7107","MoKa","","0.0579","0.0522","","0.1699","0.1606","","","","0.743","0.729","0.729","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321871","16.576","0.003","20.844","0.002","17.024","0.002","90","","94.87","0.02","90","","5860.7","1.4","294","2","294","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C48 H64 B2 Cl4 Mo2 N14 O6 -","- C48 H64 B2 Cl4 Mo2 N14 O6 -","- C192 H256 B8 Cl16 Mo8 N56 O24 -","4","1","","Ferida S. McQuillan; Hongli Chen; Thomas A. Hamor; Christopher J. Jones; Helen A. Jones; R. Peter Sidebotham","Stereoselectivity in the Formation of Metallomacrocycles from [Mo(NO){HB(3,5-Me2C3HN2)3}I2] and Ditopic Proligands: The X-ray Crystal Structures of anti-[[Mo(NO){HB(3,5-Me2C3HN2)3}{1,4-(OCH2)2C6H4}]2.4CHCl3, syn-[Mo(NO){HB(3,5-Me2C3HN2)3}{1,4-(OCH2)2C6H4}]2.2CH2Cl2, and anti-[Mo(NO){HB(3,5-Me2C3HN2)3}{(4-OC6H4)2CH2}]2.2CHCl3.CH2Cl2","Inorganic Chemistry","1999","38","","1555","1562","10.1021/ic981010s","","","0.7107","MoKa","","0.1401","0.0789","","0.1115","0.0925","","","","1.073","1.059","1.059","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321872","12.665","0.002","13.013","0.002","11.894","0.002","111.8","0.01","95.48","0.01","94.78","0.02","1796.7","0.5","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C59 H68 B2 Cl8 Mo2 N14 O6 -","- C59 H66 B2 Cl8 Mo2 N14 O6 -","- C59 H66 B2 Cl8 Mo2 N14 O6 -","1","0.5","","Ferida S. McQuillan; Hongli Chen; Thomas A. Hamor; Christopher J. Jones; Helen A. Jones; R. Peter Sidebotham","Stereoselectivity in the Formation of Metallomacrocycles from [Mo(NO){HB(3,5-Me2C3HN2)3}I2] and Ditopic Proligands: The X-ray Crystal Structures of anti-[[Mo(NO){HB(3,5-Me2C3HN2)3}{1,4-(OCH2)2C6H4}]2.4CHCl3, syn-[Mo(NO){HB(3,5-Me2C3HN2)3}{1,4-(OCH2)2C6H4}]2.2CH2Cl2, and anti-[Mo(NO){HB(3,5-Me2C3HN2)3}{(4-OC6H4)2CH2}]2.2CHCl3.CH2Cl2","Inorganic Chemistry","1999","38","","1555","1562","10.1021/ic981010s","","","0.7107","MoKa","","0.0728","0.0648","","0.1979","0.1887","","","","1.011","1.044","1.044","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321873","14.566","0.002","10.968","0.001","16.133","0.002","90","","105.62","0.01","90","","2482.2","0.5","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","(34dtpabn)H6","2,12,19,29-tetraoxo-1,4,7,10,13,18,21,24,27,30-deca-aza-4,7,10,21,24,27- cyclotetratriacontanehexaacetic acid di-acetone","","- C42 H74 N10 O18 -","- C42 H74 N10 O18 -","- C84 H148 N20 O36 -","2","0.5","","Michiko B. Inoue; Hisila Santacruz; Motomichi Inoue; Quintus Fernando","Binuclear Gd3+ Complex of a 34-Membered Macrocycle with Six Carboxymethyl Arms: X-ray Structures, Formation Constants, NMR, EPR, and 1H NMR Relaxivities","Inorganic Chemistry","1999","38","","1596","1602","10.1021/ic981015p","","","0.71073","MoKα","","","0.049","","","0.058","","","","","1.78","1.78","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321874","11.88","0.001","15.036","0.001","17.396","0.001","94.986","0.005","103.34","0.005","98.286","0.005","2968.6","0.4","296","","296","","","","","","","","","5","P -1","-P 1","2","Gd2(34dtpabn)","diaqua- (2,12,19,29-tetraoxo-1,4,7,10,13,18,21,24,27,30-deca-aza-4,7,10,21,24,27- cyclotetratriacontanehexaacetato)-di-gadolinium(iii) heptahydrate di-iso-propanol","","- C42 H90 Gd2 N10 O27 -","- C42 H90 Gd2 N10 O27 -","- C84 H180 Gd4 N20 O54 -","2","1","","Michiko B. Inoue; Hisila Santacruz; Motomichi Inoue; Quintus Fernando","Binuclear Gd3+ Complex of a 34-Membered Macrocycle with Six Carboxymethyl Arms: X-ray Structures, Formation Constants, NMR, EPR, and 1H NMR Relaxivities","Inorganic Chemistry","1999","38","7","1596","1602","10.1021/ic981015p","","","0.71073","MoKα","","","0.039","","","0.045","","","","","1.29","1.29","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321875","27.99","0.01","18.318","0.008","6.68","0.01","90","","90","","90","","3425","5","293.2","","293.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H13 N4 O0.5 Pt -","- C20 H12 N4 O0.5 Pt -","- C160 H96 N32 O4 Pt8 -","8","1","","Masako Kato; Chizuko Kosuge; Katsuyuki Morii; Jeung Sun Ahn; Hiroshi Kitagawa; Tadaoki Mitani; Michio Matsushita; Tatsuhisa Kato; Shigenobu Yano; Masaru Kimura","Luminescence Properties and Crystal Structures of Dicyano(diimine)platinum(II) Complexes Controlled by Pt...Pt and π-π Interactions","Inorganic Chemistry","1999","38","","1638","1641","10.1021/ic981027a","","","0.7107","MoKα","","0.1559","0.0399","","0.1426","0.1038","0.1426","","","1.011","","","1.011","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321876","27.54","0.08","18.27","0.06","6.6","0.06","90","","90","","90","","3321","3","220","","123.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H13 N4 O0.5 Pt -","- C20 H12 N4 O0.5 Pt -","- C160 H96 N32 O4 Pt8 -","8","1","","Masako Kato; Chizuko Kosuge; Katsuyuki Morii; Jeung Sun Ahn; Hiroshi Kitagawa; Tadaoki Mitani; Michio Matsushita; Tatsuhisa Kato; Shigenobu Yano; Masaru Kimura","Luminescence Properties and Crystal Structures of Dicyano(diimine)platinum(II) Complexes Controlled by Pt...Pt and π-π Interactions","Inorganic Chemistry","1999","38","","1638","1641","10.1021/ic981027a","","","0.7107","MoKα","","0.1549","0.0771","","0.144","0.1091","0.144","","","1.224","1.356","1.356","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321877","18.1364","0.0009","9.3524","0.0009","6.664","0.001","90","","90","","90","","1130.3","0.2","293.2","","293.2","","","","","","","","","4","C m c m","-C 2c 2","63","","","","- C12 H8 N4 Pt -","- C12 H8 N4 Pt -","- C48 H32 N16 Pt4 -","4","0.25","","Masako Kato; Chizuko Kosuge; Katsuyuki Morii; Jeung Sun Ahn; Hiroshi Kitagawa; Tadaoki Mitani; Michio Matsushita; Tatsuhisa Kato; Shigenobu Yano; Masaru Kimura","Luminescence Properties and Crystal Structures of Dicyano(diimine)platinum(II) Complexes Controlled by Pt...Pt and π-π Interactions","Inorganic Chemistry","1999","38","","1638","1641","10.1021/ic981027a","","","0.7107","MoKα","","0.0276","0.0253","","0.0673","0.0659","0.0673","","","1.028","","","1.028","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321878","8.4931","0.0006","17.264","0.001","17.699","0.001","90","","99.517","0.006","90","","2559.4","0.3","294","","294","","","","","","","","?","6","C 1 2/c 1","-C 2yc","15","","","","- C11 H11 Cd0.5 Cl N3 O4 -","- C11 H11 Cd0.5 Cl N3 O4 -","- C88 H88 Cd4 Cl8 N24 O32 -","8","1","","Zhiyong Wang; Ren-Gen Xiong; Bruce M. Foxman; Scott R. Wilson; Wenbin Lin","Two- and Three-Dimensional Cadmium Coordination Polymers Based on N,N-(2-Pyridyl)-(4-pyridylmethyl)amine","Inorganic Chemistry","1999","38","","1523","1528","10.1021/ic981123b","","","0.71073","MoKα","","","0.034","","","0.0391","","","","","1.0844","1.0844","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4321879","8.6231","0.0005","17.288","0.001","16.1675","0.0007","90","","94.73","0.002","90","","2402","0.2","298","","","","","","","","","","?","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H11 Cd0.5 N4 O3 -","- C44 H44 Cd2 N16 O12 -","- C88 H88 Cd4 N32 O24 -","2","0.25","","Zhiyong Wang; Ren-Gen Xiong; Bruce M. Foxman; Scott R. Wilson; Wenbin Lin","Two- and Three-Dimensional Cadmium Coordination Polymers Based on N,N-(2-Pyridyl)-(4-pyridylmethyl)amine","Inorganic Chemistry","1999","38","","1523","1528","10.1021/ic981123b","","","0.71073","MoKα","","","0.0498","","","0.0582","","","","","1.0161","1.0161","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321880","11.7188","0.0002","15.7525","0.0003","12.8528","0.0001","90","","93.064","0.001","90","","2369.24","0.06","298","","","","","","","","","","?","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 Cd N6 O5 S -","- C44 H48 Cd2 N12 O10 S2 -","- C88 H96 Cd4 N24 O20 S4 -","2","0.5","","Zhiyong Wang; Ren-Gen Xiong; Bruce M. Foxman; Scott R. Wilson; Wenbin Lin","Two- and Three-Dimensional Cadmium Coordination Polymers Based on N,N-(2-Pyridyl)-(4-pyridylmethyl)amine","Inorganic Chemistry","1999","38","","1523","1528","10.1021/ic981123b","","","0.71073","MoKα","","","0.0417","","","0.0469","","","","","0.3857","0.3857","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321881","17.413","0.0004","12.1794","0.0003","15.3721","0.0004","90","","120.384","0.001","90","","2812.35","0.12","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Co2 H50 N12 O19 U3 -","- Co2 H50 N12 O19 U3 -","- Co8 H200 N48 O76 U12 -","4","0.5","","David L. Clark; Steven D. Conradson; Robert J. Donohoe; D. Webster Keogh; David E. Morris; Phillip D. Palmer; Robin D. Rogers; C. Drew Tait","Chemical Speciation of the Uranyl Ion under Highly Alkaline Conditions. Synthesis, Structures, and Oxo Ligand Exchange Dynamics","Inorganic Chemistry","1999","38","","1456","1466","10.1021/ic981137h","","","0.71073","MoKα","","0.0377","0.0313","","0.0808","0.0734","","","","1.05","1.099","1.099","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321882","45.685","0.004","12.211","0.0012","36.4","0.006","90","","114.915","0.013","90","","18416","4","156","","156","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C57 H49 N O P3 Re -","- C57 H49 N O P3 Re -","- C912 H784 N16 O16 P48 Re16 -","16","2","","Talia M. McKinney; Phillip E. Fanwick; Richard A. Walton","Reactions of the Eight-Coordinate Rhenium Complex ReH4(hq)(PPh3)2 (hq = 2-Hydroxyquinoline Monoanion) with Monodentate Tertiary Phosphines: Formation of Pentagonal Bipyramidal Dihydridorhenium(III) Complexes of the Type ReH2(hq)(PPh3)2(PR3)","Inorganic Chemistry","1999","38","","1548","1554","10.1021/ic981155z","","","0.71073","MO-Kα","","","0.061","","","","0.224","","","","","","1.013","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321883","12.24","0.002","12.411","0.003","15.196","0.003","93.196","0.016","93.898","0.015","96.215","0.016","2284.9","0.8","296","","296","","","","","","","","","6","P -1","-P 1","2","","","","- C52 H55 N O2 P3 Re -","- C53 H47 N O P3 Re -","- C106 H94 N2 O2 P6 Re2 -","2","1","","Talia M. McKinney; Phillip E. Fanwick; Richard A. Walton","Reactions of the Eight-Coordinate Rhenium Complex ReH4(hq)(PPh3)2 (hq = 2-Hydroxyquinoline Monoanion) with Monodentate Tertiary Phosphines: Formation of Pentagonal Bipyramidal Dihydridorhenium(III) Complexes of the Type ReH2(hq)(PPh3)2(PR3)","Inorganic Chemistry","1999","38","","1548","1554","10.1021/ic981155z","","","1.54184","Cu-Kα","","0.065","0.038","","","0.049","","","","","1.372","1.372","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321884","17.9318","0.0015","12.8195","0.0011","22.2897","0.0013","90","","101.837","0.006","90","","5014.9","0.7","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C63 H53 N O P3 Re -","- C63 H53 N O P3 Re -","- C252 H212 N4 O4 P12 Re4 -","4","1","","Talia M. McKinney; Phillip E. Fanwick; Richard A. Walton","Reactions of the Eight-Coordinate Rhenium Complex ReH4(hq)(PPh3)2 (hq = 2-Hydroxyquinoline Monoanion) with Monodentate Tertiary Phosphines: Formation of Pentagonal Bipyramidal Dihydridorhenium(III) Complexes of the Type ReH2(hq)(PPh3)2(PR3)","Inorganic Chemistry","1999","38","","1548","1554","10.1021/ic981155z","","","1.54184","Cu-Kα","","","0.029","","","","0.039","","","","","","1.034","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321885","10.5866","0.0006","18.3842","0.001","15.568","0.0008","90","","94.34","0.001","90","","3021.3","0.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C64 H62 Cl4 N2 O2 P4 Pt2 -","- C64 H62 Cl4 N2 O2 P4 Pt2 -","- C128 H124 Cl8 N4 O4 P8 Pt4 -","2","0.5","","Jian Jun Li; Wei Li; Alan J. James; Todd Holbert; Tristan P. Sharp; Paul R. Sharp","Phosphine-Based Dinuclear Platinum(II) Diamido, Amido-Hydroxo, Oxo-Amido, Oxo-Imido, Diimido, and Dihydrazido Complexes1","Inorganic Chemistry","1999","38","","1563","1572","10.1021/ic981246w","","","0.7107","MoKα","","0.0268","0.0211","","","0.0485","0.0506","","","","","","1.031","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321886","16.331","0.005","23.908","0.005","19.233","0.006","90","","99.01","0.01","90","","7417","4","295","2","295","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C80 H71 B2 Cl2 F8 N O P4 Pt2 -","- C80 H71 B2 Cl2 F8 N O P4 Pt2 -","- C320 H284 B8 Cl8 F32 N4 O4 P16 Pt8 -","4","1","","Jian Jun Li; Wei Li; Alan J. James; Todd Holbert; Tristan P. Sharp; Paul R. Sharp","Phosphine-Based Dinuclear Platinum(II) Diamido, Amido-Hydroxo, Oxo-Amido, Oxo-Imido, Diimido, and Dihydrazido Complexes1","Inorganic Chemistry","1999","38","","1563","1572","10.1021/ic981246w","","","0.7107","MoKα","","0.0846","0.0311","","","0.0596","0.0653","","","","","","0.999","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321887","38.2725","0.0019","9.2841","0.0005","15.0099","0.0007","90","","90","","90","","5333.4","0.5","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C62 H54 N2 P4 Pt2 -","- C62 H54 N2 P4 Pt2 -","- C248 H216 N8 P16 Pt8 -","4","1","","Jian Jun Li; Wei Li; Alan J. James; Todd Holbert; Tristan P. Sharp; Paul R. Sharp","Phosphine-Based Dinuclear Platinum(II) Diamido, Amido-Hydroxo, Oxo-Amido, Oxo-Imido, Diimido, and Dihydrazido Complexes1","Inorganic Chemistry","1999","38","","1563","1572","10.1021/ic981246w","","","0.7107","MoKα","","0.0662","0.0535","","","0.1128","0.1196","","","","","","1.171","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321888","17.669","0.005","31.884","0.003","14.686","0.004","90","","105.03","0.01","90","","7990","3","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C78 H104 B F4 Li N4 O7 P4 Pt2 -","- C78 H104 B F4 Li N4 O7 P4 Pt2 -","- C312 H416 B4 F16 Li4 N16 O28 P16 Pt8 -","4","1","","Jian Jun Li; Wei Li; Alan J. James; Todd Holbert; Tristan P. Sharp; Paul R. Sharp","Phosphine-Based Dinuclear Platinum(II) Diamido, Amido-Hydroxo, Oxo-Amido, Oxo-Imido, Diimido, and Dihydrazido Complexes1","Inorganic Chemistry","1999","38","","1563","1572","10.1021/ic981246w","","","0.7107","MoKα","","0.1108","0.0525","","","0.1382","0.1593","","","","","","1.112","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321889","9.615","0.008","10.7","0.011","14.918","0.011","84.06","0.07","82.86","0.06","75.56","0.08","1471","2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C27 H40 Cl2 Cu Fe N2 O P -","- C27 H40 Cl2 Cu Fe N2 O P -","- C54 H80 Cl4 Cu2 Fe2 N4 O2 P2 -","2","1","","Donald J. Darensbourg; Way-Zen Lee; M. Jason Adams; David L. Larkins; Joseph H. Reibenspies","Diamond-Shaped Heterometallic Complexes of Iron(II) and Copper(I) Bridged by Cyanide Groups","Inorganic Chemistry","1999","38","","1378","1379","10.1021/ic981419h","","","0.71073","MoKα","","0.0514","0.0384","","0.1311","0.0934","","","","1.015","1.035","1.035","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321890","13.3707","0.0009","13.876","0.002","15.115","0.002","67.049","0.009","69.073","0.007","80.748","0.009","2411.2","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C61 H71 Cu Fe N2 O P3 -","- C48 H66 Cu Fe N2 O2 P2 -","- C96 H132 Cu2 Fe2 N4 O4 P4 -","2","1","","Donald J. Darensbourg; Way-Zen Lee; M. Jason Adams; David L. Larkins; Joseph H. Reibenspies","Diamond-Shaped Heterometallic Complexes of Iron(II) and Copper(I) Bridged by Cyanide Groups","Inorganic Chemistry","1999","38","","1378","1379","10.1021/ic981419h","","","0.71073","MoKα","","0.1726","0.084","","0.3328","0.2334","","","","0.862","0.856","0.856","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321891","9.833","0.004","34.665","0.009","10.099","0.004","90","","103.497","0.005","90","","3347","2","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H54 Bi Li N6 Te2 -","- C24 H54 Bi1.036 N6 Te2 -","- C96 H216 Bi4.144 N24 Te8 -","4","1","","Tristram Chivers; Masood Parvez; Gabriele Schatte; Glenn P. A. Yap","Homoleptic Bismuth and Antimony Complexes of the Tripodal [Te(NtBu)3]2- Anion","Inorganic Chemistry","1999","38","","1380","1381","10.1021/ic9814322","","","0.71073","MoKα","","0.0848","0.046","","","0.0844","0.0902","","","","","","0.908","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321892","9.988","0.003","17.753","0.002","19.456","0.003","90","","101.16","0.02","90","","3384.6","1.2","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C24 H54 Li N6 Sb Te2 -","- C24 H54 N6 Sb1.059 Te2 -","- C96 H216 N24 Sb4.236 Te8 -","4","1","","Tristram Chivers; Masood Parvez; Gabriele Schatte; Glenn P. A. Yap","Homoleptic Bismuth and Antimony Complexes of the Tripodal [Te(NtBu)3]2- Anion","Inorganic Chemistry","1999","38","","1380","1381","10.1021/ic9814322","","","0.71069","MoKα","","0.2118","0.0531","","","0.1143","0.1689","","","","","","0.956","","","","has coordinates,has disorder","179321","2020-10-21","18:00:00",""
"4321893","23.505","0.007","8.118","0.007","15.578","0.007","90","","112.52","0.03","90","","2746","3","293.2","","293.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H42 N8 Ni2 O10 -","- C18 H42 N8 Ni2 O10 -","- C72 H168 N32 Ni8 O40 -","4","0.5","","Peter Comba; Sergey P. Gavrish; Robert W. Hay; Peter Hilfenhaus; Yaroslaw D. Lampeka; Philip Lightfoot; Alexander Peters","Structural Variation of Dinuclear Transition Metal Compounds with a Common Type of Ligand: Solid State and Solution Structures and Model Studies","Inorganic Chemistry","1999","38","","1416","1421","10.1021/ic9807184","","","0.7107","MoKalpha","","","0.052","","","0.046","","","","","3.596","3.596","","","","","has coordinates,has Fobs","301838","2025-08-20","22:17:36",""
"4321894","10.543","0.002","11.934","0.004","16.884","0.003","90","","94.08","0.02","90","","2119","0.9","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 Ag2 Cl2 O8 -","- C21 H15 Ag2 Cl2 O8 -","- C84 H60 Ag8 Cl8 O32 -","4","1","","Gui Ling Ning; Megumu Munakata; Liang Ping Wu; Masahiko Maekawa; Takayoshi Kuroda-Sowa; Yusaku Suenaga; Kunihisa Sugimoto","Cationic Tetrasilver Complex of Hexaphenylbenzene","Inorganic Chemistry","1999","38","","1376","1377","10.1021/ic981133c","","","0.7107","MoKα","","0.0555","0.0555","","","0.0523","0.0523","","","","","","1.602","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321895","9.5861","0.0009","12.472","0.001","8.2247","0.0008","100.78","0.01","93.582","0.009","93.529","0.009","961.39","0.16","296.2","","296.2","","","","","","","","synthetic","6","P -1","-P 1","2","","","","- C21 H14 Cl N3 Pt S2 -","- C21 H14 Cl N3 Pt S2 -","- C42 H28 Cl2 N6 Pt2 S4 -","2","1","","F. Teixidor; P. Anglès; C. Viñas; R. Kivekäs; R. Sillanpää","Asymmetric Benzothiophene Condensation Facilitated by Platinum(II). The Distinct Roles of Platinum(II) and Palladium(II)","Inorganic Chemistry","1999","38","","1642","1644","10.1021/ic971425y","","","0.7107","MoKα","","0.0277","0.028","","0.0245","","0.024","","","1.497","","","1.5","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321896","13.779","0.001","19.41","0.001","26.183","0.002","90","","101.938","0.002","90","","6851.2","0.8","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C81 H75 Cl2 Gd N8 -","- C80.847 H62 Cl1.694 Gd N8 -","- C323.388 H248 Cl6.776 Gd4 N32 -","4","1","","Georgios A. Spyroulias; Catherine P. Raptopoulou; Dominique de Montauzon; Alain Mari; René Poilblanc; Aris Terzis; Athanassios G. Coutsolelos","Synthesis and Physicochemical Characterization of Protonated and Deprotonated Forms in Heteroleptic Lanthanide(III) Porphyrinate Double-Deckers. X-ray Structure of GdIIIH(oep)(tpp) at 298 and 21 K","Inorganic Chemistry","1999","38","","1683","1696","10.1021/ic970879s","","","0.7107","MoKα","","0.0685","0.0474","","0.1463","0.1149","","","","1.098","1.122","1.122","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321897","13.703","0.001","19.008","0.002","25.807","0.003","90","","101.734","0.003","90","","6581.4","1.1","21","","21","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C81 H75 Cl2 Gd N8 -","- C81 H67 Cl2 Gd N8 -","- C324 H268 Cl8 Gd4 N32 -","4","1","","Georgios A. Spyroulias; Catherine P. Raptopoulou; Dominique de Montauzon; Alain Mari; René Poilblanc; Aris Terzis; Athanassios G. Coutsolelos","Synthesis and Physicochemical Characterization of Protonated and Deprotonated Forms in Heteroleptic Lanthanide(III) Porphyrinate Double-Deckers. X-ray Structure of GdIIIH(oep)(tpp) at 298 and 21 K","Inorganic Chemistry","1999","38","","1683","1696","10.1021/ic970879s","","","0.7107","MoKα","","0.1028","0.0775","","0.2218","0.1911","","","","1.078","1.115","1.115","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321898","8.473","0.002","15.427","0.003","17.387","0.003","90","","90","","90","","2272.7","0.8","293","2","293","2","","","","","","","synthesized","4","P b c a","-P 2ac 2ab","61","","4,5-DIAZAFLUORENE 9-ONE THIOSEMICARBAZONE","","- C12 H9 N5 S -","- C12 H9 N5 S -","- C96 H72 N40 S8 -","8","1","","Ze-Hua Liu; Chun-Ying Duan; Jun Hu; Xiao-Zeng You","Design, Synthesis, and Crystal Structure of a cis-Configuration N2S2-Coordinated Palladium(II) Complex: Role of the Intra- and Intermolecular Aromatic-Ring Stacking Interaction","Inorganic Chemistry","1999","38","","1719","1724","10.1021/ic9711731","","","0.71073","MoKα","","0.1443","0.0413","","0.1782","0.0859","","","","0.792","0.775","0.775","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321899","10.749","0.003","10.749","0.003","19.872","0.004","90","","90","","120","","1988.4","0.9","293","2","293","2","","","","","","","synthesized","6","P 31","P 31","144","","bis(4,5-diazafluorene-9-one thiosemicarbazone)palladium(II) trihydrate","","- C24 H22 N10 O3 Pd S2 -","- C24 H22 N10 O3 Pd S2 -","- C72 H66 N30 O9 Pd3 S6 -","3","1","","Ze-Hua Liu; Chun-Ying Duan; Jun Hu; Xiao-Zeng You","Design, Synthesis, and Crystal Structure of a cis-Configuration N2S2-Coordinated Palladium(II) Complex: Role of the Intra- and Intermolecular Aromatic-Ring Stacking Interaction","Inorganic Chemistry","1999","38","","1719","1724","10.1021/ic9711731","","","0.71073","MoKα","","0.0837","0.0602","","0.147","0.1339","","","","1.09","1.138","1.138","","","","","has coordinates","179321","2020-10-21","18:00:00",""
"4321900","8.832","0.002","21.124","0.005","14.923","0.004","90","0","98.23","0.03","90","0","2755.5","1.2","230","0.2","230","0.2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H49 N Os P2 S -","- C23 H49 N Os P2 S -","- C92 H196 N4 Os4 P8 S4 -","4","1","","Amaya Castillo; Guada Barea; Miguel A. Esteruelas; Fernando J. Lahoz; Agustí LLedós; Feliu Maseras; Javier Modrego; Enrique Oñate; Luis A. Oro; Natividad Ruiz; Eduardo Sola","Thermally Activated Site Exchange and Quantum Exchange Coupling Processes in Unsymmetrical Trihydride Osmium Compounds","Inorganic Chemistry","1999","38","","1814","1824","10.1021/ic9804061","","","0.71073","MoKα","","0.0466","0.0301","","0.0452","0.0328","","","","","1.0892","1.0892","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321901","4.2606","0.0006","4.7944","0.0007","9.4429","0.0013","90","","90","","90","","192.89","0.05","293","2","293","2","","","","","","","","3","P m m n :2","-P 2ab 2a","59","BaCrS2","Barium Chromium Disulfide","","- Ba Cr S2 -","- Ba Cr S2 -","- Ba2 Cr2 S4 -","2","0.25","","Omar Fuentes; Chong Zheng; Catherine E. Check; Jianhua Zhang; Gerardo Chacon","Synthesis and Structural Analysis of BaCrS2","Inorganic Chemistry","1999","38","","1889","1893","10.1021/ic980609p","","","0.71073","MoKα","","0.0381","0.0335","","0.0831","0.0808","","","","1.063","1.101","1.101","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321902","24.075","0.01","21.143","0.003","15.981","0.003","90","","90","","90","","8135","4","120","2","120","2","","","","","","","see paper","7","P 21 21 21","P 2ac 2ab","19","difluoromethylcobalamin","","","- C63 H123 Co F2 N13 O31 P -","- C63 H121 Co F2 N13 O30 P -","- C252 H484 Co4 F8 N52 O120 P4 -","4","1","","Trixie Wagner; Carol E. Afshar; H. L. Carrell; Jenny P. Glusker; Ulli Englert; Harry P. C. Hogenkamp","Difluoromethylcobalamin: Structural Aspects of an Old Tree with a New Branch","Inorganic Chemistry","1999","38","","1785","1794","10.1021/ic980751q","","","0.71073","MoKα","","0.1519","0.0716","","","0.1509","0.1944","","","","","","0.904","","","","has coordinates","192276","2020-10-21","18:00:00",""
"4321903","8.7677","0.0005","11.514","0.0007","14.8858","0.0009","90","","96.548","0.001","90","","1492.94","0.15","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H11 B Cu F4 N3 -","- C14 H11 B Cu F4 N3 -","- C56 H44 B4 Cu4 F16 N12 -","4","1","","Susan Lopez; Steven W. Keller","New Linear Coordination Polymers Based on Copper(I) and 4,7-Phenanthroline: Structure Dependence on Solvent and Counteranion","Inorganic Chemistry","1999","38","","1883","1888","10.1021/ic980800z","","","0.7107","MoKα","","0.0465","0.0353","","0.0942","0.0887","","","","1.003","1.05","1.05","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321904","11.748","0.001","12.575","0.0011","14.139","0.0013","115.7","0.002","98.81","0.002","96.02","0.002","1825.2","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H26 Cu2 F12 N6 P2 -","- C38 H26 Cu2 F12 N6 P2 -","- C76 H52 Cu4 F24 N12 P4 -","2","1","","Susan Lopez; Steven W. Keller","New Linear Coordination Polymers Based on Copper(I) and 4,7-Phenanthroline: Structure Dependence on Solvent and Counteranion","Inorganic Chemistry","1999","38","","1883","1888","10.1021/ic980800z","","","0.7107","MoKα","","0.1117","0.0766","","","0.1777","0.1984","","","","","","1.026","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321905","11.3378","0.001","12.4612","0.0011","13.9045","0.0013","115.909","0.002","100.87","0.002","92.052","0.002","1719.7","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H13 B Cu F4 N3 -","- C38 H26 B2 Cu2 F8 N6 -","- C76 H52 B4 Cu4 F16 N12 -","2","1","","Susan Lopez; Steven W. Keller","New Linear Coordination Polymers Based on Copper(I) and 4,7-Phenanthroline: Structure Dependence on Solvent and Counteranion","Inorganic Chemistry","1999","38","","1883","1888","10.1021/ic980800z","","","0.7107","MoKα","","0.0989","0.0587","","0.1396","0.1235","","","","1.044","1.133","1.133","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321906","11.73","0.001","18.64","0.002","13.331","0.002","90","","93.74","0.01","90","","2908.6","0.6","130","","130","","","","","","","","by syntheses","6","I 1 2/m 1","-I 2y","12","","","","- C52 H51 Cl4 Fe2 N13 O17 -","- C50 H48 Cl4 Fe2 N12 O17 -","- C100 H96 Cl8 Fe4 N24 O34 -","2","0.25","","Gerard Roelfes; Marcel Lubben; Kui Chen; Raymond Y. N. Ho; Auke Meetsma; Susan Genseberger; Roel M. Hermant; Ronald Hage; Sanjay K. Mandal; Victor G. Young,; Yan Zang; Huub Kooijman; Anthony L. Spek; Lawrence Que,; Ben L. Feringa","Iron Chemistry of a Pentadentate Ligand That Generates a Metastable FeIII-OOH Intermediate","Inorganic Chemistry","1999","38","","1929","1936","10.1021/ic980983p","","","0.71073","MoKα","","","0.063","","","0.61","","","","","","","2.788","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321907","12.191","0.001","18.5","0.001","13.015","0.001","90","","95.928","0.008","90","","2919.6","0.4","130","","130","","","","","","","","by syntheses","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H28 Cl2 Fe N6 O9 -","- C25 H24 Cl2 Fe N6 O8 -","- C100 H96 Cl8 Fe4 N24 O32 -","4","1","","Gerard Roelfes; Marcel Lubben; Kui Chen; Raymond Y. N. Ho; Auke Meetsma; Susan Genseberger; Roel M. Hermant; Ronald Hage; Sanjay K. Mandal; Victor G. Young,; Yan Zang; Huub Kooijman; Anthony L. Spek; Lawrence Que,; Ben L. Feringa","Iron Chemistry of a Pentadentate Ligand That Generates a Metastable FeIII-OOH Intermediate","Inorganic Chemistry","1999","38","","1929","1936","10.1021/ic980983p","","","0.71073","MoKα","","","0.046","","","0.049","","","","","","","1.925","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321908","21.3348","0.0001","16.6471","0.0001","32.1048","0.0004","90","","90","","90","","11402.4","0.17","173","2","173","2","","","","","","","K.C. / Prof. L. Que","6","P b c a","-P 2ac 2ab","61","97125","","","- C49.5 H54 Cl4 Fe2 N10 O19.5 -","- C49.5 H54 Cl4 Fe2 N10 O19.5 -","- C396 H432 Cl32 Fe16 N80 O156 -","8","1","","Gerard Roelfes; Marcel Lubben; Kui Chen; Raymond Y. N. Ho; Auke Meetsma; Susan Genseberger; Roel M. Hermant; Ronald Hage; Sanjay K. Mandal; Victor G. Young,; Yan Zang; Huub Kooijman; Anthony L. Spek; Lawrence Que,; Ben L. Feringa","Iron Chemistry of a Pentadentate Ligand That Generates a Metastable FeIII-OOH Intermediate","Inorganic Chemistry","1999","38","","1929","1936","10.1021/ic980983p","","","0.71073","MoKα","","0.1005","0.0696","","0.1261","0.1148","","","","1.146","1.214","1.214","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321909","22.6542","0.0008","9.5147","0.0003","16.5329","0.0006","90","","113.578","0.001","90","","3266.1","0.2","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H19 Cl3 N2 Ti -","- C11 H19 Cl3 N2 Ti -","- C88 H152 Cl24 N16 Ti8 -","8","1","","Carlos Yélamos; Mary Jane Heeg; Charles H. Winter","Synthesis, Structure, and Properties of Group 4 and 5 Metal Pyrazolato Chloride Complexes","Inorganic Chemistry","1999","38","","1871","1878","10.1021/ic981096p","","","0.71073","MoKα","","0.1092","0.0485","","0.127","0.1081","","","","0.916","1.064","1.064","","","","","has coordinates,has disorder","179322","2020-10-21","18:00:00",""
"4321910","10.4529","0.0007","10.1437","0.0006","36.986","0.003","90","","93.308","0.001","90","","3915.1","0.5","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H57 Cl Hf N6 -","- C33 H57 Cl Hf N6 -","- C132 H228 Cl4 Hf4 N24 -","4","1","","Carlos Yélamos; Mary Jane Heeg; Charles H. Winter","Synthesis, Structure, and Properties of Group 4 and 5 Metal Pyrazolato Chloride Complexes","Inorganic Chemistry","1999","38","","1871","1878","10.1021/ic981096p","","","0.71073","MoKα","","0.1534","0.0582","","0.0878","0.0714","","","","0.909","1.072","1.072","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321911","10.2051","0.0003","38.365","0.0012","9.7585","0.0003","90","","93.328","0.001","90","","3814.2","0.2","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H57 Cl2 N6 Nb -","- C33 H57 Cl2 N6 Nb -","- C132 H228 Cl8 N24 Nb4 -","4","1","","Carlos Yélamos; Mary Jane Heeg; Charles H. Winter","Synthesis, Structure, and Properties of Group 4 and 5 Metal Pyrazolato Chloride Complexes","Inorganic Chemistry","1999","38","","1871","1878","10.1021/ic981096p","","","0.71073","MoKα","","0.0934","0.0498","","0.1167","0.0985","","","","1.006","1.092","1.092","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321912","14.04","0.005","14.042","0.006","15.556","0.007","90","","91.75","0.03","90","","3065","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 Ba Cl2 N4 O11 -","- C24 H36 Ba Cl2 N4 O11 -","- C96 H144 Ba4 Cl8 N16 O44 -","4","1","","David Esteban; Daniel Bañobre; Rufina Bastida; Andrés de Blas; Alejandro Macías; Adolfo Rodríguez; Teresa Rodríguez-Blas; David E. Fenton; Harry Adams; José Mahía","Barium Templating Schiff-Base Lateral Macrobicycles","Inorganic Chemistry","1999","38","","1937","1944","10.1021/ic9811190","","","0.71073","MoKα","","0.0576","0.0408","","0.1107","0.1002","","","","1.019","1.046","1.046","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321913","20.6001","0.0002","15.9333","0.0002","22.4867","0.0004","90","","90","","90","","7380.75","0.18","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C31 H37 Ba Cl2 N5 O11 -","- C31 H37 Ba Cl2 N5 O11 -","- C248 H296 Ba8 Cl16 N40 O88 -","8","1","","David Esteban; Daniel Bañobre; Rufina Bastida; Andrés de Blas; Alejandro Macías; Adolfo Rodríguez; Teresa Rodríguez-Blas; David E. Fenton; Harry Adams; José Mahía","Barium Templating Schiff-Base Lateral Macrobicycles","Inorganic Chemistry","1999","38","","1937","1944","10.1021/ic9811190","","","0.71073","MoKα","","0.0919","0.0467","","","0.0938","0.1097","","","","","","0.933","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321914","14.397","0.001","19.765","0.002","28.898","0.003","87.485","0.009","79.168","0.009","85.415","0.008","8047.3","1.3","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C109 H218 Ge18 K6 N13 O36 -","- C109 H218 Ge18 K6 N13 O36 -","- C218 H436 Ge36 K12 N26 O72 -","2","1","","Thomas F. Fässler; Uwe Schütz","Conformation Isomerism of Nonagermanide Ions. Crystal Structures of Brown and Red [K-([2.2.2]crypt)]6Ge9Ge9.(ethylenediamine)x (x= 0.5, 1.5)","Inorganic Chemistry","1999","38","","1866","1870","10.1021/ic981157j","","","0.71073","MoKα","","0.1274","0.0745","","","0.1715","0.2053","","","","","","1.057","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321915","14.503","0.001","19.924","0.002","28.935","0.003","87.43","0.01","80.85","0.01","85.92","0.01","8228.9","1.3","233","2","233","2","","","","","","","","6","P -1","-P 1","2","","","","- C108 H216 Ge18 K6 N12 O36 -","- C110.5 H217 Ge18 K6 N15 O36 -","- C221 H434 Ge36 K12 N30 O72 -","2","1","","Thomas F. Fässler; Uwe Schütz","Conformation Isomerism of Nonagermanide Ions. Crystal Structures of Brown and Red [K-([2.2.2]crypt)]6Ge9Ge9.(ethylenediamine)x (x= 0.5, 1.5)","Inorganic Chemistry","1999","38","","1866","1870","10.1021/ic981157j","","","0.71073","MoKα","","0.1365","0.0884","","","0.2334","0.2691","","","","","","1.064","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321916","15.095","0.005","18.838","0.004","21.811","0.006","68.21","0.07","77.31","0.05","85.31","0.05","5618","4","296","","296","","","","","","","","","7","P -1","-P 1","2","","","","- C78 H71 Cl2 N3 O P4 Re2 -","- C91.3333 Cl2 N3.33333 O0.666667 P4 Re2 -","- C274 Cl6 N10 O2 P12 Re6 -","3","1.5","","Yan Ding; Wengan Wu; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 18.1 The Isolation and Characterization of Isomers of the [Re2Cl2(μ-dppm)2(CO)(CNXyl)3]2+ Cation and Its Monocationic and Neutral Congeners","Inorganic Chemistry","1999","38","","1918","1928","10.1021/ic981192q","","","0.71073","Mo-Kα","","","0.05","","","","0.126","","","","","","1.099","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321917","15.003","0.002","33.588","0.013","16.215","0.005","90","","92.031","0.016","90","","8166","4","203","","203","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C96 H89 Cl2 N3 O P4 Re2 -","- C96 H89 Cl2 N3 O P4 Re2 -","- C384 H356 Cl8 N12 O4 P16 Re8 -","4","1","","Yan Ding; Wengan Wu; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 18.1 The Isolation and Characterization of Isomers of the [Re2Cl2(μ-dppm)2(CO)(CNXyl)3]2+ Cation and Its Monocationic and Neutral Congeners","Inorganic Chemistry","1999","38","","1918","1928","10.1021/ic981192q","","","0.71073","Mo-Kα","","0.063","0.034","","0.092","0.082","","","","1.018","1.042","1.042","","","","","has coordinates","189236","2020-10-21","18:00:00",""
"4321918","23.582","0.005","16.344","0.006","23.656","0.006","90","","109.091","0.018","90","","8616","4","295","","295","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C80.86 Cl3.72 F6 N3 O7 P4 Re2 S2 -","- C81 H73 Cl4 F6 N3 O7 P4 Re2 S2 -","- C324 H292 Cl16 F24 N12 O28 P16 Re8 S8 -","4","1","","Yan Ding; Wengan Wu; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 18.1 The Isolation and Characterization of Isomers of the [Re2Cl2(μ-dppm)2(CO)(CNXyl)3]2+ Cation and Its Monocationic and Neutral Congeners","Inorganic Chemistry","1999","38","","1918","1928","10.1021/ic981192q","","","0.71073","Mo-Kα","","0.098","0.062","","0.215","0.177","","","","1.111","1.082","1.082","","","","","has coordinates","189235","2020-10-21","18:00:00",""
"4321919","22.642","0.005","13.96","0.005","32.725","0.015","90","","109.65","0.03","90","","9741","6","295","","295","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C89.75 Cl5.25 F5.25 N3 O6.25 P4 Re2 S1.75 -","- C91 H83 Cl7 F6 N3 O7 P4 Re2 S2 -","- C364 H332 Cl28 F24 N12 O28 P16 Re8 S8 -","4","1","","Yan Ding; Wengan Wu; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 18.1 The Isolation and Characterization of Isomers of the [Re2Cl2(μ-dppm)2(CO)(CNXyl)3]2+ Cation and Its Monocationic and Neutral Congeners","Inorganic Chemistry","1999","38","","1918","1928","10.1021/ic981192q","","","0.71073","Mo-Kα","","0.072","0.045","","0.151","0.128","","","","1.143","1.107","1.107","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321920","15.663","0.004","23.826","0.006","22.492","0.006","90","","107.26","0.02","90","","8016","4","203","","203","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C81 Cl6 F3 N3 O4 P4 Re2 S -","- C82 H75 Cl7 F3 N3 O5 P4 Re2 S -","- C328 H300 Cl28 F12 N12 O20 P16 Re8 S4 -","4","1","","Yan Ding; Wengan Wu; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 18.1 The Isolation and Characterization of Isomers of the [Re2Cl2(μ-dppm)2(CO)(CNXyl)3]2+ Cation and Its Monocationic and Neutral Congeners","Inorganic Chemistry","1999","38","","1918","1928","10.1021/ic981192q","","","0.71073","Mo-Kα","","","0.037","","","","0.09","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321921","15.1232","0.0005","23.6696","0.0008","24.4036","0.0008","111.299","0.0019","96.439","0.002","104.598","0.002","7672.5","0.5","296","","296","","","","","","","","","7","P -1","-P 1","2","","","","- C78 H71 Cl2 N3 O P4 Re2 -","- C78 Cl2 N3 O P4 Re2 -","- C312 Cl8 N12 O4 P16 Re8 -","4","2","","Yan Ding; Wengan Wu; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 18.1 The Isolation and Characterization of Isomers of the [Re2Cl2(μ-dppm)2(CO)(CNXyl)3]2+ Cation and Its Monocationic and Neutral Congeners","Inorganic Chemistry","1999","38","","1918","1928","10.1021/ic981192q","","","0.71073","MO-Kα","","","0.081","","","","0.213","","","","","","0.891","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321922","14.07","0.003","15.68","0.004","20.542","0.005","76.73","0.02","75.93","0.02","87.935","0.018","4277.7","1.8","296","","296","","","","","","","","","8","P -1","-P 1","2","","","","- C78 Cl2 F3 N3 O4 P4 Re2 S -","- C78 Cl2 N3 O P4 Re2 -","- C156 Cl4 N6 O2 P8 Re4 -","2","1","","Yan Ding; Wengan Wu; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 18.1 The Isolation and Characterization of Isomers of the [Re2Cl2(μ-dppm)2(CO)(CNXyl)3]2+ Cation and Its Monocationic and Neutral Congeners","Inorganic Chemistry","1999","38","","1918","1928","10.1021/ic981192q","","","1.54184","Cu-Kα","","","0.105","","","","0.214","","","","","","1.106","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321923","18.571","0.004","28.138","0.006","20.567","0.009","90","","119.14","0.02","90","","9387","5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Tetrakis[(mu2-2-pyridylmethanolato(N,O))(2,4,6-triisopropylthiophenolato)zinc] hexane solvate","","- C90 H130 N4 O4 S4 Zn4 -","- C90 H129 N4 O4 S4 Zn4 -","- C360 H516 N16 O16 S16 Zn16 -","4","1","","Bodo Müller; Astrid Schneider; Markus Tesmer; Heinrich Vahrenkamp","Alcohol and Aldehyde Adducts of Zinc Thiolates: Structural Modeling of Alcoholdehydrogenase","Inorganic Chemistry","1999","38","","1900","1907","10.1021/ic981227m","","","0.71073","MoKα","","0.0545","0.0374","","","0.0937","0.105","","","","","","1.065","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4321924","13.806","0.002","13.806","0.002","36.254","0.007","90","","90","","90","","6910.2","1.9","293","2","173","2","","","","","","","","8","I 41/a :2","-I 4ad","88","Tetrakis[(2-quinolylmethanolato)-zinc-(pentafluorothiophenolate)]","","","- C66 H36 Cl4 F20 N4 O4 S4 Zn4 -","- C66 H36 Cl4 F20 N4 O4 S4 Zn4 -","- C264 H144 Cl16 F80 N16 O16 S16 Zn16 -","4","0.25","","Bodo Müller; Astrid Schneider; Markus Tesmer; Heinrich Vahrenkamp","Alcohol and Aldehyde Adducts of Zinc Thiolates: Structural Modeling of Alcoholdehydrogenase","Inorganic Chemistry","1999","38","","1900","1907","10.1021/ic981227m","","","0.71073","MoKα","","0.0512","0.0405","","","0.104","0.1126","","","","","","1.054","","","","has coordinates","295934","2024-11-15","12:47:25",""
"4321925","8.115","0.0006","11.237","0.0009","13.852","0.0011","92.81","0.006","91.32","0.007","95.04","0.007","1256.27","0.17","183","2","183","2","","","","","","","Tetrahydrofurane/Dichloromethane/Petrolether 60/70","6","P -1","-P 1","2","Bis[(2-dimethylammonium)benzylato-zincdibromide]","","","- C18 H26 Br4 N2 O2 Zn2 -","- C18 H26 Br4 N2 O2 Zn2 -","- C36 H52 Br8 N4 O4 Zn4 -","2","1","","Bodo Müller; Astrid Schneider; Markus Tesmer; Heinrich Vahrenkamp","Alcohol and Aldehyde Adducts of Zinc Thiolates: Structural Modeling of Alcoholdehydrogenase","Inorganic Chemistry","1999","38","","1900","1907","10.1021/ic981227m","","","0.71073","MoKα","","0.0699","0.0331","","","0.0745","0.0858","","","","","","1.064","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4321926","13.887","0.003","10.562","0.002","15.353","0.003","90","","115.46","0.03","90","","2033.2","0.9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","[Bis(pentafluorothiophenolato)(methylpyridylmethanol)zinc]","[Bis(pentafluorothiophenolato)(6-methyl-2-pyridylmethanol(N,O))zinc]","","- C19 H9 F10 N O S2 Zn -","- C19.4525 H8 F10 N O S2 Zn -","- C77.81 H32 F40 N4 O4 S8 Zn4 -","4","1","","Bodo Müller; Astrid Schneider; Markus Tesmer; Heinrich Vahrenkamp","Alcohol and Aldehyde Adducts of Zinc Thiolates: Structural Modeling of Alcoholdehydrogenase","Inorganic Chemistry","1999","38","","1900","1907","10.1021/ic981227m","","","0.71073","MoKα","","0.0577","0.0525","","","0.1376","0.1432","","","","","","1.06","","","","has coordinates","295934","2024-11-15","12:47:25",""
"4321927","15.591","0.004","7.2274","0.0015","40.355","0.005","90","0.019","90","0.02","90","0.03","4547.3","1.6","200","2","200","2","","","","","","","2,4,6-Trimethylbenzaldehyde/Petrolether 60/70","6","P b c a","-P 2ac 2ab","61","catena-Poly{[(2,4,6-trimethylbenzaldehyde)pentafluorothiophenolato-zinc] -pentafluorothiophenolato}'","","","- C22 H12 F10 O S2 Zn -","- C22 H12 F10 O S2 Zn -","- C176 H96 F80 O8 S16 Zn8 -","8","1","","Bodo Müller; Astrid Schneider; Markus Tesmer; Heinrich Vahrenkamp","Alcohol and Aldehyde Adducts of Zinc Thiolates: Structural Modeling of Alcoholdehydrogenase","Inorganic Chemistry","1999","38","","1900","1907","10.1021/ic981227m","","","0.71073","MoKα","","0.1661","0.1285","","","0.3142","0.3462","","","","","","1.112","","","","has coordinates","295934","2024-11-15","12:47:25",""
"4321928","12.763","0.008","14.058","0.007","11.602","0.008","90","0.05","90","0.05","90","0.04","2082","2","293","2","293","2","","","","","","","Tetrahydrofurane/Dichloromethane/Petrolether 60/70","7","P c a 21","P 2c -2ac","29","(6-Methyl-pyridine-2-carbaldehyde)zinc-bis(pentafluorothiophenolate)","","","- C19 H7 F10 N O S2 Zn -","- C19 H7 F10 N O S2 Zn -","- C76 H28 F40 N4 O4 S8 Zn4 -","4","1","","Bodo Müller; Astrid Schneider; Markus Tesmer; Heinrich Vahrenkamp","Alcohol and Aldehyde Adducts of Zinc Thiolates: Structural Modeling of Alcoholdehydrogenase","Inorganic Chemistry","1999","38","","1900","1907","10.1021/ic981227m","","","0.71073","MoKα","","0.1723","0.0649","","","0.1461","0.194","","","","","","1.089","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4321929","8.746","0.002","8.777","0.002","13.782","0.003","100.22","0.03","92.17","0.03","95.12","0.03","1035.5","0.4","173","2","293","2","","","","","","","","7","P -1","-P 1","2","MetPCAZn(PFTP)2","(6-Methoxy-2-pyridylcarbaldehyd)-zinc-bis(pentafluorothiophenolate)","","- C19 H7 F10 N O2 S2 Zn -","- C19 H7 F10 N O2 S2 Zn -","- C38 H14 F20 N2 O4 S4 Zn2 -","2","1","","Bodo Müller; Astrid Schneider; Markus Tesmer; Heinrich Vahrenkamp","Alcohol and Aldehyde Adducts of Zinc Thiolates: Structural Modeling of Alcoholdehydrogenase","Inorganic Chemistry","1999","38","","1900","1907","10.1021/ic981227m","","","0.71073","MoKα","","0.0345","0.0246","","","0.0641","0.0694","","","","","","1.049","","","","has coordinates","295934","2024-11-15","12:47:25",""
"4321930","11.064","0.004","7.51","0.002","13.779","0.003","90","0.02","90.6","0.02","90","0.03","1144.8","0.6","293","2","293","2","","","","","","","Dichloromethane/Petrolether 60/70","7","P 1 21 1","P 2yb","4","(2-Dimethylaminobenzaldehyde)-zinc-bis(pentafluorothiophenolate)","","","- C21 H11 F10 N O S2 Zn -","- C21 H11 F10 N O S2 Zn -","- C42 H22 F20 N2 O2 S4 Zn2 -","2","1","","Bodo Müller; Astrid Schneider; Markus Tesmer; Heinrich Vahrenkamp","Alcohol and Aldehyde Adducts of Zinc Thiolates: Structural Modeling of Alcoholdehydrogenase","Inorganic Chemistry","1999","38","","1900","1907","10.1021/ic981227m","","","0.71073","MoKα","","0.2373","0.058","","","0.1354","0.188","","","","","","1.02","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4321931","7.712","0.002","11.702","0.002","15.247","0.003","81.94","0.03","78.75","0.03","73.5","0.03","1288.7","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Bis-(N-methylimidazole-2-carbaldehyde)-zinc-bis-(pentafluorthiphenolate)","","","- C22 H12 F10 N4 O2 S2 Zn -","- C22 H12 F10 N4 O2 S2 Zn -","- C44 H24 F20 N8 O4 S4 Zn2 -","2","1","","Bodo Müller; Astrid Schneider; Markus Tesmer; Heinrich Vahrenkamp","Alcohol and Aldehyde Adducts of Zinc Thiolates: Structural Modeling of Alcoholdehydrogenase","Inorganic Chemistry","1999","38","","1900","1907","10.1021/ic981227m","","","0.71073","MoKα","","0.0662","0.0373","","","0.0924","0.106","","","","","","1.048","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321932","33.838","0.008","13.826","0.003","29.944","0.007","90","","98.844","0.012","90","","13843","6","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C62 H59 Cl4 Co4 N11 O25 -","- C63.75 H48 Cl4 Co4 N10 O26.25 -","- C510 H384 Cl32 Co32 N80 O210 -","8","1","","Katerina Dimitrou; Angelica D. Brown; Kirsten Folting; George Christou","[Co4O4]4+ Cubane Core as a Brønsted Base: Preparation and Properties of [Co4O3(OH)(O2CR)2(bpy)2]3+ and [Co4O2(OH)2(O2CR)2(bpy)2]4+ Salts","Inorganic Chemistry","1999","38","","1834","1841","10.1021/ic981237n","","","0.71069","MoKα","","","0.0832","","","","0.0752","","","","","","0","","","","has coordinates,has disorder","179322","2020-10-21","18:00:00",""
"4321933","22.603","0.004","34.759","0.006","18.167","0.003","90","","90","","90","","14273","4","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C63 H53 Ce Co4 N15 O27 -","- C59.5 H48.5 Ce Co4 N14.5 O26.6667 -","- C476 H388 Ce8 Co32 N116 O213.333 -","8","1","","Katerina Dimitrou; Angelica D. Brown; Kirsten Folting; George Christou","[Co4O4]4+ Cubane Core as a Brønsted Base: Preparation and Properties of [Co4O3(OH)(O2CR)2(bpy)2]3+ and [Co4O2(OH)2(O2CR)2(bpy)2]4+ Salts","Inorganic Chemistry","1999","38","","1834","1841","10.1021/ic981237n","","","0.71069","MoKα","","","0.0863","","","","0.0878","","","","","","2.0077","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4321934","8.001","0.005","22.99","0.02","4.982","0.003","90","","90","","90","","916.4","1.1","296","","296","","","","","","","","","6","I 2 2 2","I 2 2","23","","","","- C12 H28 Cl N6 Ni O6 -","- C12 H28 Cl N8 Ni O8 -","- C24 H56 Cl2 N16 Ni2 O16 -","2","0.25","","Masahiro Yamashita; Toshio Manabe; Kazuo Inoue; Takuya Kawashima; Hiroshi Okamoto; Hiroshi Kitagawa; Tadaoki Mitani; Koshiro Toriumi; Hiroshi Miyamae; Ryuichi Ikeda","Tuning of Spin Density Wave Strengths in Quasi-One-Dimensional Halogen-Bridged NiIII Complexes with Strong Electron Correlations, [NiIII(chxn)2X]Y2","Inorganic Chemistry","1999","38","","1894","1899","10.1021/ic9812499","","","0.71069","xray_tube","","0.073","0.066","","0.058","0.058","","","","5.241","5.533","5.533","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4321935","12.564","0.003","11.628","0.004","15.235","0.007","90","","93.64","0.03","90","","2221.3","1.4","293","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H50 Cu3 N6 O23 -","- C32 H28 Cu2.5 N6 O23 -","- C64 H56 Cu5 N12 O46 -","2","0.5","","Quanming Wang; Xintao Wu; Wenjian Zhang; Tianlu Sheng; Ping Lin; Jianmin Li","Solids with Rhombic Channels: Syntheses and Crystal Structures of [Cu3(NTA)2(4,4'-bpy)2(H2O)2].9H2O and [{Cu(4,4'-bpy)(H2O)4}{Cu2(NTA)2(4,4'-bpy)}]. 7H2O (NTA = Nitrilotriacetate, 4,4'-bpy = 4,4'-Bipyridine)","Inorganic Chemistry","1999","38","","2223","2226","10.1021/ic9802799","","","0.71069","MoKα","","","0.065","","","0.0944","","","","","1.88","1.88","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321936","16.8055","0.0003","23.7656","0.0001","11.1653","0.0002","90","","102.227","0.001","90","","4358.19","0.11","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H50 Cu3 N6 O23 -","- C32 H28 Cu3 N6 O23 -","- C128 H112 Cu12 N24 O92 -","4","1","","Quanming Wang; Xintao Wu; Wenjian Zhang; Tianlu Sheng; Ping Lin; Jianmin Li","Solids with Rhombic Channels: Syntheses and Crystal Structures of [Cu3(NTA)2(4,4'-bpy)2(H2O)2].9H2O and [{Cu(4,4'-bpy)(H2O)4}{Cu2(NTA)2(4,4'-bpy)}]. 7H2O (NTA = Nitrilotriacetate, 4,4'-bpy = 4,4'-Bipyridine)","Inorganic Chemistry","1999","38","","2223","2226","10.1021/ic9802799","","","0.71073","MoKα","","0.1019","0.068","","0.2007","0.1668","","","","1.011","1.021","1.021","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321937","14.574","0.001","13.312","0.001","19.142","0.002","90","","103.78","","90","","3606.8","0.5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H48 N2 O Pt Se2 Sn2 -","- C27 H48 N2 O Pt Se2 Sn2 -","- C108 H192 N8 O4 Pt4 Se8 Sn8 -","4","1","","Michael C. Janzen; Hilary A. Jenkins; Louis M. Rendina; Jagadese J. Vittal; Richard J. Puddephatt","Synthesis of Metallacycles by Oxidative Addition of Sn-S, Sn-Se, Sn-Te, and Ge-Te Containing Precursors to Platinum(II)","Inorganic Chemistry","1999","38","","2123","2130","10.1021/ic980862p","","","0.71073","MoKα","","0.0642","0.0324","","0.0708","0.0652","","","","0.877","1.022","1.022","","","","","has coordinates,has disorder","179322","2020-10-21","18:00:00",""
"4321938","12.305","0.001","16.667","0.001","20.999","0.002","90","","92.58","0.01","90","","4302.3","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 N2 Pt S2 Sn2 -","- C44 H50 N2 Pt S2 Sn2 -","- C176 H200 N8 Pt4 S8 Sn8 -","4","1","","Michael C. Janzen; Hilary A. Jenkins; Louis M. Rendina; Jagadese J. Vittal; Richard J. Puddephatt","Synthesis of Metallacycles by Oxidative Addition of Sn-S, Sn-Se, Sn-Te, and Ge-Te Containing Precursors to Platinum(II)","Inorganic Chemistry","1999","38","","2123","2130","10.1021/ic980862p","","","0.71073","MoKα","","0.0681","0.0402","","0.0915","0.0811","","","","1.019","1.056","1.056","","","","","has coordinates,has disorder","179322","2020-10-21","18:00:00",""
"4321939","12.3717","0.0014","16.702","0.002","21.113","0.007","90","","92.26","0.02","90","","4359.2","1.6","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 N2 Pt Se2 Sn2 -","- C44 H50 N2 Pt Se2 Sn2 -","- C176 H200 N8 Pt4 Se8 Sn8 -","4","1","","Michael C. Janzen; Hilary A. Jenkins; Louis M. Rendina; Jagadese J. Vittal; Richard J. Puddephatt","Synthesis of Metallacycles by Oxidative Addition of Sn-S, Sn-Se, Sn-Te, and Ge-Te Containing Precursors to Platinum(II)","Inorganic Chemistry","1999","38","","2123","2130","10.1021/ic980862p","","","0.71073","MoKα","","0.0887","0.0481","","0.1221","0.1036","","","","1.065","1.123","1.123","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321940","12.481","0.003","16.848","0.004","21.204","0.005","90","","92.05","0.02","90","","4455.9","1.8","294","2","294","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 N2 Pt Sn2 Te2 -","- C44 H50 N2 Pt Sn2 Te2 -","- C176 H200 N8 Pt4 Sn8 Te8 -","4","1","","Michael C. Janzen; Hilary A. Jenkins; Louis M. Rendina; Jagadese J. Vittal; Richard J. Puddephatt","Synthesis of Metallacycles by Oxidative Addition of Sn-S, Sn-Se, Sn-Te, and Ge-Te Containing Precursors to Platinum(II)","Inorganic Chemistry","1999","38","","2123","2130","10.1021/ic980862p","","","0.71073","MoKα","","0.0846","0.0599","","0.1721","0.1556","","","","1.066","1.131","1.131","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321941","18.116","0.004","10.335","0.003","19.414","0.005","90","","95.568","0.007","90","","3617.7","1.6","173","2","173","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C13 H8 Cs5 K N12 O3 S4 W4 -","- C13 Cs5 K N12 O3 S4 W4 -","- C52 Cs20 K4 N48 O12 S16 W16 -","4","1","","V. P. Fedin; I. V. Kalinina; D. G. Samsonenko; Y. V. Mironov; M. N. Sokolov; S. V. Tkachev; A. V. Virovets; N. V. Podberezskaya; M. R. J. Elsegood; W. Clegg; A. G. Sykes","Synthesis, Structure, and Properties of Molybdenum and Tungsten Cyano Complexes with Cuboidal M4(μ3-E4) (M = Mo, W; E = S, Se, Te) Cores","Inorganic Chemistry","1999","38","","1956","1965","10.1021/ic980956z","","","0.71073","MoKα","","0.074","0.0451","","","0.089","0.0951","","","","","","0.99","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321942","14.175","0.001","21.298","0.002","13.725","0.002","90","","90","","90","","4143.6","0.8","293","2","293","2","","","","","","","","7","C m m a","-C 2a 2","67","","","","- C12 H12 K6 N12 O6 Se4 W4 -","- C12 K6.0002 N12 O6 Se4 W4 -","- C48 K24.0008 N48 O24 Se16 W16 -","4","0.25","","V. P. Fedin; I. V. Kalinina; D. G. Samsonenko; Y. V. Mironov; M. N. Sokolov; S. V. Tkachev; A. V. Virovets; N. V. Podberezskaya; M. R. J. Elsegood; W. Clegg; A. G. Sykes","Synthesis, Structure, and Properties of Molybdenum and Tungsten Cyano Complexes with Cuboidal M4(μ3-E4) (M = Mo, W; E = S, Se, Te) Cores","Inorganic Chemistry","1999","38","","1956","1965","10.1021/ic980956z","","","0.71069","MoKα","","0.1056","0.0473","","","0.1332","0.1558","","","","","","0.917","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321943","12.399","0.001","13.187","0.001","13.496","0.001","83.712","0.008","66.575","0.008","63.223","0.009","1801.1","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C12 H10 K6 N12 O5 Te4 W4 -","- C12 K6 N12 O5 Te4 W4 -","- C24 K12 N24 O10 Te8 W8 -","2","1","","V. P. Fedin; I. V. Kalinina; D. G. Samsonenko; Y. V. Mironov; M. N. Sokolov; S. V. Tkachev; A. V. Virovets; N. V. Podberezskaya; M. R. J. Elsegood; W. Clegg; A. G. Sykes","Synthesis, Structure, and Properties of Molybdenum and Tungsten Cyano Complexes with Cuboidal M4(μ3-E4) (M = Mo, W; E = S, Se, Te) Cores","Inorganic Chemistry","1999","38","","1956","1965","10.1021/ic980956z","","","0.71069","MoKα","","0.0796","0.0696","","","0.2151","0.2213","","","","","","1.143","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321944","11.617","0.001","10.124","0.002","17.473","0.004","90","","100.75","0.01","90","","2018.9","0.6","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C12 H4 Cs6 Mo4 N12 O2 Te4 -","- C12 Cs6 Mo4 N12 O2 Te4 -","- C24 Cs12 Mo8 N24 O4 Te8 -","2","1","","V. P. Fedin; I. V. Kalinina; D. G. Samsonenko; Y. V. Mironov; M. N. Sokolov; S. V. Tkachev; A. V. Virovets; N. V. Podberezskaya; M. R. J. Elsegood; W. Clegg; A. G. Sykes","Synthesis, Structure, and Properties of Molybdenum and Tungsten Cyano Complexes with Cuboidal M4(μ3-E4) (M = Mo, W; E = S, Se, Te) Cores","Inorganic Chemistry","1999","38","","1956","1965","10.1021/ic980956z","","","0.71069","MoKα","","0.0939","0.0634","","","0.1466","0.1542","","","","","","0.826","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321945","12.112","0.001","21.736","0.002","16.109","0.001","90","","90","","90","","4241","0.6","293","2","293","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C12 H24 K7 Mo4 N12 O12 Te4 -","- C12 K7 Mo4 N12 O12 Te4 -","- C48 K28 Mo16 N48 O48 Te16 -","4","0.5","","V. P. Fedin; I. V. Kalinina; D. G. Samsonenko; Y. V. Mironov; M. N. Sokolov; S. V. Tkachev; A. V. Virovets; N. V. Podberezskaya; M. R. J. Elsegood; W. Clegg; A. G. Sykes","Synthesis, Structure, and Properties of Molybdenum and Tungsten Cyano Complexes with Cuboidal M4(μ3-E4) (M = Mo, W; E = S, Se, Te) Cores","Inorganic Chemistry","1999","38","","1956","1965","10.1021/ic980956z","","","0.71069","MoKα","","0.0609","0.0471","","","0.1214","0.1253","","","","","","1.132","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321946","8.1658","0.0002","15.0563","0.0002","26.5791","0.0003","90","","90.3653","0.0006","90","","3267.75","0.1","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H18 Cr O3 S3 Si -","- C10 H18 Cr O3 S3 Si -","- C80 H144 Cr8 O24 S24 Si8 -","8","2","","Hing W. Yim; Linh M. Tran; Ebern D. Dobbin; Daniel Rabinovich; Louise M. Liable-Sands; Christopher D. Incarvito; Kin-Chung Lam; Arnold L. Rheingold","Tris[(alkylthio)methyl]silanes: Syntheses and Structures of Chromium, Molybdenum, and Tungsten Complexes with a Tripodal Thioether Ligand","Inorganic Chemistry","1999","38","","2211","2215","10.1021/ic981001j","","","0.71073","MoKα","","0.0654","0.0474","","","0.1503","0.1702","","","","","","1.255","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321947","8.3463","0.00006","15.2747","0.0002","27.1865","0.0004","90","","90.8987","0.0009","90","","3465.51","0.07","198","2","198","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H18 Mo O3 S3 Si -","- C10 H18 Mo O3 S3 Si -","- C80 H144 Mo8 O24 S24 Si8 -","8","2","","Hing W. Yim; Linh M. Tran; Ebern D. Dobbin; Daniel Rabinovich; Louise M. Liable-Sands; Christopher D. Incarvito; Kin-Chung Lam; Arnold L. Rheingold","Tris[(alkylthio)methyl]silanes: Syntheses and Structures of Chromium, Molybdenum, and Tungsten Complexes with a Tripodal Thioether Ligand","Inorganic Chemistry","1999","38","","2211","2215","10.1021/ic981001j","","","0.71073","MoKα","","0.0338","0.026","","0.0634","0.0603","","","","1.064","1.103","1.103","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321948","8.1582","0.0002","14.9903","0.0002","26.7268","0.0004","90","","90.6568","0.0008","90","","3268.31","0.1","198","2","198","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H18 O3 S3 Si W -","- C10 H18 O3 S3 Si W -","- C80 H144 O24 S24 Si8 W8 -","8","2","","Hing W. Yim; Linh M. Tran; Ebern D. Dobbin; Daniel Rabinovich; Louise M. Liable-Sands; Christopher D. Incarvito; Kin-Chung Lam; Arnold L. Rheingold","Tris[(alkylthio)methyl]silanes: Syntheses and Structures of Chromium, Molybdenum, and Tungsten Complexes with a Tripodal Thioether Ligand","Inorganic Chemistry","1999","38","","2211","2215","10.1021/ic981001j","","","0.71073","MoKα","","0.0756","0.0404","","","0.0762","0.0902","","","","","","0.871","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321949","17.5677","0.0003","42.8491","0.0003","21.0196","0.0003","90","","90.613","0.001","90","","15821.8","0.4","169","","273.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C80 H72 F6 Mo N8 P Ru -","- C92.5 H85 Cl F6 Mo N8 P Ru -","- C740 H680 Cl8 F48 Mo8 N64 P8 Ru8 -","8","2","","James P. Collman; S. T. Harford; Stefan Franzen; Jean-Claude Marchon; Pascale Maldivi; Andrew P. Shreve; William H. Woodruff","Resonance Raman, X-ray Crystallographic, and Magnetic Susceptibility Studies of Metal-Metal-Bonded MoRu and WOs Porphyrin Dimers. 1. Evidence for an Unusual MO Diagram","Inorganic Chemistry","1999","38","","2085","2092","10.1021/ic981032e","","","0.7107","MoKalpha","","","0.08","","","0.093","","","","","2.15","2.15","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321950","9.378","0.002","14.231","0.003","21.049","0.002","90","","91.603","0.015","90","","2808.1","0.9","294.2","","294.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25.5 H23 Cl I2 P2 Pd S -","- C25.5 H22 Cl I2 P2 Pd S -","- C102 H88 Cl4 I8 P8 Pd4 S4 -","4","1","","Terrance Y. H. Wong; Steven J. Rettig; Brian R. James","Kinetic and Mechanistic Aspects of Sulfur Recovery from Pd~2~I~2~(μ-S)(μ-dpm)~2~ Using I2 and Structures of Pd(II) Complexes with the Chelated Monosulfide of dpm","Inorganic Chemistry","1999","38","","2143","2149","10.1021/ic981039w","","","0.7107","MoKα","","","0.035","","","","0.028","","","","","","1.32","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321951","11.6116","0.0011","11.8126","0.001","10.3623","0.0007","97.898","0.006","96.011","0.007","80.174","0.008","1382.4","0.2","294.2","","294.2","","","","","","","","","6","P -1","-P 1","2","","","","- C52 H48 Cl6 P4 Pd S2 -","- C52 H48 Cl6 P4 Pd0.5 S2 -","- C52 H48 Cl6 P4 Pd0.5 S2 -","1","0.5","","Terrance Y. H. Wong; Steven J. Rettig; Brian R. James","Kinetic and Mechanistic Aspects of Sulfur Recovery from Pd~2~I~2~(μ-S)(μ-dpm)~2~ Using I2 and Structures of Pd(II) Complexes with the Chelated Monosulfide of dpm","Inorganic Chemistry","1999","38","","2143","2149","10.1021/ic981039w","","","0.7107","MoKα","","","0.036","","","","0.033","","","","","","1.77","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321952","23.739","0.005","13.37","0.005","14.903","0.005","90","0.005","90","0.005","90","0.005","4730","3","293","2","293","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C35 H61 Cl4 N5 O17 Pd -","- C35 H61 Cl4 N5 O17 Pd -","- C140 H244 Cl16 N20 O68 Pd4 -","4","1","","Andrea Bencini; Antonio Bianchi; Vieri Fusi; Claudia Giorgi; Piero Paoletti; Jose; Antonio; Ramirez'; Barbara Valtancoli","Palladium(II) Complexation byp-Cyclophane Receptors. A Solution and Solid State Study","Inorganic Chemistry","1999","38","","2064","2070","10.1021/ic9810891","","","0.71069","MoKα","","0.2359","0.064","","0.2261","0.151","","","","0.987","1.106","1.106","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321953","10.469","0.0011","13.307","0.002","15.152","0.002","74.98","0.01","78.19","0.009","83.48","0.012","1991.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H50 Cl4 N6 O9 Pd2 -","- C30 H50 Cl4 N6 O9 Pd2 -","- C60 H100 Cl8 N12 O18 Pd4 -","2","1","","Andrea Bencini; Antonio Bianchi; Vieri Fusi; Claudia Giorgi; Piero Paoletti; Jose; Antonio; Ramirez'; Barbara Valtancoli","Palladium(II) Complexation byp-Cyclophane Receptors. A Solution and Solid State Study","Inorganic Chemistry","1999","38","","2064","2070","10.1021/ic9810891","","","0.71069","MoKα","","0.0976","0.079","","0.2403","0.191","","","","1.012","1.047","1.047","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321954","21.9919","0.0009","16.4156","0.0007","23.3225","0.001","90","","95.36","0.0001","90","","8382.8","0.6","293","2","298","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","[12]mercuracarborand-4 . 2 K-18-crown-6 . 2 NO~3~ . 2 H~2~O . 1 (CH~3~)~2~C=O","","","- C35 H98 B40 Hg4 K2 N2 O21 -","- C35 H95 B40 Hg4 K2 N2 O21 -","- C140 H380 B160 Hg16 K8 N8 O84 -","4","1","","Alfred A. Zinn; Carolyn B. Knobler; David E. Harwell; M. Frederick Hawthorne","Molecular Aggregates of Nitrate Ion with the Tetravalent Lewis Acid Host 12-Mercuracarborand-4: Novel Trihapto Coordination of NO3-","Inorganic Chemistry","1999","38","","2227","2230","10.1021/ic9811244","","","0.7107","MoKα","","0.2134","0.0712","","0.2837","0.192","","","","1.12","1.361","1.361","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321955","12.427","0.0007","12.8492","0.0007","13.634","0.0008","102.55","0.02","100.63","0.03","109.075","0.01","1929.8","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","[12]mercuracarborand-4.3KNO~3~.K-18-crown-6","","- C32 H88 B40 Hg4 K2 N2 O18 -","- C32 H88 B40 Hg4 K2 N2 O18 -","- C32 H88 B40 Hg4 K2 N2 O18 -","1","0.5","","Alfred A. Zinn; Carolyn B. Knobler; David E. Harwell; M. Frederick Hawthorne","Molecular Aggregates of Nitrate Ion with the Tetravalent Lewis Acid Host 12-Mercuracarborand-4: Novel Trihapto Coordination of NO3-","Inorganic Chemistry","1999","38","","2227","2230","10.1021/ic9811244","","","0.7107","MoKα","","0.1751","0.0672","","0.2377","0.1672","","","","0.96","1.081","1.081","","","","","has coordinates","187017","2020-10-21","18:00:00",""
"4321956","13.927","0.002","13.927","0.002","6.409","0.001","90","","90","","90","","1243.1","0.3","295","2","293","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","","","","- C64 H32 I2 N16 Yb -","- C64 H32 I2 N16 Yb -","- C64 H32 I2 N16 Yb -","1","0.0625","","Jan Janczak; Ryszard Kubiak; Adam Jezierski","Mixed-Valence, Disordered Structures and Characterization of Iodine-Doped Phthalocyanines: [YbPc2]I2 and [(AsPc)(Pc)]I2","Inorganic Chemistry","1999","38","","2043","2049","10.1021/ic981168c","","","0.71073","MoKα","","0.0934","0.039","","","0.0951","0.1124","","","","","","1.068","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321957","13.926","0.002","13.926","0.002","6.433","0.001","90","","90","","90","","1247.6","0.3","295","2","293","2","","","","","","","","5","P 4/m c c","-P 4 2c","124","","","","- C32 H16 As0.5 I N8 -","- C32 H16 As0.5 I N8 -","- C64 H32 As I2 N16 -","2","0.125","","Jan Janczak; Ryszard Kubiak; Adam Jezierski","Mixed-Valence, Disordered Structures and Characterization of Iodine-Doped Phthalocyanines: [YbPc2]I2 and [(AsPc)(Pc)]I2","Inorganic Chemistry","1999","38","","2043","2049","10.1021/ic981168c","","","0.71073","MoKα","","0.1249","0.0638","","","0.1665","0.2008","","","","","","0.965","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321958","14.628","0.004","13.787","0.004","18.084","0.005","90","","112.46","0.02","90","","3370.5","1.7","295","","295","","","","","","","","chemical synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H28 As Cr N4 O9 -","- C36 H28 As Cr N4 O9 -","- C144 H112 As4 Cr4 N16 O36 -","4","1","","Giovanni De Munno; Donatella Armentano; Miguel Julve; Francesc Lloret; Rodrigue Lescouëzec; Juan Faus","Two-Dimensional Assembling of (2,2'-Bipyrimidine)bis(oxalato)chromate(III) Units through Alkaline Cations","Inorganic Chemistry","1999","38","","2234","2237","10.1021/ic981232q","","","0.71073","MoKα","","14.44","6.1","","12.18","7.94","","","","","1.69","1.69","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321959","9.886","0.003","17.388","0.005","6.029","0.002","90","","103.33","0.02","90","","1008.5","0.5","295","","295","","","","","","","","chemical synthesis","6","C 1 2 1","C 2y","5","","","","- C12 H6 Cr N4 Na O13 -","- C12 H6 Cr N4 Na O13 -","- C24 H12 Cr2 N8 Na2 O26 -","2","0.5","","Giovanni De Munno; Donatella Armentano; Miguel Julve; Francesc Lloret; Rodrigue Lescouëzec; Juan Faus","Two-Dimensional Assembling of (2,2'-Bipyrimidine)bis(oxalato)chromate(III) Units through Alkaline Cations","Inorganic Chemistry","1999","38","","2234","2237","10.1021/ic981232q","","","0.71073","MoKα","","4.98","4.8","","6.88","6.47","","","","","0.89","0.89","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321960","23.846","0.003","11.301","0.0013","20.3262","0.0011","90","","103.446","0.007","90","","5327.4","1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H36 Cl2 Co N3 O4 -","- C17 H35 Cl2 Co N3 O4 -","- C136 H280 Cl16 Co8 N24 O32 -","8","1","","David M. L. Goodgame; David A. Grachvogel; Izhar Hussain; Andrew J. P. White; David J. Williams","Formation of Polymeric Network Arrays by Complexes of Manganese(II) or Cobalt(II) with Alkane Chain Linked Bis(amide) Ligands of Biological Relevance","Inorganic Chemistry","1999","38","","2057","2063","10.1021/ic9812609","","","0.71073","MoKα","","0.1367","0.08","","0.2659","0.2149","","","","1.054","1.15","1.15","","","","","has coordinates,has disorder","179322","2020-10-21","18:00:00",""
"4321961","24.404","0.003","11.262","0.002","21.16","0.003","90","","102.334","0.011","90","","5681.3","1.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C17 H36 Br2 Mn N3 O4 -","- C17 H35 Br2 Mn N3 O4 -","- C136 H280 Br16 Mn8 N24 O32 -","8","1","","David M. L. Goodgame; David A. Grachvogel; Izhar Hussain; Andrew J. P. White; David J. Williams","Formation of Polymeric Network Arrays by Complexes of Manganese(II) or Cobalt(II) with Alkane Chain Linked Bis(amide) Ligands of Biological Relevance","Inorganic Chemistry","1999","38","","2057","2063","10.1021/ic9812609","","","0.71073","MoKα","","0.2159","0.0857","","0.325","0.2235","","","","1.001","1.209","1.209","","","","","has coordinates,has disorder","179322","2020-10-21","18:00:00",""
"4321962","11.597","0.003","12.652","0.002","16.04","0.002","72.018","0.01","85.26","0.02","83.69","0.02","2222","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H60 Br4 Mn2 N6 O6 -","- C30 H60 Br4 Mn2 N6 O6 -","- C60 H120 Br8 Mn4 N12 O12 -","2","1","","David M. L. Goodgame; David A. Grachvogel; Izhar Hussain; Andrew J. P. White; David J. Williams","Formation of Polymeric Network Arrays by Complexes of Manganese(II) or Cobalt(II) with Alkane Chain Linked Bis(amide) Ligands of Biological Relevance","Inorganic Chemistry","1999","38","","2057","2063","10.1021/ic9812609","","","0.71073","MoKα","","0.12","0.0657","","0.1834","0.1456","","","","1.021","1.101","1.101","","","","","has coordinates,has disorder","179322","2020-10-21","18:00:00",""
"4321963","8.0051","0.0009","10.221","0.0013","10.8266","0.0009","67.556","0.007","83.64","0.008","85.83","0.011","813.25","0.16","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H48 Br2 Co N6 O6 -","- C24 H48 Br2 Co N6 O6 -","- C24 H48 Br2 Co N6 O6 -","1","0.5","","David M. L. Goodgame; David A. Grachvogel; Izhar Hussain; Andrew J. P. White; David J. Williams","Formation of Polymeric Network Arrays by Complexes of Manganese(II) or Cobalt(II) with Alkane Chain Linked Bis(amide) Ligands of Biological Relevance","Inorganic Chemistry","1999","38","","2057","2063","10.1021/ic9812609","","","0.71073","MoKα","","0.082","0.0467","","0.1119","0.0962","","","","1.045","1.093","1.093","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321964","13.285","0.005","9.569","0.002","16.46","0.003","90","","90","","90","","2092.5","1","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C12 H28 Br2 Co N4 O6 -","- C12 H28 Br2 Co N4 O6 -","- C48 H112 Br8 Co4 N16 O24 -","4","0.5","","David M. L. Goodgame; David A. Grachvogel; Izhar Hussain; Andrew J. P. White; David J. Williams","Formation of Polymeric Network Arrays by Complexes of Manganese(II) or Cobalt(II) with Alkane Chain Linked Bis(amide) Ligands of Biological Relevance","Inorganic Chemistry","1999","38","","2057","2063","10.1021/ic9812609","","","0.71073","MoKα","","0.079","0.0433","","0.1136","0.0959","","","","0.982","1.014","1.014","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321965","16.6625","0.001","10.613","0.0006","17.8888","0.001","90","","100.83","0.001","90","","3107.1","0.3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","Bis(diprotonated1,4-diazabicyclo(2.2.2)octane)vanadyl(IV)tetra(hydrogen phosphate)hydrogenboratetetrahydrate","","- C12 H41 B3 N4 O25 P4 V -","- C12 H33 B3 N4 O24.682 P4 V -","- C48 H132 B12 N16 O98.728 P16 V4 -","4","1","","Ranko P. Bontchev; Junghwan Do; Allan J. Jacobson","Synthesis and Characterization of a Borophosphate Anion Containing a Single Vanadium Atom: [N~2~C~6~H~14~]~2~[VO(PO~3~OH)~4~(B~3~O~3~OH)]4H~2~O","Inorganic Chemistry","1999","38","","2231","2233","10.1021/ic981278j","","","0.71073","MoKα","","0.053","0.0382","","0.0976","0.0907","","","","1.056","1.095","1.095","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321966","9.269","0.001","12.773","0.002","13.142","0.001","90","","90","","90","","1555.9","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","2a","","","- C16 H20 N4 Ru -","- C16 H20 N4 Ru -","- C64 H80 N16 Ru4 -","4","1","","Heather D. Hansen; Kalyani Maitra; John H. Nelson","Chloride Substitution Reactions of Cycloruthenated (R)C-(+)-N,N-Dimethyl(1-phenylethyl)amine with Pseudohalides: Ruthenium Atom Stereochemistry","Inorganic Chemistry","1999","38","","2150","2156","10.1021/ic981304d","","","0.71073","MoKα","","0.0381","0.029","","0.0551","0.0521","","","","1.039","1.044","1.044","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321967","7.303","","14.337","0.001","8.167","0.001","90","","92.25","0.01","90","","854.45","0.12","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","3a","","","- C17 H23 N2 O3 Ru -","- C17 H23 N2 O3 Ru -","- C34 H46 N4 O6 Ru2 -","2","1","","Heather D. Hansen; Kalyani Maitra; John H. Nelson","Chloride Substitution Reactions of Cycloruthenated (R)C-(+)-N,N-Dimethyl(1-phenylethyl)amine with Pseudohalides: Ruthenium Atom Stereochemistry","Inorganic Chemistry","1999","38","","2150","2156","10.1021/ic981304d","","","0.71073","MoKα","","0.0191","0.0184","","0.047","0.0462","","","","1.016","1.018","1.018","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321968","10.1105","0.0012","10.1873","0.001","15.66","0.002","90","","91.524","0.008","90","","1612.4","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","4a","","","- C17 H20 N2 Ru S -","- C17 H20 N2 Ru S -","- C68 H80 N8 Ru4 S4 -","4","2","","Heather D. Hansen; Kalyani Maitra; John H. Nelson","Chloride Substitution Reactions of Cycloruthenated (R)C-(+)-N,N-Dimethyl(1-phenylethyl)amine with Pseudohalides: Ruthenium Atom Stereochemistry","Inorganic Chemistry","1999","38","","2150","2156","10.1021/ic981304d","","","0.71073","MoKα","","0.0554","0.0402","","0.0882","0.0786","","","","1.072","1.016","1.016","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321969","8.9342","0.0013","13.0426","0.0014","13.386","0.002","90","","90","","90","","1559.8","0.4","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","5a","","","- C17 H20 N2 O Ru -","- C17 H20 N2 O Ru -","- C68 H80 N8 O4 Ru4 -","4","1","","Heather D. Hansen; Kalyani Maitra; John H. Nelson","Chloride Substitution Reactions of Cycloruthenated (R)C-(+)-N,N-Dimethyl(1-phenylethyl)amine with Pseudohalides: Ruthenium Atom Stereochemistry","Inorganic Chemistry","1999","38","","2150","2156","10.1021/ic981304d","","","0.71073","MoKα","","0.0678","0.0408","","0.0692","0.0604","","","","1.02","1.051","1.051","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321970","13.849","0.0004","13.6093","0.0004","19.5583","0.0005","90","","92.336","0.002","90","","3683.19","0.18","296","","296","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H42 N8 Ni2 O8 -","- C34 H42 N9 Ni2 O12 -","- C136 H168 N36 Ni8 O48 -","4","0.5","","Hongyan Luo; Jem-Mau Lo; Phillip E. Fanwick; Joseph G. Stowell; Mark A. Green","Monoprotic Tetradentate N3O-Donor Ligands and Their Cu(II) and Ni(II) Complexes","Inorganic Chemistry","1999","38","","2071","2078","10.1021/ic981324f","","","0.71073","MO-Kα","","","0.054","","","","0.154","","","","","","1.093","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321971","9.1471","0.0004","10.3753","0.0003","10.5352","0.0005","107.2","0.003","91.193","0.002","105.052","0.003","917.17","0.07","296","","296","","","","","","","","","7","P -1","-P 1","2","","","","- C34 H44 B2 Cu2 F8 N6 O2 -","- C34 H44 B2 Cu2 F8 N6 O2 -","- C34 H44 B2 Cu2 F8 N6 O2 -","1","0.5","","Hongyan Luo; Jem-Mau Lo; Phillip E. Fanwick; Joseph G. Stowell; Mark A. Green","Monoprotic Tetradentate N3O-Donor Ligands and Their Cu(II) and Ni(II) Complexes","Inorganic Chemistry","1999","38","","2071","2078","10.1021/ic981324f","","","0.71073","MO-Kα","","","0.074","","","","0.208","","","","","","1.04","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321972","9.158","0.002","10.714","0.002","19.085","0.004","90","","90.582","0.015","90","","1872.5","0.7","296","","296","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 B Cu F4 N3 O -","- C17 H22 B Cu F4 N3 O -","- C68 H88 B4 Cu4 F16 N12 O4 -","4","1","","Hongyan Luo; Jem-Mau Lo; Phillip E. Fanwick; Joseph G. Stowell; Mark A. Green","Monoprotic Tetradentate N3O-Donor Ligands and Their Cu(II) and Ni(II) Complexes","Inorganic Chemistry","1999","38","","2071","2078","10.1021/ic981324f","","","0.71073","MO-Kα","","","0.08","","","","0.209","","","","","","1.012","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321973","11.738","0.003","14.503","0.004","19.731","0.004","90","","90","","90","","3358.9","1.4","203","","203","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C17 H22 Cl Cu N3 O -","- C17 H22 Cl Cu N3 O -","- C136 H176 Cl8 Cu8 N24 O8 -","8","1","","Hongyan Luo; Jem-Mau Lo; Phillip E. Fanwick; Joseph G. Stowell; Mark A. Green","Monoprotic Tetradentate N3O-Donor Ligands and Their Cu(II) and Ni(II) Complexes","Inorganic Chemistry","1999","38","","2071","2078","10.1021/ic981324f","","","0.71073","Mo-Kα","","","0.086","","","","0.278","","","","","","1.183","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321974","25.252","0.065","26.752","0.012","28.567","0.042","90","","90","","90","","19298","6","213","2","213","2","","","","","","","synthesis","5","F d d d :2","-F 2uv 2vw","70","","","","- C52 H36 Cr2 F8 N8 -","- C52 H36 Cr2 F8 N8 -","- C832 H576 Cr32 F128 N128 -","16","0.5","","F. Albert Cotton; Carlos A. Murillo; Isabel Pascual","Quadruply Bonded Dichromium Complexes with Variously Fluorinated Formamidinate Ligands","Inorganic Chemistry","1999","38","","2182","2187","10.1021/ic990007l","","","0.71073","MoKα","","0.1052","0.094","","0.2585","0.2466","","","","1.152","1.214","1.214","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321975","10.8274","0.001","13.739","0.002","18.152","0.004","83.25","0.01","75.61","0.02","70.426","0.01","2462.6","0.7","213","2","213","2","","","","","","","synthesis","5","P -1","-P 1","2","","","","- C55.5 H28 Cr2 F16 N8 -","- C55.458 H28 Cr2 F16 N8 -","- C110.916 H56 Cr4 F32 N16 -","2","1","","F. Albert Cotton; Carlos A. Murillo; Isabel Pascual","Quadruply Bonded Dichromium Complexes with Variously Fluorinated Formamidinate Ligands","Inorganic Chemistry","1999","38","","2182","2187","10.1021/ic990007l","","","0.71073","MoKα","","0.0496","0.0441","","0.1128","0.1068","","","","1.037","1.055","1.055","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321976","9.606","0.0012","9.727","0.001","13.606","0.0011","69.249","0.01","73.85","0.02","84.25","0.02","1141.9","0.2","213","2","213","2","","","","","","","synthesis","5","P -1","-P 1","2","","","","- C52 H28 Cr2 F8 N8 -","- C52 H28 Cr2 F8 N8 -","- C52 H28 Cr2 F8 N8 -","1","0.5","","F. Albert Cotton; Carlos A. Murillo; Isabel Pascual","Quadruply Bonded Dichromium Complexes with Variously Fluorinated Formamidinate Ligands","Inorganic Chemistry","1999","38","","2182","2187","10.1021/ic990007l","","","0.71073","MoKα","","0.147","0.1188","","0.3497","0.3184","","","","1.189","1.241","1.241","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321977","9.689","0.009","13.703","0.01","16.844","0.01","69.9","0.1","87.1","0.06","70.13","0.06","1970","3","213","2","213","2","","","","","","","synthesis","5","P 1","P 1","1","","","","- C100.82 H76 Cl1.65 Cr2 N8 -","- C100.83 H76 Cl1.66 Cr2 N8 -","- C100.83 H76 Cl1.66 Cr2 N8 -","1","1","","F. Albert Cotton; Carlos A. Murillo; Isabel Pascual","Quadruply Bonded Dichromium Complexes with Variously Fluorinated Formamidinate Ligands","Inorganic Chemistry","1999","38","","2182","2187","10.1021/ic990007l","","","0.71073","MoKα","","0.1272","0.0965","","0.2595","0.2248","","","","1.064","1.067","1.067","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321978","10.225","0.002","11.312","0.002","11.797","0.002","117.08","0.03","96.42","0.03","107.53","0.03","1107.6","0.6","213","2","213","2","","","","","","","synthesis","5","P -1","-P 1","2","","Tetrakis (ortho)-fluorophenylformamidinate dichromium (II)","","- C52 H36 Cr2 F8 N8 -","- C52 H36 Cr2 F8 N8 -","- C52 H36 Cr2 F8 N8 -","1","0.5","","F. Albert Cotton; Carlos A. Murillo; Isabel Pascual","Quadruply Bonded Dichromium Complexes with Variously Fluorinated Formamidinate Ligands","Inorganic Chemistry","1999","38","","2182","2187","10.1021/ic990007l","","","0.71073","MoKα","","0.0763","0.0625","","0.1637","0.1471","","","","1.105","1.099","1.099","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321979","7.2294","0.0002","11.4574","0.0004","14.9103","0.0006","90","","90.341","0.005","90","","1235","0.07","293","","293","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","(bipy)Pt(edt)","(2,2'-bipyridyl)(ethylene-1,2-dithiolate)platinum(II)","","- C12 H10 N2 Pt S2 -","- C12 H10 N2 Pt S2 -","- C48 H40 N8 Pt4 S8 -","4","0.5","","Christopher E. Keefer; Robert D. Bereman; Suzanne T. Purrington; Brian W. Knight; Paul D. Boyle","The 195Pt NMR of L2Pt(1,2-dithiolene) Complexes","Inorganic Chemistry","1999","38","","2294","2302","10.1021/ic980369d","","","0.71073","MolybdenumKα","","0.026","0.026","","0.032","0.032","","","","","1.07","1.07","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321980","10.242","0.001","10.751","0.001","13.289","0.002","90","","102.87","0.01","90","","1426.5","0.3","293","","293","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","(COD)Pt(dddt)","(1,5-cyclooctadiene)(5,6-dihydro-1,4-dithiin-2,3-dithiolate)platinum(II)","","- C12 H16 Pt S4 -","- C12 H16 Pt S4 -","- C48 H64 Pt4 S16 -","4","1","","Christopher E. Keefer; Robert D. Bereman; Suzanne T. Purrington; Brian W. Knight; Paul D. Boyle","The 195Pt NMR of L2Pt(1,2-dithiolene) Complexes","Inorganic Chemistry","1999","38","","2294","2302","10.1021/ic980369d","","","0.7093","MolybdenumKα","","0.044","0.044","","0.048","0.048","","","","","1.54","1.54","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321981","10.353","0.002","16.679","0.002","9.482","0.001","99.91","0.01","106.33","0.01","77.8","0.01","1524.7","0.4","300","","300","","","","","","","","","3","P -1","-P 1","2","","1,1-diphenyl-2,3,4,5-tetraphenylstannole","","- C40 H30 Sn -","- C40 H30 Sn -","- C80 H60 Sn2 -","2","1","","Justin Ferman; Joseph P. Kakareka; Wim T. Klooster; Jerome L. Mullin; Joseph Quattrucci; John S. Ricci; Henry J. Tracy; William J. Vining; Scott Wallace","Electrochemical and Photophysical Properties of a Series of Group-14 Metalloles","Inorganic Chemistry","1999","38","","2464","2472","10.1021/ic980662d","","","0.7107","Mokα","","","0.037","","","0.038","","","","","1.11","1.11","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321982","4.727","0.003","4.727","0.003","8.88","0.007","90","","90","","90","","198.4","0.2","","","293","2","","","","","","","","4","P -4 21 m","P -4 2ab","113","","","","- F4 Li O2 Re -","- F4 Li O2 Re -","- F8 Li2 O4 Re2 -","2","0.25","","William J. Casteel; David A. Dixon; Nicolas LeBlond; Philippa E. Lock; Hélène P. A. Mercier; Gary J. Schrobilgen","Lewis Acid Behavior of ReO2F3: Synthesis of (ReO2F3)\ιnfty, ReO2F4-, Re2O4F7-, Re3O6F10-, and ReO2F3(CH3CN) and Study by NMR Spectroscopy, Raman Spectroscopy, and Density Functional Theory Calculations; and X-ray Structures of [Li][ReO2F4], [K][Re2O4F7], [K][Re2O4F7].2ReO2F3, [Cs][Re3O6F10], and ReO3F(CH3CN)2.CH3CN","Inorganic Chemistry","1999","38","","2340","2358","10.1021/ic980695t","","","0.56086","AgKα","","0.0397","0.0378","","0.1084","0.1029","","","","1.207","1.2","1.2","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321983","5.499","0.0011","5.153","0.001","14.753","0.003","90","","95.68","0.03","90","","415.99","0.15","293","2","293","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- F7 K O4 Re2 -","- F7 K O4 Re2 -","- F14 K2 O8 Re4 -","2","0.5","","William J. Casteel; David A. Dixon; Nicolas LeBlond; Philippa E. Lock; Hélène P. A. Mercier; Gary J. Schrobilgen","Lewis Acid Behavior of ReO2F3: Synthesis of (ReO2F3)\ιnfty, ReO2F4-, Re2O4F7-, Re3O6F10-, and ReO2F3(CH3CN) and Study by NMR Spectroscopy, Raman Spectroscopy, and Density Functional Theory Calculations; and X-ray Structures of [Li][ReO2F4], [K][Re2O4F7], [K][Re2O4F7].2ReO2F3, [Cs][Re3O6F10], and ReO3F(CH3CN)2.CH3CN","Inorganic Chemistry","1999","38","","2340","2358","10.1021/ic980695t","","","0.56086","AgKα","","0.0553","0.0473","","0.1243","0.12","","","","","1.121","1.121","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321984","27.319","0.024","5.274","0.005","5.355","0.003","90","","99.53","0.04","90","","760.9","1.1","213","2","213","2","","","","","","","","4","C 1 2 1","C 2y","5","","mu-fluorohexafluorotetraoxodirhenate dioxotrifluororhenium adduct","","- F13 K O8 Re2 -","- F13 K O8 Re2 -","- F26 K2 O16 Re4 -","2","0.5","","William J. Casteel; David A. Dixon; Nicolas LeBlond; Philippa E. Lock; Hélène P. A. Mercier; Gary J. Schrobilgen","Lewis Acid Behavior of ReO2F3: Synthesis of (ReO2F3)∞, ReO2F4-, Re2O4F7-, Re3O6F10-, and ReO2F3(CH3CN) and Study by NMR Spectroscopy, Raman Spectroscopy, and Density Functional Theory Calculations; and X-ray Structures of [Li][ReO2F4], [K][Re2O4F7], [K][Re2O4F7].2ReO2F3, [Cs][Re3O6F10], and ReO3F(CH3CN)2.CH3CN","Inorganic Chemistry","1999","38","","2340","2358","10.1021/ic980695t","","","0.71073","MoKα","","0.0254","0.0244","","0.0677","0.0603","","","","1.162","1.162","1.162","","","","","has coordinates","273129","2022-02-23","10:11:34",""
"4321985","9.138","0.003","12.518","0.005","9.138","0.004","90","","90","","90","","1045.3","0.7","210","2","210","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C6 H6 F N3 O3 Re -","- C6 H6 F N3 O3 Re -","- C24 H24 F4 N12 O12 Re4 -","4","0.5","","William J. Casteel; David A. Dixon; Nicolas LeBlond; Philippa E. Lock; Hélène P. A. Mercier; Gary J. Schrobilgen","Lewis Acid Behavior of ReO2F3: Synthesis of (ReO2F3)\ιnfty, ReO2F4-, Re2O4F7-, Re3O6F10-, and ReO2F3(CH3CN) and Study by NMR Spectroscopy, Raman Spectroscopy, and Density Functional Theory Calculations; and X-ray Structures of [Li][ReO2F4], [K][Re2O4F7], [K][Re2O4F7].2ReO2F3, [Cs][Re3O6F10], and ReO3F(CH3CN)2.CH3CN","Inorganic Chemistry","1999","38","","2340","2358","10.1021/ic980695t","","","0.71073","MoKα","","0.0199","","","0.0607","0.0605","","","","1.205","1.205","1.205","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321986","17.201","0.002","10.873","0.002","11.835","0.002","90","","99.72","0.01","90","","2181.7","0.6","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H34 Cl4 Cu2 N6 -","- C12 Cl4 Cu2 N6 -","- C48 Cl16 Cu8 N24 -","4","0.5","","Montserrat Rodríguez; Antoni Llobet; Montserrat Corbella; Arthur E. Martell; Joseph Reibenspies","Synthesis, Structure, and Magnetic Properties of a New Chloro-Bridged Dimer [Cu2(dpt)2Cl2]Cl2 with an Unusual Structure and Ferromagnetic Coupling","Inorganic Chemistry","1999","38","","2328","2334","10.1021/ic9808504","","","1.54178","CuKα","","0.0553","0.0388","","","0.0455","0.0478","","","","","","1.34","","","","has coordinates","176337","2020-10-21","18:00:00",""
"4321987","20.177","0.007","6.381","0.002","11.071","0.003","90","","111.8","0.02","90","","1323.4","0.7","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Trimethyltin(IV)-cupper(I)dicyanide pyrazin adduct","","- C18 H26 Cu2 N8 Sn2 -","- C18 H26 Cu2 N8 Sn2 -","- C36 H52 Cu4 N16 Sn4 -","2","0.25","","Eric Siebel; Amany M.A. Ibrahim; R. Dieter Fischer","[CuCN.Me3SnCN.C4H4N2]: A Threefold- Interpenetrating, Distorted-Diamondoid Framework (C4H4N2= Pyrazine)","Inorganic Chemistry","1999","38","","2530","2532","10.1021/ic9808549","","","0.71073","MoKα","","0.0396","0.0368","","0.1077","0.1045","","","","0.896","0.897","0.897","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321988","9.011","","9.338","","11.941","","74.51","","86.96","","86.5","","965.765","","150","0.2","150","","","","","","","","","5","P -1","-P 1","2","","{[Cd(mu-(3,6-bis(pyridin-3-yl)-1,2,4,5-tetrazine)(NO3)2(MeOH)2]}n","","- C14 H16 Cd N8 O8 -","- C14 H16 Cd N8 O8 -","- C28 H32 Cd2 N16 O16 -","2","1","","Matthew A. Withersby; Alexander J. Blake; Neil R. Champness; Paul A. Cooke; Peter Hubberstey; Wan-Sheung Li; Martin Schröder","Solvent Control in the Synthesis of 3,6-Bis(pyridin-3-yl)-1,2,4,5-tetrazine-Bridged Cadmium(II) and Zinc(II) Coordination Polymers","Inorganic Chemistry","1999","38","","2259","2266","10.1021/ic980898h","","","0.71069","MoKα","","0.0231","0.0224","","0.028","0.0277","","","","1.097","1.2341","1.2341","","","","","has coordinates","205229","2020-10-21","18:00:00",""
"4321989","9.06","0.003","9.848","0.003","13.208","0.004","86.76","0.03","79.04","0.03","88.14","0.02","1154.8","0.6","297","2","297","2","","","","","","","","5","P -1","-P 1","2","{[Cd2(mu-3,3'-pytz)3(NO3)4](EtOH)}n","3,6-bis(pyridy-3-yl)-1,2,4,5-tetrazine Cadmium nitrate ethanol adduct","","- C19 H14.5 Cd N11 O6.5 -","- C19 H12 Cd N11 O6.5 -","- C38 H24 Cd2 N22 O13 -","2","1","","Matthew A. Withersby; Alexander J. Blake; Neil R. Champness; Paul A. Cooke; Peter Hubberstey; Wan-Sheung Li; Martin Schröder","Solvent Control in the Synthesis of 3,6-Bis(pyridin-3-yl)-1,2,4,5-tetrazine-Bridged Cadmium(II) and Zinc(II) Coordination Polymers","Inorganic Chemistry","1999","38","","2259","2266","10.1021/ic980898h","","","0.71073","MoKα","","0.0397","0.0315","","","0.0802","0.0872","","","","","","0.977","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4321990","8.981","0.016","9.93","0.02","13.19","0.02","94.12","0.15","102.35","0.13","88.12","0.15","1146","4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","{[Cd2(mu-3,3'-pytz)3(NO3)4](CH2Cl2)}n","3,6-bis(pyrid-3-yl)-1,2,4,5-tetrazine Cadmium Nitrate Dichloromethane adduct","","- C18.5 H13 Cd Cl N11 O6 -","- C18.5 H12 Cd Cl N11 O6 -","- C37 H24 Cd2 Cl2 N22 O12 -","2","1","","Matthew A. Withersby; Alexander J. Blake; Neil R. Champness; Paul A. Cooke; Peter Hubberstey; Wan-Sheung Li; Martin Schröder","Solvent Control in the Synthesis of 3,6-Bis(pyridin-3-yl)-1,2,4,5-tetrazine-Bridged Cadmium(II) and Zinc(II) Coordination Polymers","Inorganic Chemistry","1999","38","","2259","2266","10.1021/ic980898h","","","0.71073","MoKα","","0.0676","0.0563","","","0.1255","0.1362","","","","","","1.041","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4321991","7.535","0.001","10.728","0.001","15.219","0.002","85.36","0.01","80.63","0.01","69.34","0.01","1135.4","0.3","150","0.2","150","","","","","","","","","5","P -1","-P 1","2","","{[Zn2(3,6-bis(pyridin-3-yl)-1,2,4,5-tetrazine)2(NO3)4(MeOH)2 (mu-3,6-bis(pyridin-3-yl)-1,2,4,5-tetrazine)]}n","","- C19 H16 N11 O7 Zn -","- C19 H16 N11 O7 Zn -","- C38 H32 N22 O14 Zn2 -","2","1","","Matthew A. Withersby; Alexander J. Blake; Neil R. Champness; Paul A. Cooke; Peter Hubberstey; Wan-Sheung Li; Martin Schröder","Solvent Control in the Synthesis of 3,6-Bis(pyridin-3-yl)-1,2,4,5-tetrazine-Bridged Cadmium(II) and Zinc(II) Coordination Polymers","Inorganic Chemistry","1999","38","","2259","2266","10.1021/ic980898h","","","0.71069","MoKα","","0.0439","0.0439","","0.0633","0.0633","","","","1.085","1.085","1.085","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321992","7.59","0.003","10.561","0.002","15.951","0.005","87.56","0.02","83.49","0.04","71.12","0.02","1202","0.7","297","2","297","2","","","","","","","","5","P -1","-P 1","2","{[Zn2(3,3'-pytz)2(NO3)4(EtOH)2(mu-3,3'-pytz)]}n","3,6-bis(pyrid-3-yl)-1,2,4,5-tetrazine Zinc nitrate ethanol adduct","","- C20 H18 N11 O7 Zn -","- C20 H18 N11 O7 Zn -","- C40 H36 N22 O14 Zn2 -","2","1","","Matthew A. Withersby; Alexander J. Blake; Neil R. Champness; Paul A. Cooke; Peter Hubberstey; Wan-Sheung Li; Martin Schröder","Solvent Control in the Synthesis of 3,6-Bis(pyridin-3-yl)-1,2,4,5-tetrazine-Bridged Cadmium(II) and Zinc(II) Coordination Polymers","Inorganic Chemistry","1999","38","","2259","2266","10.1021/ic980898h","","","0.71073","MoKα","","0.0981","0.0615","","","0.1031","0.1268","","","","","","1.219","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321993","9.111","0.0018","12.474","0.003","13.171","0.003","117.79","0.03","102.39","0.03","101.13","0.03","1216.7","0.8","150","2","150","2","","","","","","","","6","P -1","-P 1","2","{[Zn2(mu-3,3-pytz)3(NO3)4](CH2Cl2)}n","3,6-bis(Pyrid-3-yl)1,2,4,5-tetrazine Zinc Nitrate Dichloromethane adduct","","- C19 H14 Cl2 N11 O6 Zn -","- C19 H14 Cl2 N11 O6 Zn -","- C38 H28 Cl4 N22 O12 Zn2 -","2","1","","Matthew A. Withersby; Alexander J. Blake; Neil R. Champness; Paul A. Cooke; Peter Hubberstey; Wan-Sheung Li; Martin Schröder","Solvent Control in the Synthesis of 3,6-Bis(pyridin-3-yl)-1,2,4,5-tetrazine-Bridged Cadmium(II) and Zinc(II) Coordination Polymers","Inorganic Chemistry","1999","38","","2259","2266","10.1021/ic980898h","","","0.71073","MoKα","","0.0582","0.0452","","","0.1164","0.119","","","","","","0.947","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4321994","18.5249","0.0005","11.8058","0.0004","20.2942","0.0005","90","","102.951","0.001","90","","4325.5","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H60 Mo N3 S12 -","- C28 Mo N3 S12 -","- C112 Mo4 N12 S48 -","4","1","","C. Simonnet-Jégat; E. Cadusseau; R. Dessapt; F. Sécheresse","Synthesis and Structural Characterizations of New Mononuclear and Dinuclear Molybdenum(V) Anions Containing Trithiocarbonate Ligands","Inorganic Chemistry","1999","38","","2335","2339","10.1021/ic980907m","","","0.71073","MoKα","","0.0838","0.0496","","0.1663","0.1416","","","","1.02","1.064","1.064","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321995","8.793","0.0001","22.3059","0.0003","14.5029","0.0002","90","","98.445","0.001","90","","2813.7","0.06","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H36 Mo N S8 -","- C18 H36 Mo N S8 -","- C72 H144 Mo4 N4 S32 -","4","1","","C. Simonnet-Jégat; E. Cadusseau; R. Dessapt; F. Sécheresse","Synthesis and Structural Characterizations of New Mononuclear and Dinuclear Molybdenum(V) Anions Containing Trithiocarbonate Ligands","Inorganic Chemistry","1999","38","","2335","2339","10.1021/ic980907m","","","0.71073","MoKα","","0.0976","0.0425","","0.146","0.1044","","","","0.864","0.798","0.798","","","","","has coordinates","179322","2020-10-21","18:00:00",""
"4321996","12.65","0.002","21.262","0.004","21.09","0.004","90","","99.16","0.004","90","","5600.1","1.7","173","2","173","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","bis(mu!5$-2,6-pyridinedithiolate-S,N,S')-tetrakis- ((eta$4!-1,5-cyclo-octadiene)-rhodium(i))-thallium(i) hexafluorophosphate dichloromethane solvate","","- C43 H56 Cl2 F6 N2 P Rh4 S4 Tl -","- C43.001 H54 Cl2.002 F6 N2 P Rh4 S4 Tl -","- C172.004 H216 Cl8.008 F24 N8 P4 Rh16 S16 Tl4 -","4","1","","Miguel A. Casado; Jesús J. Pérez-Torrente; José A. López; Miguel A. Ciriano; Fernando J. Lahoz; Luis A. Oro","Encapsulation of Thallium(I) by Tetranuclear Rhodium or Iridium Complexes: Synthesis and Molecular Structure of Heterobimetallic Complexes Stabilized by s2-d8 Bonding Interactions","Inorganic Chemistry","1999","38","","2482","2488","10.1021/ic980988m","","","0.71073","MoKα","","0.0857","0.0476","","","0.1055","0.1219","","","","","","1.054","","","","has coordinates,has disorder","179322","2020-10-21","18:00:00",""
"4321997","14.565","0.013","10.903","0.006","7.941","0.007","90","","96.22","0.07","90","","1253.6","1.7","208","2","208","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","diphenyltrichlorophosphorane","","","- C12 H10 Cl3 P -","- C12 H10 Cl3 P -","- C48 H40 Cl12 P4 -","4","0.5","","Stephen A. Bell; Steven J. Geib; Tara Y. Meyer","Ph2PCl3: Covalency in Solution and the Solid State","Inorganic Chemistry","1999","38","","2524","2526","10.1021/ic980994i","","","0.71073","MoKα","","0.0952","0.069","","","0.1899","0.2105","","","","","","1.238","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4321998","6.409","0.005","14.717","0.01","7.259","0.006","90","","114.73","0.04","90","","621.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C5 H15 Co N O12 -","- C5 H15 Co N O12 -","- C10 H30 Co2 N2 O24 -","2","0.5","","Bert D. Alleyne; Hazel-Ann Hosein; Hema Jaggernauth; Lincoln A. Hall; Andrew J. P. White; David J. Williams","First Row Transition Metal Complexes of 1-Methylcyclobutenedione, a Monosubstituted Squarate Ligand","Inorganic Chemistry","1999","38","","2416","2421","10.1021/ic981011k","","","0.71073","MoKα","","0.0911","0.0638","","0.2971","0.1643","","","","1.161","1.197","1.197","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4321999","6.5473","0.0007","14.671","0.002","7.2687","0.0011","90","","114.929","0.009","90","","633.15","0.15","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C5 H15 N Ni O12 -","- C5 H15 N2 Ni O12 -","- C10 H30 N4 Ni2 O24 -","2","0.5","","Bert D. Alleyne; Hazel-Ann Hosein; Hema Jaggernauth; Lincoln A. Hall; Andrew J. P. White; David J. Williams","First Row Transition Metal Complexes of 1-Methylcyclobutenedione, a Monosubstituted Squarate Ligand","Inorganic Chemistry","1999","38","","2416","2421","10.1021/ic981011k","","","0.71073","MoKα","","0.0288","0.0262","","0.0749","0.0726","","","","1.064","1.077","1.077","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322000","8.8258","0.0008","16.1527","0.0014","9.9084","0.0008","90","","93.23","0.007","90","","1410.3","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 Mn O10 -","- C10 H14 Mn O10 -","- C40 H56 Mn4 O40 -","4","1","","Bert D. Alleyne; Hazel-Ann Hosein; Hema Jaggernauth; Lincoln A. Hall; Andrew J. P. White; David J. Williams","First Row Transition Metal Complexes of 1-Methylcyclobutenedione, a Monosubstituted Squarate Ligand","Inorganic Chemistry","1999","38","","2416","2421","10.1021/ic981011k","","","0.71073","MoKα","","0.0506","0.0376","","0.1058","0.0973","","","","1.048","1.081","1.081","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322001","8.7748","0.0002","16.0212","0.0003","9.8083","0.0002","90","","93.595","0.001","90","","1376.17","0.05","300","2","300","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 Co O10 -","- C10 H14 Co O10 -","- C40 H56 Co4 O40 -","4","1","","Bert D. Alleyne; Hazel-Ann Hosein; Hema Jaggernauth; Lincoln A. Hall; Andrew J. P. White; David J. Williams","First Row Transition Metal Complexes of 1-Methylcyclobutenedione, a Monosubstituted Squarate Ligand","Inorganic Chemistry","1999","38","","2416","2421","10.1021/ic981011k","","","0.71073","MoKα","","0.0586","0.0355","","0.0855","0.0751","","","","1.059","1.084","1.084","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322002","8.647","0.002","16.139","0.004","9.656","0.003","90","","94.13","0.03","90","","1344","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 Cu O10 -","- C10 H14 Cu O10 -","- C40 H56 Cu4 O40 -","4","1","","Bert D. Alleyne; Hazel-Ann Hosein; Hema Jaggernauth; Lincoln A. Hall; Andrew J. P. White; David J. Williams","First Row Transition Metal Complexes of 1-Methylcyclobutenedione, a Monosubstituted Squarate Ligand","Inorganic Chemistry","1999","38","","2416","2421","10.1021/ic981011k","","","0.71073","MoKα","","0.0421","0.0354","","0.098","0.0928","","","","1.059","1.08","1.08","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322003","8.7929","0.0009","15.9814","0.0009","9.7924","0.0004","90","","93.606","0.009","90","","1373.33","0.17","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H14 O10 Zn -","- C10 H14 O10 Zn -","- C40 H56 O40 Zn4 -","4","1","","Bert D. Alleyne; Hazel-Ann Hosein; Hema Jaggernauth; Lincoln A. Hall; Andrew J. P. White; David J. Williams","First Row Transition Metal Complexes of 1-Methylcyclobutenedione, a Monosubstituted Squarate Ligand","Inorganic Chemistry","1999","38","","2416","2421","10.1021/ic981011k","","","1.54178","CuKα","","0.041","0.0355","","0.0951","0.0914","","","","1.149","1.182","1.182","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322004","19.601","0.002","19.601","0.002","6.7196","0.0006","90","","90","","120","","2235.8","0.4","298","","","","","","","","","","","4","P 63 c m","P 6c -2","185","","","","- Cu3 I3 P4 Se4 -","- Cu3 I3 P4 Se4 -","- Cu18 I18 P24 Se24 -","6","0.5","","Arno Pfitzner; Sara Reiser","(CuI)~3~P~4~Se~4~: β-P~4~Se~4~ Cages between Columns of Copper Iodide","Inorganic Chemistry","1999","38","","2451","2454","10.1021/ic981042f","","x-ray","0.71073","MoKα","","0.0613","0.0589","","0.145","0.1449","","","","4.55","4.69","4.69","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322005","9.593","0.001","30.315","0.004","13.708","0.002","90","","108.66","0.01","90","","3776.9","0.9","23","","23","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C30 H40 Br2 F6 N2 O P4 W -","- C120 H160 Br8 F24 N8 O4 P16 W4 -","- C120 H160 Br8 F24 N8 O4 P16 W4 -","","","","Hiroshige Ishino; Shin'ichi Tokunaga; Hidetake Seino; Youichi Ishii; Masanobu Hidai","Synthesis and Structures of Tungsten (1-Pyridinio)imido Complexes and Their Facile N-N Bond Cleavage1","Inorganic Chemistry","1999","38","","2489","2496","10.1021/ic981116n","","","0.7107","MoKalpha","","","0.044","","","0.035","","","","","1.35","1.35","","","","","has coordinates","191073","2020-10-21","18:00:00",""
"4322006","8.823","0.004","34.939","0.005","10.729","0.003","90","","93.58","0.03","90","","3300.9","1.8","20","","20","","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C26 H33 Cl2 F3 N2 O4 P2 S W -","- C104 H132 Cl8 F12 N8 O16 P8 S4 W4 -","- C104 H132 Cl8 F12 N8 O16 P8 S4 W4 -","","","","Hiroshige Ishino; Shin'ichi Tokunaga; Hidetake Seino; Youichi Ishii; Masanobu Hidai","Synthesis and Structures of Tungsten (1-Pyridinio)imido Complexes and Their Facile N-N Bond Cleavage1","Inorganic Chemistry","1999","38","","2489","2496","10.1021/ic981116n","","","0.7107","MoKalpha","","","0.041","","","0.027","","","","","1.33","1.33","","","","","has coordinates","191073","2020-10-21","18:00:00",""
"4322007","20.266","0.002","10.502","0.001","30.363","0.002","90","","96.012","0.007","90","","6426.7","1","20","","20","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24.5 H34 Cl4 N2 O5 P2 W -","- C200 H280 Cl40 N16 O40 P16 W8 -","- C200 H280 Cl40 N16 O40 P16 W8 -","","","","Hiroshige Ishino; Shin'ichi Tokunaga; Hidetake Seino; Youichi Ishii; Masanobu Hidai","Synthesis and Structures of Tungsten (1-Pyridinio)imido Complexes and Their Facile N-N Bond Cleavage1","Inorganic Chemistry","1999","38","","2489","2496","10.1021/ic981116n","","","0.7107","MoKalpha","","","0.044","","","0.027","","","","","1.82","1.82","","","","","has coordinates","191073","2020-10-21","18:00:00",""
"4322008","13.0529","0.0008","9.985","0.002","18.07","0.001","90","","110.755","0.004","90","","2202.3","0.5","20","","20","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C17 H23 Cl2 N O P2 W -","- C68 H92 Cl8 N4 O4 P8 W4 -","- C68 H92 Cl8 N4 O4 P8 W4 -","","","","Hiroshige Ishino; Shin'ichi Tokunaga; Hidetake Seino; Youichi Ishii; Masanobu Hidai","Synthesis and Structures of Tungsten (1-Pyridinio)imido Complexes and Their Facile N-N Bond Cleavage1","Inorganic Chemistry","1999","38","","2489","2496","10.1021/ic981116n","","","0.7107","MoKalpha","","","0.027","","","0.018","","","","","1.55","1.55","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322009","10.656","0.003","12.202","0.005","13.266","0.003","75.39","0.02","73.31","0.02","71.65","0.02","1543.2","0.9","158","","158","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H110 Li2 O10 Ti2 -","- C50 H110 Li2 O10 Ti2 -","- C50 H110 Li2 O10 Ti2 -","1","0.5","","Timothy J. Boyle; Todd M. Alam; Cory J. Tafoya; Eric R. Mechenbier; Joseph W. Ziller","Syntheses, Characterizations, and X-ray Structures of Alkali Metal Derivatives of Titanium(IV) Neopentoxides","Inorganic Chemistry","1999","38","","2422","2428","10.1021/ic981143d","","","0.71073","MoKα","","0.0764","0.0506","","0.1373","0.1199","","","","1.03","1.053","1.053","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322010","15.06","0.004","12.264","0.003","18.15","0.005","90","","104.903","0.01","90","","3239.5","1.5","163","","163","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C50 H110 K2 O10 Ti2 -","- C50 H104 K2 O10 Ti2 -","- C100 H208 K4 O20 Ti4 -","2","0.5","","Timothy J. Boyle; Todd M. Alam; Cory J. Tafoya; Eric R. Mechenbier; Joseph W. Ziller","Syntheses, Characterizations, and X-ray Structures of Alkali Metal Derivatives of Titanium(IV) Neopentoxides","Inorganic Chemistry","1999","38","","2422","2428","10.1021/ic981143d","","","0.71073","MoKα","","0.1574","0.1016","","0.3137","0.259","","","","1.021","1.076","1.076","","","","","has coordinates,has disorder","179323","2020-10-21","18:00:00",""
"4322011","10.1105","0.0006","9.9463","0.0005","12.7254","0.0008","90","","110.287","0.005","90","","1200.31","0.13","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C2 Cl6 Cu N Zr -","- C4 Cl6 Cu2 N2 Zr -","- C16 Cl24 Cu8 N8 Zr4 -","4","0.5","","Andrew M. Dattelbaum; James D. Martin","[H2NMe2]CuZrCl6: Hydrogen-Bond Induced Distortions in a Copper Zirconium Chloride Analogue of a Thiophosphate","Inorganic Chemistry","1999","38","","2369","2374","10.1021/ic9811906","","","0.71073","MolybdenumKα","","0.028","0.028","","0.041","0.04","","","","","1.48","1.48","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322012","10.2345","0.0017","9.4269","0.0011","12.691","0.002","90","","109.9","0.02","90","","1151.3","0.3","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C2 H8 Cl6 Cu N Zr -","- C2 H8 Cl6 Cu N Zr -","- C8 H32 Cl24 Cu4 N4 Zr4 -","4","1","","Andrew M. Dattelbaum; James D. Martin","[H2NMe2]CuZrCl6: Hydrogen-Bond Induced Distortions in a Copper Zirconium Chloride Analogue of a Thiophosphate","Inorganic Chemistry","1999","38","","2369","2374","10.1021/ic9811906","","","0.71073","MolybdenumKα","","0.049","0.049","","0.058","0.058","","","","","1.75","1.75","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322013","20.205","0.003","11.7529","0.0009","30.905","0.003","90","","90.333","0.01","90","","7338.8","1.4","297","2","297","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C78 H62 Cl4 Hg O10 P4 Pd2 -","- C78 H62 Cl4 Hg O10 P4 Pd2 -","- C312 H248 Cl16 Hg4 O40 P16 Pd8 -","4","0.5","","Larry R. Falvello; Susana Fernández; Rafael Navarro; Esteban P. Urriolabeitia","Reactivity of Palladium(II) Complexes Containing the Orthometalated C,C-Chelating Ligand C6H4-2-PPh2C(H)COCH2PPh3 toward Deprotonating Reagents","Inorganic Chemistry","1999","38","","2455","2463","10.1021/ic9812050","","","0.71073","MoKα","","0.141","0.0591","","","0.1116","0.1355","","","","","","1.04","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322014","9.736","0.001","9.736","0.001","16.75","0.001","90","","90","","120","","1375","0.2","205","2","205","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","Bis(tricyclo(5.2.1.0^2.6^)deca-2,4-dienyl)chromium(III) hexafluorophosphat","","- C20 H22 Cr F6 P -","- C20 H22 Cr F6 P -","- C60 H66 Cr3 F18 P3 -","3","0.5","","Irene Gattinger; Martin A. Herker; Wolfgang Hiller; Frank H. Köhler","Fusing Rigid Spin Probes to Paramagnetic Sandwiches. Synthesis, Crystal Structures, and NMR Spectroscopy of Bis(isodicyclopentadienyl)metal Compounds","Inorganic Chemistry","1999","38","","2359","2368","10.1021/ic9812407","","","0.71073","MoKα","","0.0563","0.0548","","0.1523","0.1505","","","","1.043","1.047","1.047","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322015","9.708","0.001","9.708","0.001","16.566","0.002","90","","90","","120","","1352.1","0.3","199","2","199","2","","","","","","","","5","P 31 2 1","P 31 2""","152","","Bis(tricyclo(5.2.1.0^2.6^)deca-2,4-dienyl)iron(III) hexafluorophosphat","","- C20 H22 F6 Fe P -","- C20 H22 F6 Fe P -","- C60 H66 F18 Fe3 P3 -","3","0.5","","Irene Gattinger; Martin A. Herker; Wolfgang Hiller; Frank H. Köhler","Fusing Rigid Spin Probes to Paramagnetic Sandwiches. Synthesis, Crystal Structures, and NMR Spectroscopy of Bis(isodicyclopentadienyl)metal Compounds","Inorganic Chemistry","1999","38","","2359","2368","10.1021/ic9812407","","","0.71073","MoKα","","0.0456","0.0439","","0.1256","0.1239","","","","1.08","1.086","1.086","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322016","10.796","0.003","21.225","0.003","12.677","0.002","90","","100.49","0.02","90","","2856.3","1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H42 Cl2 N9 O2 P3 Pd -","- C19 H42 Cl2 N9 O2 P3 Pd -","- C76 H168 Cl8 N36 O8 P12 Pd4 -","4","1","","Donald J. Darensbourg; Jeffrey B. Robertson; David L. Larkins; Joseph H. Reibenspies","Water-Soluble Organometallic Compounds. 7.1 Further Studies of 1,3,5-Triaza-7-Phosphaadamantane Derivatives of Group 10 Metals, Including Metal Carbonyls and Hydrides","Inorganic Chemistry","1999","38","","2473","2481","10.1021/ic981243j","","","0.71073","MoKα","","0.0785","0.0606","","0.2514","0.1748","","","","0.904","0.706","0.706","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322017","23.046","0.005","7.508","0.0015","23.808","0.005","90","","90","","90","","4119.5","1.5","293","2","293","2","","","","","","","","6","C m c a","-C 2ac 2","64","","","","- C14 H26 N6 Ni O3 P2 -","- C14 H26 N6 Ni O3 P2 -","- C112 H208 N48 Ni8 O24 P16 -","8","","","Donald J. Darensbourg; Jeffrey B. Robertson; David L. Larkins; Joseph H. Reibenspies","Water-Soluble Organometallic Compounds. 7.1 Further Studies of 1,3,5-Triaza-7-Phosphaadamantane Derivatives of Group 10 Metals, Including Metal Carbonyls and Hydrides","Inorganic Chemistry","1999","38","","2473","2481","10.1021/ic981243j","","","0.71073","MoKα","","0.0752","0.0665","","0.2465","0.2279","","","","1.981","2.01","2.01","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322018","19.8476","0.0019","19.8476","0.0019","19.8476","0.0019","90","","90","","90","","7818.5","1.3","193","2","193","2","","","","","","","","7","F d -3 :2","-F 2uv 2vw 3","203","","","","- C24 H60 Cl N12 O6 P4 Pt -","- C24 H60 Cl N12 O6 P4 Pt -","- C192 H480 Cl8 N96 O48 P32 Pt8 -","8","0.0833333","","Donald J. Darensbourg; Jeffrey B. Robertson; David L. Larkins; Joseph H. Reibenspies","Water-Soluble Organometallic Compounds. 7.1 Further Studies of 1,3,5-Triaza-7-Phosphaadamantane Derivatives of Group 10 Metals, Including Metal Carbonyls and Hydrides","Inorganic Chemistry","1999","38","","2473","2481","10.1021/ic981243j","","","0.71073","MoKα","","0.0793","0.057","","","0.1132","0.1255","","","","","","1.024","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322019","25.079","0.005","21.639","0.004","17.325","0.004","90","","115.61","0.03","90","","8478","4","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C24 H56 B2 F8 N12 O4 P4 Pt -","- C24 H56 B2 F8 N12 O4 P4 Pt -","- C192 H448 B16 F64 N96 O32 P32 Pt8 -","8","1","","Donald J. Darensbourg; Jeffrey B. Robertson; David L. Larkins; Joseph H. Reibenspies","Water-Soluble Organometallic Compounds. 7.1 Further Studies of 1,3,5-Triaza-7-Phosphaadamantane Derivatives of Group 10 Metals, Including Metal Carbonyls and Hydrides","Inorganic Chemistry","1999","38","","2473","2481","10.1021/ic981243j","","","1.54184","CuKα","","0.1665","0.0828","","0.1914","0.1771","","","","1.194","1.467","1.467","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322020","16.063","0.003","15.895","0.003","19.703","0.004","90","","107.11","0.03","90","","4808","1.8","183","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","6,13-Diethoxycarbonyl-7,12-dimethyl-1,4,8,11-tetraazacyclotetradeka- 5,7,12,14-tetraenato-iron(III)-ioded","","- C21.5 H10 Fe I N4 O4 -","- C21.5 H30 Fe I N4 O4 -","- C172 H240 Fe8 I8 N32 O32 -","8","1","","Heike Keutel; Indira Käpplinger; Ernst-Gottfried Jäger; Michael Grodzicki; Volker Schünemann; Alfred Xaver Trautwein","Structural, Magnetic, and Electronic Properties of a Pentacoordinated Intermediate-Spin (S=3/2) Iron(III) Complex with a Macrocyclic [N4]2-Ligand","Inorganic Chemistry","1999","38","","2320","2327","10.1021/ic981276z","","","0.71073","MoKα","","0.0869","0.0389","","0.1201","0.0833","","","","1.094","1.024","1.024","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322021","22.2416","0.0014","8.907","0.0007","18.5029","0.0013","90","","119.528","0.001","90","","3189.4","0.4","150","2","150","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C15 H45 Al Cl2 N4 P2 Si5 -","- C15 H45 Al Cl2 N4 P2 Si5 -","- C60 H180 Al4 Cl8 N16 P8 Si20 -","4","1","","Neil Burford; Daren J. LeBlanc","Iminophosphine Cycloaddition Reactions of a Diazaphosphoniaaluminatacyclobutane and a Novel Intramolecular Phosphiridine P\ρightarrowP Coordination","Inorganic Chemistry","1999","38","","2248","2249","10.1021/ic9813718","","","0.71073","MoKα","","0.0656","0.0414","","","0.0836","0.091","","","","","","0.979","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322022","14.6485","0.0003","18.6224","0.0004","17.3207","0.0004","90","","98.626","0.001","90","","4671.47","0.18","150","2","150","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C36 H56 Al Cl2 N4 P3 Si4 -","- C36 H56 Al Cl2 N4 P3 Si4 -","- C144 H224 Al4 Cl8 N16 P12 Si16 -","4","1","","Neil Burford; Daren J. LeBlanc","Iminophosphine Cycloaddition Reactions of a Diazaphosphoniaaluminatacyclobutane and a Novel Intramolecular Phosphiridine P\ρightarrowP Coordination","Inorganic Chemistry","1999","38","","2248","2249","10.1021/ic9813718","","","0.71073","MoKα","","0.0798","0.0457","","","0.1212","0.1361","","","","","","1.022","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322023","15.5968","0.0011","16.7018","0.0011","15.5733","0.0007","90","","112.076","0.005","90","","3759.3","0.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C84 H68 B Cu2 F4 N6 P4 -","- C84 H68 B Cu2 F4 N6 P4 -","- C168 H136 B2 Cu4 F8 N12 P8 -","2","0.5","","Manuela Schwach; Hans-Dieter Hausen; Wolfgang Kaim","The First Crystal Structure of a Metal-Stabilized Tetrazine Anion Radical: Formation of a Dicopper Complex through Self-Assembly in a Comproportionation Reaction","Inorganic Chemistry","1999","38","","2242","2243","10.1021/ic9814625","","","0.71073","MoKα","","0.0874","0.0616","","0.1891","0.1653","","","","1.062","1.119","1.119","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322024","14.441","0.003","15.194","0.003","14.085","0.003","90","","90","","90","","3090.5","1.1","293","2","293","2","","","","","","","","6","C m c m","-C 2c 2","63","Oxophthalocyaninato molibden(V) triiodide","","","- C32 H16 I3 Mo N8 O -","- C32 H16 I3 Mo N8 O -","- C128 H64 I12 Mo4 N32 O4 -","4","0.25","","Jan Janczak; Ryszard Kubiak","Synthesis, Structure, and Characterization of Oxomolybdenum(V) Phthalocyaninato(2-) Triiodide","Inorganic Chemistry","1999","38","","2429","2433","10.1021/ic9900410","","","0.71073","MoKα","","0.0319","0.023","","","0.056","0.0592","","","","","","1.028","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322025","31.551","0.001","31.551","0.001","12.9","0.001","90","","90","","90","","12841.5","1.1","100","2","100","2","","","","","","","","7","P 42/n :2","-P 4bc","86","","","","- C299 H319 Cl3 N24 O4 Ru4 Zn -","- C220 H136 Cl N24 O4 Ru4 Zn -","- C440 H272 Cl2 N48 O8 Ru8 Zn2 -","2","0.25","","Enzo Alessio; Silvano Geremia; Stefano Mestroni; Ivana Srnova; Miroslav Slouf; Teresa Gianferrara; Anna Prodi","Porphyrin ""Flying-Saucers"": Solid State and Solution Structure of a Novel Pentameric Array of Axially-Ligated Canted Porphyrins","Inorganic Chemistry","1999","38","","2527","2529","10.1021/ic990084g","","","0.8","synchrotron","","0.0979","0.0832","","","0.237","0.245","","","","","","1.063","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322026","7.011","0.001","9.773","0.002","10.331","0.001","113.73","0.01","91.05","0.02","92.42","0.02","646.96","0.18","155","2","155","2","","","","","","","","4","P -1","-P 1","2","","","","- Cs F10 O6 Re3 -","- Cs F10 O6 Re3 -","- Cs2 F20 O12 Re6 -","2","1","","William J. Casteel; David A. Dixon; Nicolas LeBlond; Philippa E. Lock; Hélène P. A. Mercier; Gary J. Schrobilgen","Lewis Acid Behavior of ReO2F3: Synthesis of (ReO2F3)\ιnfty, ReO2F4-, Re2O4F7-, Re3O6F10-, and ReO2F3(CH3CN) and Study by NMR Spectroscopy, Raman Spectroscopy, and Density Functional Theory Calculations; and X-ray Structures of [Li][ReO2F4], [K][Re2O4F7], [K][Re2O4F7].2ReO2F3, [Cs][Re3O6F10], and ReO3F(CH3CN)2.CH3CN","Inorganic Chemistry","1999","38","","2340","2358","10.1021/ic980695t","","","0.56086","AgKα","","0.0694","0.0533","","0.1511","0.1395","","","","1.035","1.073","1.073","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322027","10.068","0.001","10.756","0.001","14.323","0.002","98.64","0.01","96.33","0.009","96.472","0.009","1510.9","0.3","293.2","","293.2","","","","","","","","","7","P -1","-P 1","2","","","","- C23 H29 Cl3 N2 O6 P2 W -","- C23 H29 Cl3 N2 O6 P2 W -","- C46 H58 Cl6 N4 O12 P4 W2 -","2","1","","Hiroshige Ishino; Shin'ichi Tokunaga; Hidetake Seino; Youichi Ishii; Masanobu Hidai","Synthesis and Structures of Tungsten (1-Pyridinio)imido Complexes and Their Facile N-N Bond Cleavage1","Inorganic Chemistry","1999","38","","2489","2496","10.1021/ic981116n","","","0.7107","MoKα","","0.032","0.032","","","0.0289","0.0289","","","","","","2.014","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322028","12.734","0.003","13.221","0.003","16.33","0.003","90","","90.18","0.03","90","","2749.2","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H28 N4 Ni O2 S2 -","- C24 H28 N4 Ni O2 S2 -","- C96 H112 N16 Ni4 O8 S8 -","4","1","","Chin-Ti Chen; Sish-Yuan Liao; Kuan-Jiuh Lin; Chiung-Hsueh Chen; Tzu-Yao Jeremy Lin","Structural Effects on Molecular Dipoles and Solvatochromism of Nickel(diimine)(dithiolate) Complexes","Inorganic Chemistry","1999","38","","2734","2741","10.1021/ic981125w","","","0.7093","","","0.1034","0.0616","","0.241","0.2114","","","","1.003","1.147","1.147","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322029","10.224","0.002","12.529","0.003","13.017","0.003","102.49","0.03","109.39","0.03","94.08","0.03","1517","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H30 F6 N2 Ni O3 S2 -","- C24 H30 F6 N2 Ni O3 S2 -","- C48 H60 F12 N4 Ni2 O6 S4 -","2","1","","Chin-Ti Chen; Sish-Yuan Liao; Kuan-Jiuh Lin; Chiung-Hsueh Chen; Tzu-Yao Jeremy Lin","Structural Effects on Molecular Dipoles and Solvatochromism of Nickel(diimine)(dithiolate) Complexes","Inorganic Chemistry","1999","38","","2734","2741","10.1021/ic981125w","","","0.71069","MoKα","","0.1473","0.0871","","0.3064","0.2614","","","","0.932","1.119","1.119","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322030","7.935","0.009","11.528","0.002","14.45","0.003","90","","91.51","0.05","90","","1321.4","1.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H2 F6 N4 Ni S2 -","- C8 H2 F6 N4 Ni S2 -","- C32 H8 F24 N16 Ni4 S8 -","4","1","","Chin-Ti Chen; Sish-Yuan Liao; Kuan-Jiuh Lin; Chiung-Hsueh Chen; Tzu-Yao Jeremy Lin","Structural Effects on Molecular Dipoles and Solvatochromism of Nickel(diimine)(dithiolate) Complexes","Inorganic Chemistry","1999","38","","2734","2741","10.1021/ic981125w","","","0.71069","MoKα","","0.0821","0.0369","","0.1163","0.0991","","","","0.911","1.035","1.035","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322031","7.8144","0.0014","10.345","0.002","18.481","0.008","75.07","0.02","83.97","0.03","78.98","0.02","1414.5","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H24 F6 N2 Ni O4 S2 -","- C24 H24 F6 N2 Ni O4 S2 -","- C48 H48 F12 N4 Ni2 O8 S4 -","2","1","","Chin-Ti Chen; Sish-Yuan Liao; Kuan-Jiuh Lin; Chiung-Hsueh Chen; Tzu-Yao Jeremy Lin","Structural Effects on Molecular Dipoles and Solvatochromism of Nickel(diimine)(dithiolate) Complexes","Inorganic Chemistry","1999","38","","2734","2741","10.1021/ic981125w","","","0.71069","MoKα","","0.086","0.0544","","0.1894","0.1661","","","","0.908","1.007","1.007","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322032","8.197","0.002","9.462","0.003","12.866","0.004","77.24","0.02","76.99","0.02","74.16","0.02","921.7","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H10 F6 N2 Ni O S2 -","- C17 H10 F6 N2 Ni O S2 -","- C34 H20 F12 N4 Ni2 O2 S4 -","2","1","","Chin-Ti Chen; Sish-Yuan Liao; Kuan-Jiuh Lin; Chiung-Hsueh Chen; Tzu-Yao Jeremy Lin","Structural Effects on Molecular Dipoles and Solvatochromism of Nickel(diimine)(dithiolate) Complexes","Inorganic Chemistry","1999","38","","2734","2741","10.1021/ic981125w","","","0.71069","MoKα","","0.0491","0.0356","","0.1055","0.0986","","","","0.995","1.064","1.064","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322033","15.556","0.004","15.556","0.004","6.9368","0.0008","90","","90","","90","","1678.6","0.6","213","2","213","2","","","","","","","synthesized","5","P 42 21 2","P 4n 2n","94","","Bis(trans-dichloro-bis(cyclohexylamine))-di-molybdenum(II)","","- C24 H52 Cl4 Mo2 N4 -","- C24 H52 Cl4 Mo2 N4 -","- C48 H104 Cl8 Mo4 N8 -","2","0.25","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 3. Preparation, Characterization, and Crystal Structure of Mo2Cl4(NH2R)4 (R = Et, Prn, But, Cy): First Quadruply-Bonded Dimolybdenum Compounds with Primary Amine Ligands","Inorganic Chemistry","1999","38","","2649","2654","10.1021/ic981289c","","","0.71073","MoKα","","0.0389","0.0374","","0.0933","0.0918","","","","1.088","1.093","1.093","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:36",""
"4322034","13.328","0.003","26.639","0.005","6.774","0.002","90","","90","","90","","2405.1","1","153","2","153","2","","","","","","","synthesized","5","C c c a :2","-C 2a 2ac","68","","Bis(trans-dichloro-bis(propylamine))-di-molybdenum(II)","","- C12 H36 Cl4 Mo2 N4 -","- C12 H36 Cl4 Mo1.998 N4 -","- C48 H144 Cl16 Mo7.992 N16 -","4","0.25","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 3. Preparation, Characterization, and Crystal Structure of Mo2Cl4(NH2R)4 (R = Et, Prn, But, Cy): First Quadruply-Bonded Dimolybdenum Compounds with Primary Amine Ligands","Inorganic Chemistry","1999","38","","2649","2654","10.1021/ic981289c","","","0.71073","MoKα","","0.0705","0.0316","","0.0839","0.0732","","","","1.076","1.177","1.177","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322035","12.37","0.002","17.977","0.002","25.498","0.006","95.32","0.01","103.21","0.02","103.48","0.01","5303.8","1.7","173","2","173","2","","","","","","","synthesized","6","P -1","-P 1","2","","Mer-trichloro-tris(propylamine)-molybdenum(III)","","- C9.67 H28.33 Cl3 Mo N3 O0.17 -","- C9.66667 H28.3333 Cl3 Mo N3 O0.166667 -","- C116 H340 Cl36 Mo12 N36 O2 -","12","6","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 3. Preparation, Characterization, and Crystal Structure of Mo2Cl4(NH2R)4 (R = Et, Prn, But, Cy): First Quadruply-Bonded Dimolybdenum Compounds with Primary Amine Ligands","Inorganic Chemistry","1999","38","","2649","2654","10.1021/ic981289c","","","0.71073","MoKα","","0.0869","0.0551","","0.1579","0.1386","","","","1.033","1.076","1.076","","","","","has coordinates,has disorder","179323","2020-10-21","18:00:00",""
"4322036","19.165","0.001","20.858","0.001","14.14","0.0008","90","","99.002","0.005","90","","5582.8","0.5","213","2","213","2","","","","","","","synthesized","5","P 1 21/c 1","-P 2ybc","14","","Bis(trans-dichloro-bis(butylamine))-di-molybdenum(II)","","- C16 H44 Cl4 Mo2 N4 -","- C16 H44 Cl4 Mo2 N4 -","- C128 H352 Cl32 Mo16 N32 -","8","2","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 3. Preparation, Characterization, and Crystal Structure of Mo2Cl4(NH2R)4 (R = Et, Prn, But, Cy): First Quadruply-Bonded Dimolybdenum Compounds with Primary Amine Ligands","Inorganic Chemistry","1999","38","","2649","2654","10.1021/ic981289c","","","0.71073","MoKα","","0.0582","0.0451","","0.1183","0.1024","","","","1.155","1.115","1.115","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:36",""
"4322037","12.999","0.003","25.389","0.005","16.279","0.003","90","","98.36","0.03","90","","5315.5","1.9","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- Bi2 H92 Na10 O120 W22 -","- Bi2 Na10 O120 W22 -","- Bi4 Na20 O240 W44 -","2","0.5","","Ina Loose; Elisabeth Droste; Michael Bösing; Heinrich Pohlmann; Michael H. Dickman; Cristina Rosu; Michael T. Pope; Bernt Krebs","Heteropolymetalate Clusters of the Subvalent Main Group Elements BiIII and SbIII","Inorganic Chemistry","1999","38","","2688","2694","10.1021/ic981313m","","","0.71073","MoKα","","0.0748","0.0596","","","0.1665","0.174","","","","","","1.06","","","","has coordinates","289031","2024-01-11","08:36:03",""
"4322038","12.903","0.003","25.142","0.005","16.23","0.003","90","","94.53","0.03","90","","5248.7","1.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- Bi Co0.86 H23.5 Na4.44 O58.5 W10.14 -","- Bi Co0.86 Na4.44 O58.5 W10.14 -","- Bi4 Co3.44 Na17.76 O234 W40.56 -","4","1","","Ina Loose; Elisabeth Droste; Michael Bösing; Heinrich Pohlmann; Michael H. Dickman; Cristina Rosu; Michael T. Pope; Bernt Krebs","Heteropolymetalate Clusters of the Subvalent Main Group Elements BiIII and SbIII","Inorganic Chemistry","1999","38","","2688","2694","10.1021/ic981313m","","","0.71073","MoKα","","0.0639","0.0549","","","0.1335","0.1389","","","","","","1.158","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322039","12.583","0.0001","26.4969","0.0001","12.8111","0.0001","90","","93.0076","0.0004","90","","4265.47","0.05","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- Bi2 Co1.66 Na8.8 O102 W20.34 -","- Bi2 Co1.66 Na8.8 O102 W20.34 -","- Bi4 Co3.32 Na17.6 O204 W40.68 -","2","0.5","","Ina Loose; Elisabeth Droste; Michael Bösing; Heinrich Pohlmann; Michael H. Dickman; Cristina Rosu; Michael T. Pope; Bernt Krebs","Heteropolymetalate Clusters of the Subvalent Main Group Elements BiIII and SbIII","Inorganic Chemistry","1999","38","","2688","2694","10.1021/ic981313m","","","0.71073","MoKα","","0.0753","0.0527","","0.1164","0.1082","","","","1.109","1.159","1.159","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322040","12.852","0.003","17.512","0.004","18.908","0.004","90","","91.99","0.03","90","","4252.9","1.7","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- Bi2 H50 K3 Na7 O95 W20 Zn2 -","- Bi2 K3 Na7 O95 W20 Zn2 -","- Bi4 K6 Na14 O190 W40 Zn4 -","2","0.5","","Ina Loose; Elisabeth Droste; Michael Bösing; Heinrich Pohlmann; Michael H. Dickman; Cristina Rosu; Michael T. Pope; Bernt Krebs","Heteropolymetalate Clusters of the Subvalent Main Group Elements BiIII and SbIII","Inorganic Chemistry","1999","38","","2688","2694","10.1021/ic981313m","","","0.71073","MoKα","","0.1193","0.0856","","","0.2088","0.2332","","","","","","1.028","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322041","17.995","0.009","11.976","0.005","22.08","0.012","90","","112.57","0.03","90","","4394","4","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C0 H72 Fe2 K6 Na O105 Sb2 W20 -","- Fe2 K6 O102 Sb2 W20 -","- Fe4 K12 O204 Sb4 W40 -","2","0.5","","Ina Loose; Elisabeth Droste; Michael Bösing; Heinrich Pohlmann; Michael H. Dickman; Cristina Rosu; Michael T. Pope; Bernt Krebs","Heteropolymetalate Clusters of the Subvalent Main Group Elements BiIII and SbIII","Inorganic Chemistry","1999","38","","2688","2694","10.1021/ic981313m","","","0.71069","MoKα","","0.1109","0.0962","","0.2644","0.2521","","","","1.024","1.105","1.105","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322042","12.757","0.003","15.002","0.003","16.139","0.003","68.43","0.03","89.85","0.03","66.86","0.03","2604.7","1.4","213","2","213","2","","","","","","","","7","P -1","-P 1","2","","","","- Bi H56 N3 Na2 O57 W10 Zn -","- Bi Na2 O60 W10 Zn -","- Bi2 Na4 O120 W20 Zn2 -","2","1","","Ina Loose; Elisabeth Droste; Michael Bösing; Heinrich Pohlmann; Michael H. Dickman; Cristina Rosu; Michael T. Pope; Bernt Krebs","Heteropolymetalate Clusters of the Subvalent Main Group Elements BiIII and SbIII","Inorganic Chemistry","1999","38","","2688","2694","10.1021/ic981313m","","","0.71073","MoKα","","0.1245","0.0878","","","0.2122","0.2465","","","","","","1.065","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322043","13.592","0.005","19.286","0.005","21.237","0.005","90","","93.09","0.03","90","","5559","3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H107 Bi2 Fe2 N5 O92 W20 -","- C16 Bi2 Fe2 N4 O93 W20 -","- C32 Bi4 Fe4 N8 O186 W40 -","2","0.5","","Ina Loose; Elisabeth Droste; Michael Bösing; Heinrich Pohlmann; Michael H. Dickman; Cristina Rosu; Michael T. Pope; Bernt Krebs","Heteropolymetalate Clusters of the Subvalent Main Group Elements BiIII and SbIII","Inorganic Chemistry","1999","38","","2688","2694","10.1021/ic981313m","","","0.71069","MoKα","","0.1242","0.0776","","0.1803","0.16","","","","1.064","1.158","1.158","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322044","20.744","0.003","15.474","0.002","26.158","0.005","90","","90.6","0.01","90","","8396","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Co2 H78 N10 O89 Sb2 W20 -","- Co2 O99 Sb2 W20 -","- Co8 O396 Sb8 W80 -","4","0.5","","Ina Loose; Elisabeth Droste; Michael Bösing; Heinrich Pohlmann; Michael H. Dickman; Cristina Rosu; Michael T. Pope; Bernt Krebs","Heteropolymetalate Clusters of the Subvalent Main Group Elements BiIII and SbIII","Inorganic Chemistry","1999","38","","2688","2694","10.1021/ic981313m","","","0.71073","MoKα","","0.0765","0.0504","","0.1343","0.1209","","","","1.06","1.101","1.101","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322045","15.239","0.003","15.852","0.003","11.79","0.002","90","","90","","90","","2848.1","0.9","213","2","213","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C16 H18 Cl6 Cr4 O5 -","- C8 H9 Cl3 Cr2 O2.5 -","- C64 H72 Cl24 Cr16 O20 -","8","2","","F. Albert Cotton; Carlos A. Murillo; Isabel Pascual","First Cr(II) Complex with a Tetrahedral M4(μ4-O) Core: [M4(μ4-O)(μ-Cl)6(THF)4]","Inorganic Chemistry","1999","38","","2746","2749","10.1021/ic9814468","","","0.71073","MoKα","","0.0403","0.0393","","0.1059","0.103","","","","0.989","0.981","0.981","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322046","12.673","0.001","14.138","0.002","23.89","0.003","90","","90","","90","","4280.4","0.9","173","2","173","2","","","","","","","synthesis","6","P c c n","-P 2ab 2ac","56","","","","- C44 H40 Cl2 N12 Ni3 O -","- C44 H32 Cl2 N12 Ni3 O -","- C176 H128 Cl8 N48 Ni12 O4 -","4","0.5","","Rodolphe Clérac; F. Albert Cotton; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual; Xiaoping Wang","Further Study of the Linear Trinickel(II) Complex of Dipyridylamide","Inorganic Chemistry","1999","38","","2655","2657","10.1021/ic990006t","","","0.71073","MoKα","","0.1066","0.0463","","0.1306","0.1101","","","","1.09","1.171","1.171","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322047","27.3046","0.0007","27.3046","0.0007","12.2452","0.0002","90","","90","","90","","9129.3","0.4","213","2","213","2","","","","","","","synthesis","5","I -4","I -4","82","","","","- C42 H36 Cl6 N12 Ni3 -","- C42 H34 Cl6 N12 Ni3 -","- C336 H272 Cl48 N96 Ni24 -","8","1","","Rodolphe Clérac; F. Albert Cotton; Kim R. Dunbar; Carlos A. Murillo; Isabel Pascual; Xiaoping Wang","Further Study of the Linear Trinickel(II) Complex of Dipyridylamide","Inorganic Chemistry","1999","38","","2655","2657","10.1021/ic990006t","","","0.71073","MoKα","","0.0408","0.0392","","0.0996","0.0978","","","","1.073","1.074","1.074","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322048","10.1851","0.0004","10.2318","0.0007","27.617","0.002","94.457","0.007","91.462","0.006","90.214","0.006","2868.3","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","Cs7In4Bi6","","- Bi12 Cs14 In8 -","- Bi12 Cs14 In8 -","- Bi24 Cs28 In16 -","2","1","","Svilen Bobev; Slavi C. Sevov","Cs7In4Bi6: A Zintl Phase Tailored from the PbO-Type Layers of the Parent InBi Compound","Inorganic Chemistry","1999","38","","2672","2675","10.1021/ic990113n","","","0.71073","MoKα","","0.0982","0.0748","","0.3606","0.1917","","","","1.445","1.503","1.503","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322049","18.6778","0.0005","5.1046","0.0002","16.6257","0.0002","90","","90","","90","","1585.14","0.08","115","2","115","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C14 H10 Cl3 Cu3 N4 -","- C14 H10 Cl3 Cu3 N4 -","- C56 H40 Cl12 Cu12 N16 -","4","1","","Douglas J. Chesnut; Anakarin Kusnetzow; Robert R. Birge; Jon Zubieta","Solid State Coordination Chemistry of the Copper Halide- and Pseudo-Halide-Organoamine System, Cu-X-[(bis-2,3-(2-pyridyl)pyrazine)] (X = Cl, Br, CN): Hydrothermal Synthesis and Structural Characterization","Inorganic Chemistry","1999","38","","2663","2671","10.1021/ic990132x","","","0.71073","MoKα","","0.0942","0.0684","","0.1271","0.1158","","","","1.159","1.191","1.191","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322050","7.795","0.0001","8.857","","11.1268","0.0002","72.2","","83.05","0.001","73.832","0.001","701.954","0.016","115","2","115","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H24 Br2 Cu2 N8 O2 -","- C28 H20 Br2 Cu2 N8 O2 -","- C28 H20 Br2 Cu2 N8 O2 -","1","0.5","","Douglas J. Chesnut; Anakarin Kusnetzow; Robert R. Birge; Jon Zubieta","Solid State Coordination Chemistry of the Copper Halide- and Pseudo-Halide-Organoamine System, Cu-X-[(bis-2,3-(2-pyridyl)pyrazine)] (X = Cl, Br, CN): Hydrothermal Synthesis and Structural Characterization","Inorganic Chemistry","1999","38","","2663","2671","10.1021/ic990132x","","","0.71073","MoKα","","0.0383","0.0328","","","0.0861","0.0888","","","","","","1.036","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322051","10.884","0.002","16.713","0.004","9.307","0.002","90","","113.199","0.005","90","","1556.1","0.6","115","2","115","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Br2 Cu2 N4 -","- C14 H10 Br2 Cu2 N4 -","- C56 H40 Br8 Cu8 N16 -","4","0.5","","Douglas J. Chesnut; Anakarin Kusnetzow; Robert R. Birge; Jon Zubieta","Solid State Coordination Chemistry of the Copper Halide- and Pseudo-Halide-Organoamine System, Cu-X-[(bis-2,3-(2-pyridyl)pyrazine)] (X = Cl, Br, CN): Hydrothermal Synthesis and Structural Characterization","Inorganic Chemistry","1999","38","","2663","2671","10.1021/ic990132x","","","0.71073","MoKα","","0.0388","0.0344","","","0.0875","0.0898","","","","","","1.05","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322052","12.8549","0.0002","9.0875","0.0001","16.0023","0.0002","90","","110.476","0.001","90","","1751.26","0.04","115","2","115","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H10 Cu3 N7 -","- C17 H10 Cu3 N7 -","- C68 H40 Cu12 N28 -","4","1","","Douglas J. Chesnut; Anakarin Kusnetzow; Robert R. Birge; Jon Zubieta","Solid State Coordination Chemistry of the Copper Halide- and Pseudo-Halide-Organoamine System, Cu-X-[(bis-2,3-(2-pyridyl)pyrazine)] (X = Cl, Br, CN): Hydrothermal Synthesis and Structural Characterization","Inorganic Chemistry","1999","38","","2663","2671","10.1021/ic990132x","","","0.71073","MoKα","","0.0596","0.0406","","","0.0795","0.0859","","","","","","1.067","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322053","13.609","0.001","16.598","0.002","17.302","0.002","100.35","0.02","111.26","0.02","111.67","0.02","3155.2","1.2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C138 H166 B2 Fe2 N12 S6 Sn -","- C138 H166 B2 Fe2 N12 S6 Sn -","- C138 H166 B2 Fe2 N12 S6 Sn -","1","0.5","","Thorsten Glaser; Eckhard Bill; Thomas Weyhermüller; Wolfram Meyer-Klaucke; Karl Wieghardt","Sn(III) and Ge(III) in the Thiophenolato-Bridged Complexes [LFeSnFeL]n+ and [LFeGeFeL]n+ (n = 2, 3; L = 1,4,7-(4-tert-Butyl-2-mercaptobenzyl)-1,4,7-triazacyclononane)","Inorganic Chemistry","1999","38","","2632","2642","10.1021/ic9902018","","","0.71073","MoKα","","0.0509","0.0438","","0.119","0.1086","","","","1.078","1.049","1.049","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322054","15.772","0.002","17.527","0.002","20.096","0.003","72.95","0.02","79.09","0.02","68.5","0.02","4920.6","1.4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C91.5 H135 Cl3 Fe2 N6 O16.5 S6 Sn -","- C91.5 H126 Cl3 Fe2 N6 O16.5 S6 Sn -","- C183 H252 Cl6 Fe4 N12 O33 S12 Sn2 -","2","1","","Thorsten Glaser; Eckhard Bill; Thomas Weyhermüller; Wolfram Meyer-Klaucke; Karl Wieghardt","Sn(III) and Ge(III) in the Thiophenolato-Bridged Complexes [LFeSnFeL]n+ and [LFeGeFeL]n+ (n = 2, 3; L = 1,4,7-(4-tert-Butyl-2-mercaptobenzyl)-1,4,7-triazacyclononane)","Inorganic Chemistry","1999","38","","2632","2642","10.1021/ic9902018","","","0.71073","MoKα","","0.0957","0.0558","","0.1536","0.1098","","","","1.103","1.012","1.012","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322055","13.531","0.001","16.578","0.002","17.199","0.002","100.06","0.02","112.15","0.02","112.01","0.02","3080.4","1.2","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C138 H166 B2 Fe2 Ge N12 S6 -","- C138 H166 B2 Fe2 Ge N12 S6 -","- C138 H166 B2 Fe2 Ge N12 S6 -","1","0.5","","Thorsten Glaser; Eckhard Bill; Thomas Weyhermüller; Wolfram Meyer-Klaucke; Karl Wieghardt","Sn(III) and Ge(III) in the Thiophenolato-Bridged Complexes [LFeSnFeL]n+ and [LFeGeFeL]n+ (n = 2, 3; L = 1,4,7-(4-tert-Butyl-2-mercaptobenzyl)-1,4,7-triazacyclononane)","Inorganic Chemistry","1999","38","","2632","2642","10.1021/ic9902018","","","0.71073","MoKα","","0.1612","0.0792","","0.1896","0.1366","","","","1.075","1.105","1.105","","","","","has coordinates,has disorder","179323","2020-10-21","18:00:00",""
"4322056","12.657","0.003","14.833","0.003","17.707","0.004","79.65","0.02","86.06","0.02","68.69","0.02","3046.6","1.3","178","2","178","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H55 Cu5 Gd N18 O24.25 -","- C45 H55 Cu5 Gd N18 O24.25 -","- C90 H110 Cu10 Gd2 N36 O48.5 -","2","1","","Ann J. Stemmler; Jeff W. Kampf; Martin L. Kirk; Bassel H. Atasi; Vincent L. Pecoraro","The Preparation, Characterization, and Magnetism of Copper 15-Metallacrown-5 Lanthanide Complexes","Inorganic Chemistry","1999","38","","2807","2817","10.1021/ic9800233","","","0.71073","MoKα","","0.0829","0.0534","","0.1378","0.1289","","","","0.986","1.122","1.122","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322057","16.319","0.002","21.863","0.002","18.41","0.003","90","","96.85","0.01","90","","6521.5","1.5","178","2","178","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C45 H55 Cu5 Eu N19 O24 -","- C48 H62 Cu5 Eu N19 O25 -","- C192 H248 Cu20 Eu4 N76 O100 -","4","1","","Ann J. Stemmler; Jeff W. Kampf; Martin L. Kirk; Bassel H. Atasi; Vincent L. Pecoraro","The Preparation, Characterization, and Magnetism of Copper 15-Metallacrown-5 Lanthanide Complexes","Inorganic Chemistry","1999","38","","2807","2817","10.1021/ic9800233","","","0.71073","MoKα","","0.1262","0.0463","","0.0935","0.075","","","","0.737","0.935","0.935","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322058","11.163","0.005","11.524","0.004","13.323","0.004","93.85","0.03","94.79","0.03","107.14","0.03","1624.5","1.1","293","2","178","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H36 Cu5 Eu N12 O24.5 -","- C10 H20 Cu5 Eu N12 O24.5 -","- C20 H40 Cu10 Eu2 N24 O49 -","2","1","","Ann J. Stemmler; Jeff W. Kampf; Martin L. Kirk; Bassel H. Atasi; Vincent L. Pecoraro","The Preparation, Characterization, and Magnetism of Copper 15-Metallacrown-5 Lanthanide Complexes","Inorganic Chemistry","1999","38","","2807","2817","10.1021/ic9800233","","","0.71073","MoKα","","0.1578","0.123","","0.3277","0.2979","","","","1.016","1.114","1.114","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322059","13.978","0.006","8.103","0.003","18.037","0.005","90","","98.61","0.03","90","","2019.9","1.3","20","","20","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H23 Cl Cu N6 O5 -","- C64 H92 Cl4 Cu4 N24 O20 -","- C64 H92 Cl4 Cu4 N24 O20 -","","","","Hiromasa Kurosaki; Kentarou Hayashi; Yoshinobu Ishikawa; Masafumi Goto; Kazufumi Inada; Isao Taniguchi; Mitsuhiko Shionoya; Eiichi Kimura","New Robust Bleomycin Analogues: Synthesis, Spectroscopy, and Crystal Structures of the Copper(II) Complexes","Inorganic Chemistry","1999","38","","2824","2832","10.1021/ic980510i","","","0.7107","MoKalpha","","","0.053","","","0.044","","","","","2.87","2.87","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322060","16.092","0.004","7.974","0.004","16.819","0.002","90","","99.64","0.01","90","","2127.7","1.2","20","","20","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C18 H27 B Cu F4 N6 O -","- C72 H108 B4 Cu4 F16 N24 O4 -","- C72 H108 B4 Cu4 F16 N24 O4 -","","","","Hiromasa Kurosaki; Kentarou Hayashi; Yoshinobu Ishikawa; Masafumi Goto; Kazufumi Inada; Isao Taniguchi; Mitsuhiko Shionoya; Eiichi Kimura","New Robust Bleomycin Analogues: Synthesis, Spectroscopy, and Crystal Structures of the Copper(II) Complexes","Inorganic Chemistry","1999","38","","2824","2832","10.1021/ic980510i","","","1.5418","CuKalpha","","","0.04","","","0.025","","","","","1.67","1.67","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322061","10.983","0.005","16.96","0.006","9.058","0.004","90","","98.03","0.07","90","","1670.7","1.2","295","2","295","2","","","","","","","synthesis","6","P 1 21 1","P 2yb","4","","","","- C23 H39 Ce Cl3 N3 O10 -","- C23 H27 Ce Cl3 N3 O10 -","- C46 H54 Ce2 Cl6 N6 O20 -","2","1","","Umberto Casellato; Sergio Tamburini; Patrizia Tomasin; Pietro A. Vigato; Silvio Aime; Mauro Botta","Synthesis, X-ray Structure, and Solution NMR Studies of Ln(III) Complexes with a Macrocyclic Asymmetric Compartmental Schiff Base. Preference of the Ln(III) Ions for a Crown-Like Coordination Site","Inorganic Chemistry","1999","38","","2906","2916","10.1021/ic980715r","","","0.71073","MoKα","","0.0922","0.0813","","0.2379","0.2084","","","","2.392","2.392","2.392","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322062","10.87","0.005","16.785","0.006","9.046","0.004","90","","97.91","0.07","90","","1634.8","1.2","295","2","295","2","","","","","","","synthesis","6","P 1 21 1","P 2yb","4","","","","- C23 H39 Cl3 Dy N3 O10 -","- C22 H27 Cl3 Dy N3 O10 -","- C44 H54 Cl6 Dy2 N6 O20 -","2","1","","Umberto Casellato; Sergio Tamburini; Patrizia Tomasin; Pietro A. Vigato; Silvio Aime; Mauro Botta","Synthesis, X-ray Structure, and Solution NMR Studies of Ln(III) Complexes with a Macrocyclic Asymmetric Compartmental Schiff Base. Preference of the Ln(III) Ions for a Crown-Like Coordination Site","Inorganic Chemistry","1999","38","","2906","2916","10.1021/ic980715r","","","0.71073","MoKα","","0.0541","0.0467","","0.1816","0.1423","","","","1.484","1.484","1.484","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322063","15.269","0.005","11.484","0.005","19.389","0.007","90","","102.85","0.06","90","","3315","2","293","2","295","2","","","","","","","synthesis","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H43 Cl3 Lu N3 O12 -","- C23 H27 Cl3 Lu N3 O12 -","- C92 H108 Cl12 Lu4 N12 O48 -","4","1","","Umberto Casellato; Sergio Tamburini; Patrizia Tomasin; Pietro A. Vigato; Silvio Aime; Mauro Botta","Synthesis, X-ray Structure, and Solution NMR Studies of Ln(III) Complexes with a Macrocyclic Asymmetric Compartmental Schiff Base. Preference of the Ln(III) Ions for a Crown-Like Coordination Site","Inorganic Chemistry","1999","38","","2906","2916","10.1021/ic980715r","","","0.71073","MoKα","","0.1071","0.0639","","0.329","0.2028","","","","1.965","1.965","1.965","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322064","13.7621","0.001","8.7492","0.0013","10.0073","0.001","90","","90","","90","","1205","0.2","113","2","113","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C8 H19 Br2 Cu N3 -","- C8 H19 Br2 Cu N3 -","- C32 H76 Br8 Cu4 N12 -","4","0.5","","Eric L. Hegg; Stephen H. Mortimore; Chin Li Cheung; Jennifer E. Huyett; Douglas R. Powell; Judith N. Burstyn","Structure-Reactivity Studies in Copper(II)-Catalyzed Phosphodiester Hydrolysis","Inorganic Chemistry","1999","38","","2961","2968","10.1021/ic981087g","","","1.54178","CuKα","","0.0514","0.0449","","0.1048","0.1022","","","","1.178","1.194","1.194","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322065","20.693","0.004","11.429","0.002","20.138","0.004","90","","104.78","0.03","90","","4605.1","1.6","113","2","113","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C7 H17 Br2 Cu N3 -","- C7 H17 Br2 Cu N3 -","- C112 H272 Br32 Cu16 N48 -","16","2","","Eric L. Hegg; Stephen H. Mortimore; Chin Li Cheung; Jennifer E. Huyett; Douglas R. Powell; Judith N. Burstyn","Structure-Reactivity Studies in Copper(II)-Catalyzed Phosphodiester Hydrolysis","Inorganic Chemistry","1999","38","","2961","2968","10.1021/ic981087g","","","1.54178","CuKα","","0.0791","0.0786","","0.2076","0.2071","","","","1.163","1.172","1.172","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322066","13.019","0.004","13.765","0.006","15.549","0.005","93.74","0.03","90.35","0.03","92.07","0.03","2778.6","1.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C68 H56 Fe2 Ir P4 -","- C68 H56 Fe2 Ir P4 -","- C136 H112 Fe4 Ir2 P8 -","2","1","","Bruno Longato; Lorenzo Riello; Giuliano Bandoli; Giuseppe Pilloni","Iridium(III, 0, and -I) Complexes Stabilized by 1,1'-Bis(diphenylphosphino)ferrocene (dppf): Synthesis and Characterization. Crystal Structures of [Na(THF)5][Ir(dppf)2].THF and [Ir(dppf)2]","Inorganic Chemistry","1999","38","","2818","2823","10.1021/ic981166s","","","0.71073","MoKα","","0.0877","0.0619","","0.1637","0.1464","","","","1.219","1.272","1.272","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322067","13.325","0.003","23.976","0.005","26.774","0.007","90","","98.77","0.02","90","","8454","3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C92 H104 Fe2 Ir Na O6 P4 -","- C92 H104 Fe2 Ir Na O6 P4 -","- C368 H416 Fe8 Ir4 Na4 O24 P16 -","4","1","","Bruno Longato; Lorenzo Riello; Giuliano Bandoli; Giuseppe Pilloni","Iridium(III, 0, and -I) Complexes Stabilized by 1,1'-Bis(diphenylphosphino)ferrocene (dppf): Synthesis and Characterization. Crystal Structures of [Na(THF)5][Ir(dppf)2].THF and [Ir(dppf)2]","Inorganic Chemistry","1999","38","","2818","2823","10.1021/ic981166s","","","0.71073","MoKα","","0.0727","0.0427","","0.2096","0.1174","","","","1.138","1.115","1.115","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322068","11.475","0.001","17.493","0.002","25.697","0.004","86.12","0.02","84.83","0.02","86.85","0.02","5119.3","1.1","298.2","","298.2","","","","","","","","","7","P -1","-P 1","2","","","","- C49 H42 Cl3 N3 Os P4 S4 -","- C49 H42 Cl3 N3 Os P4 S4 -","- C196 H168 Cl12 N12 Os4 P16 S16 -","4","2","","Wa-Hung Leung; Joyce L. C. Chim; Ian D. Williams; Wing-Tak Wong","Reactions of Nitridorhenium(V) and -Osmium(VI) Complexes with Acylating Agents","Inorganic Chemistry","1999","38","","3000","3005","10.1021/ic981244b","","","0.7107","MoKalpha","","","0.0459","","","0.0465","","","","","2.108","2.108","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322069","14.009","0.001","16.85","0.001","23.528","0.002","90","","99.43","0.02","90","","5478.8","0.8","298.2","","298.2","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C51 H43 Cl5 N3 O2 P4 Re S4 -","- C51 H43 Cl5 N3 O2 P4 Re S4 -","- C204 H172 Cl20 N12 O8 P16 Re4 S16 -","4","1","","Wa-Hung Leung; Joyce L. C. Chim; Ian D. Williams; Wing-Tak Wong","Reactions of Nitridorhenium(V) and -Osmium(VI) Complexes with Acylating Agents","Inorganic Chemistry","1999","38","","3000","3005","10.1021/ic981244b","","","0.7107","MoKalpha","","","0.0318","","","0.037","","","","","1.583","1.583","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322070","9.747","0.001","12.578","0.001","15.049","0.002","104.385","0.008","94.942","0.008","90.446","0.008","1779.7","0.3","20","","20","","","","","","","","","7","P -1","-P 1","2","","","","- C29 H48 F3 N O3 Ru2 S3 -","- C58 H96 F6 N2 O6 Ru4 S6 -","- C58 H96 F6 N2 O6 Ru4 S6 -","","","","Takafumi Iwasa; Hitoshi Shimada; Atsushi Takami; Hiroyuki Matsuzaka; Youichi Ishii; Masanobu Hidai","Preparation of Cationic Dinuclear Hydrido Complexes of Ruthenium, Rhodium, and Iridium with Bridging Thiolato Ligands and Their Reactions with Nitrosobenzene","Inorganic Chemistry","1999","38","","2851","2859","10.1021/ic981274e","","","0.7107","MoKalpha","","","0.047","","","0.047","","","","","2.5","2.5","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322071","16.279","0.002","15.332","0.002","19.936","0.002","90","","104.188","0.009","90","","4824","1","23","","23","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C50.5 H66 B Cl Rh2 S2 -","- C204 H260 B4 Cl4 Rh8 S8 -","- C204 H260 B4 Cl4 Rh8 S8 -","","","","Takafumi Iwasa; Hitoshi Shimada; Atsushi Takami; Hiroyuki Matsuzaka; Youichi Ishii; Masanobu Hidai","Preparation of Cationic Dinuclear Hydrido Complexes of Ruthenium, Rhodium, and Iridium with Bridging Thiolato Ligands and Their Reactions with Nitrosobenzene","Inorganic Chemistry","1999","38","","2851","2859","10.1021/ic981274e","","","0.7107","MoKalpha","","","0.04","","","0.026","","","","","1.92","1.92","","","","","has coordinates","191072","2020-10-21","18:00:00",""
"4322072","9.334","0.003","21.871","0.001","15.644","0.003","90","","104.28","0.02","90","","3095","1.2","20","","20","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H45 B F4 Ir2 S2 -","- C104 H180 B4 F16 Ir8 S8 -","- C104 H180 B4 F16 Ir8 S8 -","","","","Takafumi Iwasa; Hitoshi Shimada; Atsushi Takami; Hiroyuki Matsuzaka; Youichi Ishii; Masanobu Hidai","Preparation of Cationic Dinuclear Hydrido Complexes of Ruthenium, Rhodium, and Iridium with Bridging Thiolato Ligands and Their Reactions with Nitrosobenzene","Inorganic Chemistry","1999","38","","2851","2859","10.1021/ic981274e","","","0.7107","MoKalpha","","","0.037","","","0.026","","","","","1.31","1.31","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322073","14.802","0.003","12.929","0.004","19.735","0.003","90","","95.48","0.01","90","","3759.5","1.5","23","","23","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C33 H49 F3 N O4 Ru2 S3 -","- C132 H196 F12 N4 O16 Ru8 S12 -","- C132 H196 F12 N4 O16 Ru8 S12 -","","","","Takafumi Iwasa; Hitoshi Shimada; Atsushi Takami; Hiroyuki Matsuzaka; Youichi Ishii; Masanobu Hidai","Preparation of Cationic Dinuclear Hydrido Complexes of Ruthenium, Rhodium, and Iridium with Bridging Thiolato Ligands and Their Reactions with Nitrosobenzene","Inorganic Chemistry","1999","38","","2851","2859","10.1021/ic981274e","","","0.7107","MoKalpha","","","0.042","","","0.03","","","","","1.53","1.53","","","","","has coordinates","191072","2020-10-21","18:00:00",""
"4322074","11.045","0.003","24.286","0.003","19.249","0.003","90","","90.94","0.02","90","","5162.6","1.7","23","","23","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H69 B N O Rh2 S2 -","- C224 H276 B4 N4 O4 Rh8 S8 -","- C224 H276 B4 N4 O4 Rh8 S8 -","","","","Takafumi Iwasa; Hitoshi Shimada; Atsushi Takami; Hiroyuki Matsuzaka; Youichi Ishii; Masanobu Hidai","Preparation of Cationic Dinuclear Hydrido Complexes of Ruthenium, Rhodium, and Iridium with Bridging Thiolato Ligands and Their Reactions with Nitrosobenzene","Inorganic Chemistry","1999","38","","2851","2859","10.1021/ic981274e","","","0.7107","MoKalpha","","","0.047","","","0.033","","","","","1.6","1.6","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322075","11.031","0.005","24.316","0.005","19.226","0.007","90","","90.91","0.04","90","","5156","3","23","","23","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C56 H69 B Ir2 N O S2 -","- C224 H276 B4 Ir8 N4 O4 S8 -","- C224 H276 B4 Ir8 N4 O4 S8 -","","","","Takafumi Iwasa; Hitoshi Shimada; Atsushi Takami; Hiroyuki Matsuzaka; Youichi Ishii; Masanobu Hidai","Preparation of Cationic Dinuclear Hydrido Complexes of Ruthenium, Rhodium, and Iridium with Bridging Thiolato Ligands and Their Reactions with Nitrosobenzene","Inorganic Chemistry","1999","38","","2851","2859","10.1021/ic981274e","","","0.7107","MoKalpha","","","0.038","","","0.026","","","","","1.83","1.83","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322076","9.028","0.0008","17.032","0.002","37.455","0.004","98.453","0.008","93.899","0.007","91.642","0.008","5679.2","1","23","","23","","","","","","","","","7","P -1","-P 1","2","","","","- C58.5 H75 B Cl2 O0.5 Rh3 S2 -","- C234 H288 B4 Cl8 O2 Rh12 S8 -","- C234 H288 B4 Cl8 O2 Rh12 S8 -","","","","Takafumi Iwasa; Hitoshi Shimada; Atsushi Takami; Hiroyuki Matsuzaka; Youichi Ishii; Masanobu Hidai","Preparation of Cationic Dinuclear Hydrido Complexes of Ruthenium, Rhodium, and Iridium with Bridging Thiolato Ligands and Their Reactions with Nitrosobenzene","Inorganic Chemistry","1999","38","","2851","2859","10.1021/ic981274e","","","0.7107","MoKalpha","","","0.047","","","0.029","","","","","1.51","1.51","","","","","has coordinates","191070","2020-10-21","18:00:00",""
"4322077","12.772","0.006","15.208","0.005","19.601","0.007","90","","90","","90","","3807","3","293","2","293","2","","","","","","","synthesis","7","P 21 21 21","P 2ac 2ab","19","","","","- C36 H39 Cl5 N3 O2 P Ru -","- C36 H39 Cl5 N3 O2 P Ru -","- C144 H156 Cl20 N12 O8 P4 Ru4 -","4","1","","Victorio Cadierno; M. Pilar Gamasa; José Gimeno; Luis Iglesias; Santiago García-Granda","Stereochemically Controlled Synthesis of Ruthenium(II) Complexes Containing Bis(oxazolin-2'-yl)pyridine Ligands. X-ray Crystal Structures of trans-[RuCl2(PPh3){κ3-N,N,N-(S,S)-iPr-pybox}] and [RuCl(CCCPh2)(PPh3){κ3-N,N,N-(S,S)-iPr-pybox}][PF6] ((S,S)-iPr-pybox= 2,6-Bis[4'-(S)-isopropyloxazolin-2'-yl]pyridine)","Inorganic Chemistry","1999","38","","2874","2879","10.1021/ic9813258","","","0.71073","MoKα","","0.0805","0.0565","","","0.0944","0.1086","","","","","","1.049","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322078","14.79","0.03","16.254","0.008","22.917","0.018","90","","90","","90","","5509","12","293","2","293","2","","","","","","","synthesis","8","P 21 21 21","P 2ac 2ab","19","","","","- C54 H56 Cl F6 N3 O3 P2 Ru -","- C54 H56 Cl F6 N3 O3 P2 Ru -","- C216 H224 Cl4 F24 N12 O12 P8 Ru4 -","4","1","","Victorio Cadierno; M. Pilar Gamasa; José Gimeno; Luis Iglesias; Santiago García-Granda","Stereochemically Controlled Synthesis of Ruthenium(II) Complexes Containing Bis(oxazolin-2'-yl)pyridine Ligands. X-ray Crystal Structures of trans-[RuCl2(PPh3){κ3-N,N,N-(S,S)-iPr-pybox}] and [RuCl(CCCPh2)(PPh3){κ3-N,N,N-(S,S)-iPr-pybox}][PF6] ((S,S)-iPr-pybox= 2,6-Bis[4'-(S)-isopropyloxazolin-2'-yl]pyridine)","Inorganic Chemistry","1999","38","","2874","2879","10.1021/ic9813258","","","0.71073","MoKα","","0.1403","0.0545","","","0.1381","0.1679","","","","","","1.03","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322079","8.8353","0.0004","16.728","0.001","12.2105","0.0009","90","","112.543","0.004","90","","1666.78","0.18","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H25 B8 Fe N -","- C12 H25 B8 Fe N -","- C48 H100 B32 Fe4 N4 -","4","1","","Josef Holub; Bohumír Grüner; Ivana Císařová; Jiří Fusek; Zbyněk Plzák; Francesc Teixidor; Clara Viñas; Bohumil Štíbr","A Series of the Twelve-Vertex Ferratricarbollides [2-(η^5^-C~5~H~5~)-9-X-closo-2,1,7,9-FeC~3~B~8~H~10~] where X = H~2~N, MeHN,Me~2~N,Bu^t^HN, and Bu^t^(Me)N. A Highly Stable Metallatricarbaborane System with Amine Functions in the Para Position to the Metal Center","Inorganic Chemistry","1999","38","","2775","2780","10.1021/ic981400e","","","0.71069","MoKα","","0.0369","0.03","","","0.0828","0.0872","","","","","","1.013","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322080","11.1901","0.001","11.2735","0.0012","12.135","0.001","98.996","0.008","117.188","0.006","105.354","0.007","1242.6","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","Complex 1","[(N-(2-(1-naphthyl)ethyl)-1-aza-4,8- dithiacyclodecane)copper(I)(acetonitrile)]hexafluorophosphate","","- C21 H28 Cu F6 N2 P S2 -","- C21 H28 Cu F6 N2 P S2 -","- C42 H56 Cu2 F12 N4 P2 S4 -","2","1","","Rebecca R. Conry; William S. Striejewske; A. Alex Tipton","Copper(I) Complexes with a NS2-Macrocyclic Ligand Bearing a Pendant Naphthyl Group: Structures of {N-[2-(1-Naphthyl)ethyl]-1-aza-4,8-dithiacyclodecane}copper(I)-Ligand, where Ligand = η2-Naphthalene, Acetonitrile, or Triphenylphosphine","Inorganic Chemistry","1999","38","","2833","2843","10.1021/ic981418p","","","0.71073","MoKα","","0.0648","0.0505","","0.1418","0.1291","","","","1.053","1.087","1.087","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:36",""
"4322081","15.7318","0.0015","8.9164","0.001","17.205","0.002","90","","102.431","0.006","90","","2356.8","0.4","300","2","300","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","Complex 2","[(N-(2-(1-naphthyl)ethyl)-1-aza-4,8-dithiacyclodecane)copper(I)] hexafluorophosphate","","- C22 H31 Cu F6 N P S2 -","- C22 H31 Cu F6 N P S2 -","- C88 H124 Cu4 F24 N4 P4 S8 -","4","1","","Rebecca R. Conry; William S. Striejewske; A. Alex Tipton","Copper(I) Complexes with a NS2-Macrocyclic Ligand Bearing a Pendant Naphthyl Group: Structures of {N-[2-(1-Naphthyl)ethyl]-1-aza-4,8-dithiacyclodecane}copper(I)-Ligand, where Ligand = η2-Naphthalene, Acetonitrile, or Triphenylphosphine","Inorganic Chemistry","1999","38","","2833","2843","10.1021/ic981418p","","","0.71073","MoKα","","0.1126","0.0587","","0.1545","0.1285","","","","1.02","1.115","1.115","","","","","has coordinates,has disorder","179323","2020-10-21","18:00:00",""
"4322082","10.8308","0.0009","12.632","0.0008","19.9412","0.0013","80.445","0.005","76.405","0.006","78.825","0.005","2580.7","0.3","299","2","299","2","","","","","","","","7","P -1","-P 1","2","cocrystallized 1&2","","","- C46 H61 Cu2 F12 N3 P2 S4 -","- C46 H61 Cu2 F12 N3 P2 S4 -","- C92 H122 Cu4 F24 N6 P4 S8 -","2","1","","Rebecca R. Conry; William S. Striejewske; A. Alex Tipton","Copper(I) Complexes with a NS2-Macrocyclic Ligand Bearing a Pendant Naphthyl Group: Structures of {N-[2-(1-Naphthyl)ethyl]-1-aza-4,8-dithiacyclodecane}copper(I)-Ligand, where Ligand = η2-Naphthalene, Acetonitrile, or Triphenylphosphine","Inorganic Chemistry","1999","38","","2833","2843","10.1021/ic981418p","","","0.71073","MoKα","","0.1317","0.0661","","0.1871","0.1476","","","","1.013","1.1","1.1","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322083","11.462","0.002","15.972","0.002","19.835","0.009","90","","94.5","0.03","90","","3620","1.8","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","complex 3","[(N-(2-(1-naphthyl)ethyl)-1-aza-4,8- dithiacyclodecane)copper(I)(triphenylphosphine)]hexafluorophosphate","","- C37 H40 Cu F6 N P2 S2 -","- C37 H40 Cu F6 N P2 S2 -","- C148 H160 Cu4 F24 N4 P8 S8 -","4","1","","Rebecca R. Conry; William S. Striejewske; A. Alex Tipton","Copper(I) Complexes with a NS2-Macrocyclic Ligand Bearing a Pendant Naphthyl Group: Structures of {N-[2-(1-Naphthyl)ethyl]-1-aza-4,8-dithiacyclodecane}copper(I)-Ligand, where Ligand = η2-Naphthalene, Acetonitrile, or Triphenylphosphine","Inorganic Chemistry","1999","38","","2833","2843","10.1021/ic981418p","","","0.71073","MoKα","","0.2426","0.0906","","0.1889","0.133","","","","1.027","1.256","1.256","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322084","7.9599","0.0017","15.62","0.003","19.695","0.003","90","","100.439","0.017","90","","2408.2","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H29 Cl2 N5 Ni O8 -","- C18 H29 Cl2 N5 Ni O8 -","- C72 H116 Cl8 N20 Ni4 O32 -","4","1","","Elena V. Rybak-Akimova; Alexander Y. Nazarenko; Svetlana S. Silchenko","Unusual Ligand Isomerization Dictated by Coordination Requirements of the Metal Ion: A Double-Bond Shift in Cu(II)-Assisted Template Condensation between Diacetylpyridine and a Tripodal Tetramine","Inorganic Chemistry","1999","38","","2974","2980","10.1021/ic990027n","","","0.71073","MoKα","","0.1036","0.0657","","","0.1643","0.1937","","","","","","1.04","","","","has coordinates,has disorder","179323","2020-10-21","18:00:00",""
"4322085","16.676","0.004","9.238","0.002","17.46","0.004","90","","112.03","0.02","90","","2493.4","1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H30 Cl2 Cu N5 O8.5 -","- C18 H29 Cl2 Cu N5 O8.5 -","- C72 H116 Cl8 Cu4 N20 O34 -","4","1","","Elena V. Rybak-Akimova; Alexander Y. Nazarenko; Svetlana S. Silchenko","Unusual Ligand Isomerization Dictated by Coordination Requirements of the Metal Ion: A Double-Bond Shift in Cu(II)-Assisted Template Condensation between Diacetylpyridine and a Tripodal Tetramine","Inorganic Chemistry","1999","38","","2974","2980","10.1021/ic990027n","","","0.71073","MoKα","","0.0915","0.0602","","","0.1539","0.1764","","","","","","1.011","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322086","8.29","0.002","12.65","0.003","15.69","0.003","90","","99.22","0.03","90","","1624.1","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C9 H28 Cl2 N4 O2 Zn -","- C9 H28 Cl2 N4 O2 Zn -","- C36 H112 Cl8 N16 O8 Zn4 -","4","1","","Elena V. Rybak-Akimova; Alexander Y. Nazarenko; Svetlana S. Silchenko","Unusual Ligand Isomerization Dictated by Coordination Requirements of the Metal Ion: A Double-Bond Shift in Cu(II)-Assisted Template Condensation between Diacetylpyridine and a Tripodal Tetramine","Inorganic Chemistry","1999","38","","2974","2980","10.1021/ic990027n","","","0.71069","MoKα","","0.1073","0.0505","","","0.0999","0.1201","","","","","","0.997","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322087","18.2688","0.0008","7.0112","0.0004","22.6479","0.001","90","","90","","90","","2900.9","0.2","196","","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C18 H42 Cl4 Li4 N6 -","- C18 H42 Cl4 Li4 N6 -","- C72 H168 Cl16 Li16 N24 -","4","1","","Alexander Jockisch; Hubert Schmidbaur","An ""Open Cube"" Lithium Chloride Tetramer Containing Azetidine Ligands","Inorganic Chemistry","1999","38","","3014","3016","10.1021/ic9900307","","","0.71073","MoKα","","0.0548","0.0409","","0.1122","0.1015","","","","1.046","1.056","1.056","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322088","14.735","0.002","14.976","0.002","24.066","0.003","76.94","0.01","76.19","0.01","62.11","0.01","4517.5","1.1","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H132 Cl4 Si16 Sn4 -","- C44.5 H108 Cl4 Si16 Sn4 -","- C89 H216 Cl8 Si32 Sn8 -","2","1","","S. P. Mallela; Yochen Saar; Sven Hill; R. A. Geanangel","Reactions of LiE(SiMe3)3, E = Si, Ge: X-ray Crystal Structure of the Cyclotetrastannane [ClSnSi(SiMe3)3]4","Inorganic Chemistry","1999","38","","2957","2960","10.1021/ic9900455","","","0.71073","MoKα","","0.0373","0.0269","","","0.0739","0.0812","","","","","","1.059","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322089","17.996","0.005","13.44","0.003","19.689","0.006","90","","110.41","0.03","90","","4463","2","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C40 H44 B9 Cl2 Cu O P2 Ru -","- C40 H44 B9 Cl2 Cu O P2 Ru -","- C160 H176 B36 Cl8 Cu4 O4 P8 Ru4 -","4","1","","Dianne D. Ellis; Samantha M. Couchman; John C. Jeffery; John M. Malget; F. Gordon A. Stone","The Reagent [K(18-crown-6)][RuH(PPh3)2(η5-7,8-C2B9H11)] as a Precursor to New Ruthenacarborane Complexes","Inorganic Chemistry","1999","38","","2981","2988","10.1021/ic990057q","","","0.71073","MoKα","","0.1081","0.0622","","0.1354","0.1203","","","","1.136","1.284","1.284","","","","","has coordinates,has disorder","179323","2020-10-21","18:00:00",""
"4322090","10.3868","0.001","15.789","0.002","22.848","0.003","90","","91.633","0.012","90","","3745.5","0.8","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H41 B9 O P2 Ru -","- C39 H41 B9 O P2 Ru -","- C156 H164 B36 O4 P8 Ru4 -","4","1","","Dianne D. Ellis; Samantha M. Couchman; John C. Jeffery; John M. Malget; F. Gordon A. Stone","The Reagent [K(18-crown-6)][RuH(PPh3)2(η5-7,8-C2B9H11)] as a Precursor to New Ruthenacarborane Complexes","Inorganic Chemistry","1999","38","","2981","2988","10.1021/ic990057q","","","0.71073","MoKα","","0.07","0.0367","","0.0952","0.0681","","","","0.982","1.033","1.033","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322091","10.9437","0.0014","17.901","0.004","23.818","0.003","90","","90.737","0.011","90","","4665.6","1.3","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C43 H43 B9 Cl2 O4 P2 Ru2 -","- C43 H43 B9 Cl2 O4 P2 Ru2 -","- C172 H172 B36 Cl8 O16 P8 Ru8 -","4","1","","Dianne D. Ellis; Samantha M. Couchman; John C. Jeffery; John M. Malget; F. Gordon A. Stone","The Reagent [K(18-crown-6)][RuH(PPh3)2(η5-7,8-C2B9H11)] as a Precursor to New Ruthenacarborane Complexes","Inorganic Chemistry","1999","38","","2981","2988","10.1021/ic990057q","","","0.71073","MoKα","","0.0466","0.0289","","0.0668","0.0613","","","","0.975","1.028","1.028","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322092","12.7415","0.001","33.576","0.003","14.0383","0.0013","90","","96.628","0.008","90","","5965.6","0.9","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C59 H65 B9 Cl4 Cu O P3 Ru -","- C59 H61 B9 Cl4 Cu O P3 Ru -","- C236 H244 B36 Cl16 Cu4 O4 P12 Ru4 -","4","1","","Dianne D. Ellis; Samantha M. Couchman; John C. Jeffery; John M. Malget; F. Gordon A. Stone","The Reagent [K(18-crown-6)][RuH(PPh3)2(η5-7,8-C2B9H11)] as a Precursor to New Ruthenacarborane Complexes","Inorganic Chemistry","1999","38","","2981","2988","10.1021/ic990057q","","","0.71073","MoKα","","0.0672","0.0428","","0.0972","0.0876","","","","1.025","1.073","1.073","","","","","has coordinates,has disorder","179323","2020-10-21","18:00:00",""
"4322093","18.13","0.004","18.033","0.002","18.347","0.003","90","","93.21","0.02","90","","5988.9","1.8","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C58 H61 Au B9 Cl4 P3 Ru -","- C58 H61 Au B9 Cl4 P3 Ru -","- C232 H244 Au4 B36 Cl16 P12 Ru4 -","4","1","","Dianne D. Ellis; Samantha M. Couchman; John C. Jeffery; John M. Malget; F. Gordon A. Stone","The Reagent [K(18-crown-6)][RuH(PPh3)2(η5-7,8-C2B9H11)] as a Precursor to New Ruthenacarborane Complexes","Inorganic Chemistry","1999","38","","2981","2988","10.1021/ic990057q","","","0.71073","MoKα","","0.0806","0.0456","","0.0992","0.0884","","","","1.096","1.184","1.184","","","","","has coordinates,has disorder","179323","2020-10-21","18:00:00",""
"4322094","8.41","0.001","11.029","0.001","10.993","0.001","90","","111.13","0.01","90","","951.09","0.18","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- Hf5.95 Sb4 Ti1.05 -","- Hf5.947 Sb4 Ti1.053 -","- Hf23.788 Sb16 Ti4.212 -","4","1","","Holger Kleinke","Sb-Sb Interactions in the Hafnium-Rich Antimonide Hf6TiSb4","Inorganic Chemistry","1999","38","","2931","2935","10.1021/ic990138m","","","0.71073","MoKα","","0.1034","0.0382","","0.0788","0.0706","","","","0.6","0.847","0.847","","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322095","21.089","0.003","12.962","0.002","27.353","0.003","90","0.012","93.365","0.01","90","0.012","7464.2","1.8","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","tetrakis(thf)calcium bis(2,5-diphenyl-3,4-bis(trimethylsilyl)phosphacyclopentadienide","","- C74 H104 Ca O4 P2 Si4 -","- C74 H104 Ca O4 P2 Si4 -","- C296 H416 Ca4 O16 P8 Si16 -","4","0.5","","Matthias Westerhausen; Matthias H. Digeser; Heinrich Nöth; Werner Ponikwar; Thomas Seifert; Kurt Polborn","2,5-Diphenyl-3,4-bis(trimethylsilyl)-1-phosphacyclopentadienide as a Ligand at Calcium, Strontium, and Tin(II)","Inorganic Chemistry","1999","38","","3207","3214","10.1021/ic981132k","","","0.71073","MoKα","","0.074","0.0521","","0.1381","0.1227","","","","1.075","1.106","1.106","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322096","21.0471","0.001","12.9643","0.0006","27.1778","0.0012","90","","93.189","0.001","90","","7404.3","0.6","293","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","tetrakis(thf)strontiumi bis(2,5-diphenyl-3,4-bis(trimethylsilyl)phosphacyclopentadienide","","- C74 H104 O4 P2 Si4 Sr -","- C74 H104 O4 P2 Si4 Sr -","- C296 H416 O16 P8 Si16 Sr4 -","4","0.5","","Matthias Westerhausen; Matthias H. Digeser; Heinrich Nöth; Werner Ponikwar; Thomas Seifert; Kurt Polborn","2,5-Diphenyl-3,4-bis(trimethylsilyl)-1-phosphacyclopentadienide as a Ligand at Calcium, Strontium, and Tin(II)","Inorganic Chemistry","1999","38","","3207","3214","10.1021/ic981132k","","","0.71073","MoKα","","0.0544","0.0426","","0.0954","0.0894","","","","1.09","1.115","1.115","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322097","12.5325","0.0004","13.1258","0.0004","14.8161","0.0005","87.667","0.001","79.438","0.001","72.684","0.001","2287.1","0.13","293","2","173","2","","","","","","","","5","P -1","-P 1","2","","Bis(2,5-diphenyl-3,4-bis(trimethylsilyl)phosphacyclopentadienyl Tin(II)","","- C44 H56 P2 Si4 Sn -","- C44 H56 P2 Si4 Sn -","- C88 H112 P4 Si8 Sn2 -","2","1","","Matthias Westerhausen; Matthias H. Digeser; Heinrich Nöth; Werner Ponikwar; Thomas Seifert; Kurt Polborn","2,5-Diphenyl-3,4-bis(trimethylsilyl)-1-phosphacyclopentadienide as a Ligand at Calcium, Strontium, and Tin(II)","Inorganic Chemistry","1999","38","","3207","3214","10.1021/ic981132k","","","0.71073","MoKα","","0.04","0.0304","","0.0692","0.0649","","","","1.092","1.11","1.11","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322098","20.856","0.004","13.523","0.003","13.203","0.003","90","","90","","90","","3723.7","1.4","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","[Ru(bpy)(CO)3Cl]+[Cl]-.(H5O2)+(Cl)-","","","- C13 H13 Cl3 N2 O5 Ru -","- C13 H13 Cl3 N2 O5 Ru -","- C104 H104 Cl24 N16 O40 Ru8 -","8","1","","Matti Haukka; Pipsa Hirva; Saija Luukkanen; Mirja Kallinen; Markku Ahlgrén; Tapani A. Pakkanen","Reactions of Ruthenium Bipyridine Catalyst Precursors: Synthetic, Structural, and Theoretical Studies on Ruthenium Mono(bipyridine) Carbonyls in Ethylene Glycol Solutions","Inorganic Chemistry","1999","38","","3182","3189","10.1021/ic981266y","","","0.71073","MoKα","","0.0251","0.0203","","","0.0498","0.0505","","","","","","0.934","","","","has coordinates","179323","2020-10-21","18:00:00",""
"4322099","27.889","0.003","10.27","0.002","26.563","0.002","90","","112.01","0.03","90","","7054","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","Ru(bpy)(CO)2Cl(C(O)OCH2CH2OH).1/4(HOCH2CH2OH)","","","- C15.5 H14.5 Cl N2 O5.5 Ru -","- C15.5 H13 Cl N2 O5.495 Ru -","- C248 H208 Cl16 N32 O87.92 Ru16 -","16","2","","Matti Haukka; Pipsa Hirva; Saija Luukkanen; Mirja Kallinen; Markku Ahlgrén; Tapani A. Pakkanen","Reactions of Ruthenium Bipyridine Catalyst Precursors: Synthetic, Structural, and Theoretical Studies on Ruthenium Mono(bipyridine) Carbonyls in Ethylene Glycol Solutions","Inorganic Chemistry","1999","38","","3182","3189","10.1021/ic981266y","","","0.71073","MoKα","","0.056","0.0275","","","0.0464","0.0489","","","","","","0.773","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322100","6.3871","0.001","8.132","0.002","12.693","0.003","89.2","0.03","81.37","0.03","81.2","0.03","644.1","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","Ru(bpy)(CO)2ClH","","","- C12 H9 Cl N2 O2 Ru -","- C12 H9 Cl N2 O2 Ru -","- C24 H18 Cl2 N4 O4 Ru2 -","2","1","","Matti Haukka; Pipsa Hirva; Saija Luukkanen; Mirja Kallinen; Markku Ahlgrén; Tapani A. Pakkanen","Reactions of Ruthenium Bipyridine Catalyst Precursors: Synthetic, Structural, and Theoretical Studies on Ruthenium Mono(bipyridine) Carbonyls in Ethylene Glycol Solutions","Inorganic Chemistry","1999","38","","3182","3189","10.1021/ic981266y","","","0.71073","MoKα","","0.0355","0.0257","","","0.0556","0.0598","","","","","","1.074","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322101","10.853","0.003","12.746","0.003","17.907","0.005","98.09","0.02","89.99","0.02","96.34","0.02","2437.2","1.1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H54 Ce N11 O14 -","- C40 H51 Ce N11 O14 -","- C80 H102 Ce2 N22 O28 -","2","1","","C. Platas; F. Avecilla; A. de Blas; C. F. G. C. Geraldes; T. Rodríguez-Blas; H. Adams; J. Mahía","1H NMR in Solution and Solid State Structural Study of Lanthanide(III) Cryptates","Inorganic Chemistry","1999","38","","3190","3199","10.1021/ic981314e","","","0.71073","MoKα","","0.0645","0.0521","","","0.1429","0.1511","","","","","","1.082","","","","has coordinates,has disorder","179324","2020-10-21","18:00:00",""
"4322102","10.896","0.002","12.566","0.004","17.688","0.003","81.23","0.02","89.5","0.01","84.72","0.03","2383.3","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H56 N11 Nd O14 -","- C41 H56 N11 Nd O14 -","- C82 H112 N22 Nd2 O28 -","2","1","","C. Platas; F. Avecilla; A. de Blas; C. F. G. C. Geraldes; T. Rodríguez-Blas; H. Adams; J. Mahía","1H NMR in Solution and Solid State Structural Study of Lanthanide(III) Cryptates","Inorganic Chemistry","1999","38","","3190","3199","10.1021/ic981314e","","","0.71073","MoKα","","0.0578","0.0519","","","0.148","0.1532","","","","","","1.12","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322103","10.896","0.002","12.566","0.004","17.688","0.003","81.23","0.02","89.5","0.01","84.72","0.03","2383.3","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H54 Eu N11 O14 -","- C40 H54 Eu N11 O14 -","- C80 H108 Eu2 N22 O28 -","2","1","","C. Platas; F. Avecilla; A. de Blas; C. F. G. C. Geraldes; T. Rodríguez-Blas; H. Adams; J. Mahía","1H NMR in Solution and Solid State Structural Study of Lanthanide(III) Cryptates","Inorganic Chemistry","1999","38","","3190","3199","10.1021/ic981314e","","","0.71073","MoKα","","0.0624","0.0566","","","0.1528","0.1587","","","","","","1.017","","","","has coordinates,has disorder","301838","2025-08-20","22:17:36",""
"4322104","12.723","0.002","14.047","0.003","16.943","0.003","66.07","0.02","79.838","0.012","81.616","0.014","2715.1","1","570","2","570","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H45 N15 O25 Y2 -","- C45 H45 N15 O25 Y2 -","- C90 H90 N30 O50 Y4 -","2","1","","C. Platas; F. Avecilla; A. de Blas; C. F. G. C. Geraldes; T. Rodríguez-Blas; H. Adams; J. Mahía","1H NMR in Solution and Solid State Structural Study of Lanthanide(III) Cryptates","Inorganic Chemistry","1999","38","","3190","3199","10.1021/ic981314e","","","0.71073","MoKα","","0.1184","0.089","","0.2618","0.2333","","","","1.047","1.065","1.065","","","","","has coordinates,has disorder","179324","2020-10-21","18:00:00",""
"4322105","12.074","0.002","12.22","0.002","15.434","0.003","80.89","0.03","88.36","0.03","79.76","0.03","2212.7","0.7","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C42.78 H39 Cl0.22 F6 Fe N3.78 P2 Pt Sb -","- C42.82 H39 Cl0.18 F6 Fe N3.82 P2 Pt Sb -","- C85.64 H78 Cl0.36 F12 Fe2 N7.64 P4 Pt2 Sb2 -","2","1","","Guy N. Richardson; Udo Brand; Heinrich Vahrenkamp","Linear and Bent M(μ-CN)Pt(μ-CN)M Chains: Probes for Remote Metal-Metal Interactions","Inorganic Chemistry","1999","38","","3070","3079","10.1021/ic981384l","","","0.71073","MoKα","","0.0876","0.0569","","","0.143","0.1624","","","","","","1.078","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322106","13.047","0.003","15.018","0.003","21.66","0.004","90","","101.77","0.03","90","","4154.8","1.5","293","2","293","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","monoironcyanide-bipy-platinum-chloride","cyclopentadienydiphenylphospineetheneiron cyanide-2,2'-dipyridylmonochloroplatinum-hexafluroantimonate","","- C42 H37 Cl F6 Fe N3 P2 Pt Sb -","- C42 H37 Cl F6 Fe N3 P2 Pt Sb -","- C168 H148 Cl4 F24 Fe4 N12 P8 Pt4 Sb4 -","4","1","","Guy N. Richardson; Udo Brand; Heinrich Vahrenkamp","Linear and Bent M(μ-CN)Pt(μ-CN)M Chains: Probes for Remote Metal-Metal Interactions","Inorganic Chemistry","1999","38","","3070","3079","10.1021/ic981384l","","","0.71073","MoKα","","0.0717","0.0324","","","0.073","0.0865","","","","","","1.032","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322107","11.846","0.002","11.918","0.002","15.13","0.003","95.03","0.03","91.25","0.03","94.73","0.03","2119.7","0.7","293","2","293","2","","","","","","","","9","P -1","-P 1","2","trans-diironcyanide-platinum(II)di-pyridine","","","- C86 H92 F12 Fe2 N4 O4 P4 Pt Sb2 -","- C86 H92 F12 Fe2 N4 O4 P4 Pt Sb2 -","- C86 H92 F12 Fe2 N4 O4 P4 Pt Sb2 -","1","0.5","","Guy N. Richardson; Udo Brand; Heinrich Vahrenkamp","Linear and Bent M(μ-CN)Pt(μ-CN)M Chains: Probes for Remote Metal-Metal Interactions","Inorganic Chemistry","1999","38","","3070","3079","10.1021/ic981384l","","","0.71073","MoKα","","0.0405","0.0402","","","0.1102","0.1108","","","","","","1.107","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322108","14.796","0.003","18.158","0.004","32.363","0.006","88.43","0.03","84.34","0.03","72.83","0.03","8267","3","223","2","293","2","","","","","","","","10","P -1","-P 1","2","","","","- C74.5 H68 Cl0.275 F10.35 Fe2 N4 O0.5 P4 Pt Sb1.725 -","- C74.5 H68 Cl0.275 F10.35 Fe2 N4 O0.5 P4 Pt Sb1.725 -","- C298 H272 Cl1.1 F41.4 Fe8 N16 O2 P16 Pt4 Sb6.9 -","4","2","","Guy N. Richardson; Udo Brand; Heinrich Vahrenkamp","Linear and Bent M(μ-CN)Pt(μ-CN)M Chains: Probes for Remote Metal-Metal Interactions","Inorganic Chemistry","1999","38","","3070","3079","10.1021/ic981384l","","","0.71069","MoKα","","0.1308","0.0984","","","0.2588","0.2855","","","","","","1.002","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322109","31.215","0.006","11.384","0.002","25.738","0.005","90","","123.09","0.03","90","","7663","4","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C74 H68 F12 Fe2 N4 P4 Pt Sb2 -","- C74 H68 F12 Fe2 N4 P4 Pt Sb2 -","- C296 H272 F48 Fe8 N16 P16 Pt4 Sb8 -","4","0.5","","Guy N. Richardson; Udo Brand; Heinrich Vahrenkamp","Linear and Bent M(μ-CN)Pt(μ-CN)M Chains: Probes for Remote Metal-Metal Interactions","Inorganic Chemistry","1999","38","","3070","3079","10.1021/ic981384l","","","0.71073","MoKα","","0.1082","0.0408","","","0.0851","0.1061","","","","","","1.039","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322110","32.12","0.006","32.12","0.006","14.46","0.003","90","","90","","120","","12920","4","293","2","293","2","","","","","","","","8","P 61","P 61","169","","cis-[{Cp(dppe)Fe-NC-}2Pt(bipy)](SbF6)2","","- C74 H66 F12 Fe2 N4 P4 Pt Sb2 -","- C74 H66 F12 Fe2 N4 P4 Pt Sb2 -","- C444 H396 F72 Fe12 N24 P24 Pt6 Sb12 -","6","1","","Guy N. Richardson; Udo Brand; Heinrich Vahrenkamp","Linear and Bent M(μ-CN)Pt(μ-CN)M Chains: Probes for Remote Metal-Metal Interactions","Inorganic Chemistry","1999","38","","3070","3079","10.1021/ic981384l","","","0.71073","MoKα","","0.0989","0.0635","","","0.1395","0.1575","","","","","","1.058","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322111","13.399","0.003","14.598","0.003","15.895","0.003","90","","101.15","0.03","90","","3050.4","1.1","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C67 H60 Cl2 Fe2 N4 P4 Pt -","- C67 H60 Cl2 Fe2 N4 P4 Pt -","- C134 H120 Cl4 Fe4 N8 P8 Pt2 -","2","0.5","","Guy N. Richardson; Udo Brand; Heinrich Vahrenkamp","Linear and Bent M(μ-CN)Pt(μ-CN)M Chains: Probes for Remote Metal-Metal Interactions","Inorganic Chemistry","1999","38","","3070","3079","10.1021/ic981384l","","","0.71073","MoKα","","0.0918","0.0391","","","0.0875","0.1057","","","","","","1.065","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322112","26.991","0.006","4.0093","0.0008","31.169","0.006","90","","104.95","0.013","90","","3258.8","1.2","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","[dicarbonyl(3[(4'-((4''-n-decyloxybenzoyl)oxy)phenoxy)carbonil]- 2,4-pentane-dionate)iridium(I)] methanol solvate","","- C32 H39 Ir O10 -","- C33 H35 Ir O9 -","- C132 H140 Ir4 O36 -","4","1","","Joaquín Barberá; Anabel Elduque; Raquel Giménez; Fernando J. Lahoz; José A. López; Luis A. Oro; José Luis Serrano; Belén Villacampa; Julio Villalba","Rhodium(I) and Iridium(I) Complexes Containing β-Diketonate or Pyrazole Ligands. Liquid Crystal and Nonlinear Optical Properties","Inorganic Chemistry","1999","38","","3085","3092","10.1021/ic9814017","","","0.71073","MoKα","","0.1039","0.0583","","","0.132","0.1566","","","","","","1.04","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322113","8.552","0.002","9.254","0.002","11.625","0.002","87.81","0.02","85.74","0.02","66.93","0.02","844","0.3","293","2","297","2","","","","","","","synthesis","5","P -1","-P 1","2","","bis(histamine)copper(II) thiocyanate","","- C12 H18 Cu N8 S2 -","- C12 H18 Cu N8 S2 -","- C24 H36 Cu2 N16 S4 -","2","1","","Fred B. Stocker; Paul Fadden; Spencer Dreher; Doyle Britton","Copper(II) Complexes of Histamine and Cysteine Produced by Thiosulfate-Assisted Synthesis Using Copper(I) Cyanide. The in Situ Formation of the Thiocyanate Anion and the 2-Amino-2-thiazoline-4-carboxylic Acid Ligand","Inorganic Chemistry","1999","38","","3251","3253","10.1021/ic9814118","","","0.71073","MoKα","","0.064","0.0434","","0.1112","0.1006","","","","1.033","1.08","1.08","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322114","7.9578","0.0002","8.1505","0.0002","19.5206","0.0006","90","","90","","90","","1266.11","0.06","173","2","173","2","","","","","","","synthesis","6","P 21 21 21","P 2ac 2ab","19","","copper(II)(2-amino-1,3-thiazoline-4-carboxylate) monohydrate'","","- C8 H12 Cu N4 O5 S2 -","- C8 H12 Cu N4 O5 S2 -","- C32 H48 Cu4 N16 O20 S8 -","4","1","","Fred B. Stocker; Paul Fadden; Spencer Dreher; Doyle Britton","Copper(II) Complexes of Histamine and Cysteine Produced by Thiosulfate-Assisted Synthesis Using Copper(I) Cyanide. The in Situ Formation of the Thiocyanate Anion and the 2-Amino-2-thiazoline-4-carboxylic Acid Ligand","Inorganic Chemistry","1999","38","","3251","3253","10.1021/ic9814118","","","0.71073","MoKα","","0.021","0.0201","","0.0488","0.0485","","","","1.09","1.096","1.096","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322115","10.311","0.006","19.045","0.005","19.611","0.006","108.5","0.02","96.53","0.05","103.23","0.04","3482","3","244","2","244","2","","","","","","","","6","P -1","-P 1","2","","","","- C63 H56 B2 Cd F24 N12 -","- C63 H56 B2 Cd F24 N12 -","- C126 H112 B4 Cd2 F48 N24 -","2","1","","Daniel L. Reger; James E. Collins; Arnold L. Rheingold; Louise M. Liable-Sands","Solid State Structure of {[HC(3,5-Me2pz)3][HB(3,5-Me2pz)3]Cd}{B[3,5-(CF3)2C6H3]4}: Comparison of the Bonding of Tris(pyrazolyl)methane and Tris(pyrazolyl)borate Ligands","Inorganic Chemistry","1999","38","","3235","3237","10.1021/ic981453w","","","0.71073","MoKα","","0.0953","0.0601","","0.1345","0.1273","","","","1.251","1.557","1.557","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322116","11.427","0.002","12.882","0.002","14.692","0.002","99.098","0.014","108.339","0.012","113.11","0.02","1787.2","0.7","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H39 O2 P2 Pt Rh -","- C38 H39 O2 P2 Pt Rh -","- C76 H78 O4 P4 Pt2 Rh2 -","2","1","","Larry R. Falvello; Juan Forniés; Antonio Martín; Julio Gómez; Elena Lalinde; M. Teresa Moreno; Jorge Sacristán","Synthesis of Heterobridged (μ-C\τbCR)(μ-X) (X = PPh2, PPh2O) Platinum-Rhodium or Platinum-Iridium Dimers","Inorganic Chemistry","1999","38","","3116","3125","10.1021/ic9900049","","","0.71073","MoKα","","0.0458","0.032","","0.0708","0.0661","","","","1.021","1.025","1.025","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322117","47.744","0.009","9.09","0.002","15.571","0.002","90","","93.77","0.013","90","","6743","2","153","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","5,10,15-tris(p-methoxyphenyl)porphyrin Zn^II^","","","- C41.4 H30.8 Cl0.8 N4 O3 Zn -","- C41 H30 Cl0.8 N4 O3 Zn -","- C328 H240 Cl6.4 N32 O24 Zn8 -","8","1","","Jacek Wojaczyński; Lechosław Latos-Grażyński; Piotr J. Chmielewski; Pamela Van Calcar; Alan L. Balch","1H NMR Investigations of Triphenylporphyrin Metal Complexes and Electronic Interactions in Iron(III) Complexes of meso-meso-Linked 5,5'-Bis(10,15,20-triphenylporphyrin)","Inorganic Chemistry","1999","38","","3040","3050","10.1021/ic990038g","","","1.54178","CuKα","","0.1003","0.0756","","0.253","0.2169","","","","1.062","1.143","1.143","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322118","5.937","0.001","8.228","0.002","12.47","0.002","80.36","0.03","80.8","0.03","80.54","0.03","586.9","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C6 H15 N5 O6 Pt0.5 -","- C6 H13 N5 O6 Pt0.5 -","- C12 H26 N10 O12 Pt -","2","1","","Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert","A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2)","Inorganic Chemistry","1999","38","","3160","3166","10.1021/ic990044c","","","0.71069","MoKα","","0.0235","0.0232","","0.0565","0.0546","","","","1.055","1.055","1.055","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322119","7.392","0.001","9.072","0.002","10.047","0.002","112.4","0.03","106.07","0.03","94.66","0.03","585.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C6 H12 Cl N4 O5 Pt0.5 -","- C6 H12 Cl N4 O5 Pt0.5 -","- C12 H24 Cl2 N8 O10 Pt -","2","1","","Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert","A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2)","Inorganic Chemistry","1999","38","","3160","3166","10.1021/ic990044c","","","0.71069","MoKα","","0.0371","0.0297","","0.0871","0.06","","","","1.022","1.067","1.067","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322120","7.104","0.001","7.549","0.002","9.209","0.002","87.74","0.03","88.04","0.03","85.92","0.03","491.98","0.18","136","2","136","2","","","","","","","","5","P -1","-P 1","2","trans-[Pt(NH2CH3)2(1-MeC-N4)2] * 4 H2O","","","- C6 H15 N4 O3 Pt0.5 -","- C6 H15 N4 O3 Pt0.5 -","- C12 H30 N8 O6 Pt -","2","1","","Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert","A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2)","Inorganic Chemistry","1999","38","","3160","3166","10.1021/ic990044c","","","0.71069","MoKα","","0.0199","0.0199","","","0.0465","0.0465","","","","","","1.031","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322121","7.045","0.001","7.421","0.001","9.966","0.002","109.25","0.03","99.22","0.03","95.02","0.03","480.01","0.18","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C7 H15 N4 O2 Pt0.5 -","- C7 H15 N4 O2 Pt0.5 -","- C14 H30 N8 O4 Pt -","2","1","","Jens Müller; Frank Glahé,; Eva Freisinger; Bernhard Lippert","A Major, pH-Induced Stereochemical Switch of Pairs of trans-Oriented Ligands in Complexes of trans-a2PtII (a = NH3, CH3NH2)","Inorganic Chemistry","1999","38","","3160","3166","10.1021/ic990044c","","","0.71069","MoKα","","0.0256","0.0254","","","0.0499","0.0499","","","","","","1.038","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322122","11.705","0.008","19.527","0.008","20.67","0.009","90","","98.14","0.04","90","","4677","4","293","","","","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C54 H82 Mo6 N6 O20 P4 Pb2 S14 -","- C54 H82 Mo6 N6 O20 P4 Pb2 S14 -","- C108 H164 Mo12 N12 O40 P8 Pb4 S28 -","2","0.5","","Rong-Min Yu; Shao-Fang Lu; Xiao-Ying Huang; Qiang-Jin Wu; Jian-Quan Huang","Synthesis and Structural Characterization of an Unusual Oxygen-Linked Double Cubane-Like Cluster {[Mo3PbOS3](OAc)2(py)3(dtp)2O}2","Inorganic Chemistry","1999","38","","3313","3315","10.1021/ic9703890","","","0.71073","MoKα","","","0.0564","","","0.0682","","","","","0.86","0.86","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322123","13.146","0.007","15.142","0.005","25.631","0.009","90","","90","","90","","5102","4","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H32 N O11 V -","- C21 H32 N O11 V -","- C168 H256 N8 O88 V8 -","8","2","","Kajal Krishna Rajak; Sankar Prasad Rath; Sujit Mondal; Animesh Chakravorty","Carbohydrate Binding to VO3+. Sugar Vanadate Esters Incorporating l-Amino Acid Schiff Bases as Coligands","Inorganic Chemistry","1999","38","","3283","3289","10.1021/ic981344h","","","0.71073","MoKα","","0.1589","0.0806","","0.2522","0.1681","","","","1.024","1.011","1.011","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322124","13.645","0.004","7.022","0.002","15.5","0.004","90","","113.98","0.02","90","","1356.9","0.7","295","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H32 N O11 V -","- C25 H32 N O11 V -","- C50 H64 N2 O22 V2 -","2","1","","Kajal Krishna Rajak; Sankar Prasad Rath; Sujit Mondal; Animesh Chakravorty","Carbohydrate Binding to VO3+. Sugar Vanadate Esters Incorporating l-Amino Acid Schiff Bases as Coligands","Inorganic Chemistry","1999","38","","3283","3289","10.1021/ic981344h","","","0.71073","MoKα","","0.0962","0.063","","0.1891","0.1375","","","","1.03","1.079","1.079","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322125","14.275","0.003","19.721","0.004","10.416","0.002","90","","90","","90","","2932.3","1","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C12 H26 Hg2 I7 N8 -","- C12 H26 Hg2.01 I7 N8 -","- C48 H104 Hg8.04 I28 N32 -","4","0.5","","Per H. Svensson; Lars Kloo","Metal Iodides in Polyiodide Networks: Synthesis and Structure of Binary Metal Iodide-Iodine Compounds Stable under Ambient Conditions","Inorganic Chemistry","1999","38","","3390","3393","10.1021/ic981348m","","","0.71073","MoKα","","0.0463","0.0357","","0.0813","0.0775","","","","1.069","1.131","1.131","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322126","8.7246","0.0004","9.786","0.0003","11.1103","0.0004","90","","90","","90","","948.59","0.06","293","2","293","2","","","","","","","","5","A m a 2","A 2 -2a","40","","","","- H6 Hg I3 N O -","- Hg I3 N O -","- Hg4 I12 N4 O4 -","4","0.5","","Per H. Svensson; Lars Kloo","Metal Iodides in Polyiodide Networks: Synthesis and Structure of Binary Metal Iodide-Iodine Compounds Stable under Ambient Conditions","Inorganic Chemistry","1999","38","","3390","3393","10.1021/ic981348m","","","0.71073","MoKα","","0.043","0.0397","","0.0914","0.0902","","","","1.087","1.114","1.114","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322127","9.525","0.005","9.071","0.004","22.841","0.011","90","","95.75","0.04","90","","1963.6","1.7","203","2","203","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C42 H46 Fe2 N4 S4 -","- C42 H46 Fe2 N4 S4 -","- C84 H92 Fe4 N8 S8 -","2","0.5","","Peter Comba; Jürgen Ensling; Philipp Gütlich; Andreas Kühner; Alexander Peters; Hans Pritzkow","Bis-macrocyclic Ligands with Two Ferrocenyl End Groups, and Their Tetranuclear Dicopper(I) Compounds","Inorganic Chemistry","1999","38","","3316","3320","10.1021/ic981389i","","","0.7107","MoKα","","0.1103","0.0497","","","0.0992","0.1163","","","","","","1.012","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322128","10.173","0.004","13.758","0.006","16.102","0.003","90","","92.86","0.02","90","","2250.8","1.4","188","2","188","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Chromium(VI) dioxo-bis(tert-butyl, 2,5-fluoro-methyl-anilide)","","- C22 H30 Cr F2 N2 O2 -","- C22 H30 Cr F2 N2 O2 -","- C88 H120 Cr4 F8 N8 O8 -","4","1","","Aaron L. Odom; Daniel J. Mindiola; Christopher C. Cummins","A Nucleophilic Chromium(V) Dioxo Radical Anion","Inorganic Chemistry","1999","38","","3290","3295","10.1021/ic981403r","","","0.71073","MoKα","","0.0509","0.0451","","0.0978","0.0948","","","","1.212","1.226","1.226","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322129","9.6227","0.0009","10.3127","0.001","19.649","0.002","80.855","0.002","81.889","0.002","72.625","0.002","1828.2","0.3","133","2","133","2","","","","","","","","7","P -1","-P 1","2","","Chromium(V)mon-oxo-bis(tert-butyl, 2,5-fluoro-methyl-anilide)triphenylsiloxide.","","- C40 H45 Cr F2 N2 O2 Si -","- C40 H36 Cr F2 N2 O2 Si -","- C80 H72 Cr2 F4 N4 O4 Si2 -","2","1","","Aaron L. Odom; Daniel J. Mindiola; Christopher C. Cummins","A Nucleophilic Chromium(V) Dioxo Radical Anion","Inorganic Chemistry","1999","38","","3290","3295","10.1021/ic981403r","","","0.71073","MoKα","","0.1123","0.0887","","0.195","0.1745","","","","1.171","1.218","1.218","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322130","10.9","0.001","10.9","0.001","10.997","0.001","90","","90","","90","","1306.6","0.2","173","2","173","2","","","","","","","","5","P 41","P 4w","76","","bis-triflouroacetato-tricarbonyl-aquo-ruthenium(II)","","- C7 H2 F6 O8 Ru -","- C7 H2 F6 O8 Ru -","- C28 H8 F24 O32 Ru4 -","4","1","","Tiziana Funaioli; Claudia Cavazza; Fabio Marchetti; Giuseppe Fachinetti","Aqueous Organometallic Chemistry of Ruthenium(II). Aquo Carbonyl Derivatives and Related Ethene Hydrocarboxylation in Fully Aqueous Solvent","Inorganic Chemistry","1999","38","","3361","3368","10.1021/ic981429i","","","0.71073","MoKα","","0.0458","0.0424","","0.1156","0.1127","","","","1.033","1.051","1.051","","","","","has coordinates,has disorder","179324","2020-10-21","18:00:00",""
"4322131","7.5675","0.0011","7.5675","0.0011","34.703","0.005","90","","90","","120","","1721.1","0.4","173","2","173","2","","","","","","","","6","R 3 :H","R 3","146","","Tris-aquo-tricarbonyl-ruthenium(II) di-tetrafluoborate","","- C3 H6 B2 F8 O6 Ru -","- C3 H6 B2 F8 O6 Ru -","- C18 H36 B12 F48 O36 Ru6 -","6","0.666667","","Tiziana Funaioli; Claudia Cavazza; Fabio Marchetti; Giuseppe Fachinetti","Aqueous Organometallic Chemistry of Ruthenium(II). Aquo Carbonyl Derivatives and Related Ethene Hydrocarboxylation in Fully Aqueous Solvent","Inorganic Chemistry","1999","38","","3361","3368","10.1021/ic981429i","","","0.71073","MoKα","","0.0203","0.0193","","","0.0483","0.0491","","","","","","1.191","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322132","9.394","0.001","15.679","0.003","8.086","0.001","90","","95.25","0.01","90","","1186","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Bis-ethyl-tetracarbonyl-tetraaquo-diruthenium(II) bis-trifluoromethanesulfonate","","- C10 H18 F6 O14 Ru2 S2 -","- C10 H18 F6 O14 Ru2 S2 -","- C20 H36 F12 O28 Ru4 S4 -","2","0.5","","Tiziana Funaioli; Claudia Cavazza; Fabio Marchetti; Giuseppe Fachinetti","Aqueous Organometallic Chemistry of Ruthenium(II). Aquo Carbonyl Derivatives and Related Ethene Hydrocarboxylation in Fully Aqueous Solvent","Inorganic Chemistry","1999","38","","3361","3368","10.1021/ic981429i","","","0.71073","MoKα","","0.0529","0.0385","","","0.0913","0.0992","","","","","","1.053","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322133","12.878","0.002","11.561","0.002","13.058","0.003","90","","90.54","0.01","90","","1944","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Tetra-μ-propionyl-di-μ3-hydroxo-octacarbonyl-bis-trifluoroacetato-tetrarut henium(II)","","- C11 H11 F3 O10 Ru2 S -","- C11 H11 F3 O10 Ru2 S -","- C44 H44 F12 O40 Ru8 S4 -","4","1","","Tiziana Funaioli; Claudia Cavazza; Fabio Marchetti; Giuseppe Fachinetti","Aqueous Organometallic Chemistry of Ruthenium(II). Aquo Carbonyl Derivatives and Related Ethene Hydrocarboxylation in Fully Aqueous Solvent","Inorganic Chemistry","1999","38","","3361","3368","10.1021/ic981429i","","","0.71073","MoKα","","0.1392","0.0983","","","0.2519","0.2912","","","","","","1.079","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322134","11.854","0.003","14.705","0.003","15.866","0.004","107.81","","106.72","","97.56","","2447.6","1","187","2","187","2","","","","","","","","7","P -1","-P 1","2","","","","- C56 H50 Cu F6 N4 O P -","- C56 H50 Cu F6 N4 O P -","- C112 H100 Cu2 F12 N8 O2 P2 -","2","1","","Mark T. Miller; Peter K. Gantzel; Timothy B. Karpishin","Effects of Sterics and Electronic Delocalization on the Photophysical, Structural, and Electrochemical Properties of 2,9-Disubstituted 1,10-Phenanthroline Copper(I) Complexes","Inorganic Chemistry","1999","38","","3414","3422","10.1021/ic9900399","","","0.71073","MoKα","","0.1149","0.0752","","0.2348","0.1909","","","","1.016","1.013","1.013","","","","","has coordinates,has disorder","179324","2020-10-21","18:00:00",""
"4322135","23.096","0.006","23.387","0.006","17.873","0.007","90","","100.08","0.01","90","","9505","5","295","2","295","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C54.63 H45.5 Cu F6 N4 O0.63 P -","- C54.63 H45.5 Cu F6 N4 O0.63 P -","- C437.04 H364 Cu8 F48 N32 O5.04 P8 -","8","1","","Mark T. Miller; Peter K. Gantzel; Timothy B. Karpishin","Effects of Sterics and Electronic Delocalization on the Photophysical, Structural, and Electrochemical Properties of 2,9-Disubstituted 1,10-Phenanthroline Copper(I) Complexes","Inorganic Chemistry","1999","38","","3414","3422","10.1021/ic9900399","","","0.71073","MoKα","","0.0946","0.0602","","0.1753","0.1453","","","","1.065","1.109","1.109","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322136","13.327","0.007","14.114","0.007","15.175","0.005","87.23","0.04","66.48","0.03","61.84","0.04","2273","2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H32 Cu F6 N4 P -","- C56 H32 Cu F6 N4 P -","- C112 H64 Cu2 F12 N8 P2 -","2","1","","Mark T. Miller; Peter K. Gantzel; Timothy B. Karpishin","Effects of Sterics and Electronic Delocalization on the Photophysical, Structural, and Electrochemical Properties of 2,9-Disubstituted 1,10-Phenanthroline Copper(I) Complexes","Inorganic Chemistry","1999","38","","3414","3422","10.1021/ic9900399","","","0.71073","MoKα","","0.0678","0.0547","","0.1599","0.1445","","","","1.021","1.041","1.041","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322137","14.547","0.006","22.868","0.006","30.659","0.01","90","","90","","90","","10199","6","295","2","295","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C58 H44 Cu F6 N4 P -","- C58 H44 Cu F6 N4 P -","- C464 H352 Cu8 F48 N32 P8 -","8","1","","Mark T. Miller; Peter K. Gantzel; Timothy B. Karpishin","Effects of Sterics and Electronic Delocalization on the Photophysical, Structural, and Electrochemical Properties of 2,9-Disubstituted 1,10-Phenanthroline Copper(I) Complexes","Inorganic Chemistry","1999","38","","3414","3422","10.1021/ic9900399","","","0.71073","MoKα","","0.191","0.0943","","0.2745","0.2044","","","","1.026","1.132","1.132","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:36",""
"4322138","11.314","0.002","14.073","0.003","15.165","0.003","108.04","0.03","105.95","0.03","92.54","0.03","2185.3","1","130","2","130","2","","","","","","","","5","P -1","-P 1","2","(Cu^II^)~2~(TPKB-O) . 1.75THF . 0.25H~2~O","","","- C102 H89 Cu4 N8 O12 -","- C102 H76 Cu4 N8 O12 -","- C102 H76 Cu4 N8 O12 -","1","0.5","","Richard Koerner; Marilyn M. Olmstead; Andrzej Ozarowski; Alan L. Balch","A Linear Tetrapyrrole as a Binucleating Ligand with Copper(II). Coordination beyond the Usual M-N4 Bonding","Inorganic Chemistry","1999","38","","3262","3263","10.1021/ic9901113","","","1.54184","CuKα","","0.0606","0.0551","","0.1551","0.1494","","","","1.007","1.031","1.031","","","","","has coordinates","295969","2024-11-17","19:08:00",""
"4322139","8.219","0.002","11.21","0.001","14.331","0.003","90","","93.171","0.009","90","","1318.4","0.4","153","2","153","2","","","","","","","synthesized","5","P 1 21/c 1","-P 2ybc","14","","trans-Tetrachloro-bis(tripropylphosphine)-rhenium (IV)","","- C18 H42 Cl4 P2 Re -","- C18 H42 Cl4 P2 Re -","- C36 H84 Cl8 P4 Re2 -","2","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 5. Reduction or Disproportionation at the Re26+ Unit in Reactions with Tertiary Phosphines in Different Solvents","Inorganic Chemistry","1999","38","","3384","3389","10.1021/ic990114f","","","0.71073","MoKα","","0.0413","0.0249","","0.0702","0.065","","","","1.145","1.19","1.19","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322140","8.0555","0.0004","12.536","0.002","10.2041","0.0006","90","","99.167","0.009","90","","1017.29","0.18","213","2","213","2","","","","","","","synthesized","5","P 1 21/n 1","-P 2yn","14","","trans-Tetrachloro-bis(triethylphosphine)-rhenium (IV)","","- C12 H30 Cl4 P2 Re -","- C12 H30 Cl4 P2 Re -","- C24 H60 Cl8 P4 Re2 -","2","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 5. Reduction or Disproportionation at the Re26+ Unit in Reactions with Tertiary Phosphines in Different Solvents","Inorganic Chemistry","1999","38","","3384","3389","10.1021/ic990114f","","","0.71073","MoKα","","0.033","0.0294","","0.084","0.079","","","","1.119","1.114","1.114","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322141","12.876","0.002","12.1351","0.0007","13.2125","0.0007","90","","90","","90","","2064.5","0.4","213","2","213","2","","","","","","","synthesized","5","P b c a","-P 2ac 2ab","61","","trans-Tetrachloro-bis(triethylphosphine)-rhenium (IV)","","- C12 H30 Cl4 P2 Re -","- C12 H30 Cl4 P2 Re -","- C48 H120 Cl16 P8 Re4 -","4","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 5. Reduction or Disproportionation at the Re26+ Unit in Reactions with Tertiary Phosphines in Different Solvents","Inorganic Chemistry","1999","38","","3384","3389","10.1021/ic990114f","","","0.71073","MoKα","","0.0401","0.0333","","0.087","0.0817","","","","1.092","1.126","1.126","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322142","11.7679","0.0009","18.574","0.005","19.688","0.004","90","","93.37","0.02","90","","4295.9","1.5","213","2","213","2","","","","","","","synthesized","5","P 1 21/n 1","-P 2yn","14","","Pentachloro-tris(tripropylphosphine)-di-rhenium (II,III), 1,3,6- isomer, hexane solvate","","- C28.5 H66.5 Cl5 P3 Re2 -","- C28.5 H63 Cl5 P3 Re2.0026 -","- C114 H252 Cl20 P12 Re8.0104 -","4","1","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 5. Reduction or Disproportionation at the Re26+ Unit in Reactions with Tertiary Phosphines in Different Solvents","Inorganic Chemistry","1999","38","","3384","3389","10.1021/ic990114f","","","0.71073","MoKα","","0.0545","0.0455","","0.1123","0.1048","","","","1.148","1.146","1.146","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322143","12.214","0.002","15.296","0.002","20.945","0.006","90","","90","","90","","3913.1","1.4","153","2","153","2","","","","","","","synthesized","5","P 21 21 21","P 2ac 2ab","19","","Pentachloro-tris(tripropylphosphine)-di-rhenium (II,III), 1,3,6-isomer","","- C27 H63 Cl5 P3 Re2 -","- C27 H63 Cl5 P3 Re2 -","- C108 H252 Cl20 P12 Re8 -","4","1","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 5. Reduction or Disproportionation at the Re26+ Unit in Reactions with Tertiary Phosphines in Different Solvents","Inorganic Chemistry","1999","38","","3384","3389","10.1021/ic990114f","","","0.71073","MoKα","","0.0661","0.0526","","0.1313","0.1231","","","","1.091","1.086","1.086","","","","","has coordinates,has disorder","179324","2020-10-21","18:00:00",""
"4322144","9.0617","0.0006","9.0617","0.0006","9.0617","0.0006","90","","90","","90","","744.1","0.09","295","2","295","2","","","","","","","","3","I -4 3 d","I -4bd 2c 3","220","zirconium nickel antimonide","","","- Ni3 Sb4 Zr3 -","- Ni3 Sb4 Zr3 -","- Ni12 Sb16 Zr12 -","4","0.0833333","","Meitian Wang; Robert McDonald; Arthur Mar","M3Ni3Sb4 (M = Zr, Hf) and Zr3Pt3Sb4. Ternary Antimonides with the Y3Au3Sb4 Structure","Inorganic Chemistry","1999","38","","3435","3438","10.1021/ic990144i","","","0.71073","MoKα","","0.0338","0.0273","","","0.0626","0.0648","","","","","","1.091","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322145","9.2936","0.0005","22.2088","0.0012","13.0576","0.0007","90","","91.237","0.001","90","","2694.5","0.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H27 P Re S3 -","- C29 H27 P Re S3 -","- C116 H108 P4 Re4 S12 -","4","1","","Josemon Jacob; Ilia A. Guzei; James H. Espenson","Synthesis and Structural Characterization of Novel Terminal and Bridging Re(V)-Sulfido Complexes","Inorganic Chemistry","1999","38","","3266","3267","10.1021/ic990354v","","","0.71073","MoKα","","0.0408","0.0246","","","0.0416","0.0436","","","","","","1.001","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322146","11.2214","0.0006","12.8234","0.0007","13.7784","0.0008","90","","90.423","0.001","90","","1982.61","0.19","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 O Re2 S5 -","- C16 H18 O Re2 S5 -","- C64 H72 O4 Re8 S20 -","4","1","","Josemon Jacob; Ilia A. Guzei; James H. Espenson","Synthesis and Structural Characterization of Novel Terminal and Bridging Re(V)-Sulfido Complexes","Inorganic Chemistry","1999","38","","3266","3267","10.1021/ic990354v","","","0.71073","MoKα","","0.0269","0.0203","","","0.0449","0.0466","","","","","","1.006","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322147","13.486","0.007","13.637","0.004","17.274","0.004","90","","112.5","0.02","90","","2935","1.9","150.2","","150.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H44 I N4 Na O8 -","- C24 H44 I N4 Na O8 -","- C96 H176 I4 N16 Na4 O32 -","4","1","","Hiroshi Tsukube; Yoshihisa Mizutani; Satoshi Shinoda; Tsuyoshi Okazaki; Makoto Tadokoro; Kenzi Hori","Side Arm Effects on Cyclen-Alkali Metal Cation Complexation: Highly Selective and Three-Dimensional Encapsulation of Na+ Ion","Inorganic Chemistry","1999","38","","3506","3512","10.1021/ic980590q","","","0.7107","MoKα","","0.0244","0.0244","","","0.0326","0.0326","","","","","","1.404","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322148","12.021","0.003","14.668","0.004","12.023","0.003","91.94","0.02","90.61","0.02","91.96","0.02","2117.3","0.9","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C33 H66 Cl3 N8 Na O4 -","- C33 H64 Cl3 N8 Na O4 -","- C66 H128 Cl6 N16 Na2 O8 -","2","1","","Hiroshi Tsukube; Yoshihisa Mizutani; Satoshi Shinoda; Tsuyoshi Okazaki; Makoto Tadokoro; Kenzi Hori","Side Arm Effects on Cyclen-Alkali Metal Cation Complexation: Highly Selective and Three-Dimensional Encapsulation of Na+ Ion","Inorganic Chemistry","1999","38","","3506","3512","10.1021/ic980590q","","","0.7107","MoKα","","0.0544","0.0544","","","0.076","0.076","","","","","","1.807","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322149","8.997","0.003","14.117","0.004","25.162","0.004","90","","95.52","0.02","90","","3181","1.5","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H40 I N8 Na -","- C32 H40 I N8 Na -","- C128 H160 I4 N32 Na4 -","4","1","","Hiroshi Tsukube; Yoshihisa Mizutani; Satoshi Shinoda; Tsuyoshi Okazaki; Makoto Tadokoro; Kenzi Hori","Side Arm Effects on Cyclen-Alkali Metal Cation Complexation: Highly Selective and Three-Dimensional Encapsulation of Na+ Ion","Inorganic Chemistry","1999","38","","3506","3512","10.1021/ic980590q","","","0.7107","MoKα","","0.0318","0.0318","","","0.0587","0.0587","","","","","","1.667","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322150","16.245","0.006","21.12","0.01","12.868","0.006","90","","90","","90","","4415","3","20","","20","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C17 H26 Cl Cu N7 O4 -","- C136 H208 Cl8 Cu8 N56 O32 -","- C136 H208 Cl8 Cu8 N56 O32 -","","","","Yoshiki Shii; Yuri Motoda; Toshihiro Matsuo; Fumiaki Kai; Toshio Nakashima; Jean-Pierre Tuchagues; Naohide Matsumoto","Deprotonation-Induced Enantioselective Aggregation and Deprotonation-Induced Ligand Rearrangement of Copper(II) Complexes Yield 1D Homochiral and Heterochiral Chains and a Cyclic Tetramer, Respectively","Inorganic Chemistry","1999","38","","3513","3522","10.1021/ic9813260","","","0.7107","MoKalpha","","","0.052","","","0.029","","","","","1.72","1.72","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322151","11.156","0.003","20.768","0.003","13.065","0.003","90","","114.97","0.02","90","","2744.1","1.1","20","","20","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H30 Cl Cu N7 O4 -","- C108 H120 Cl4 Cu4 N28 O16 -","- C108 H120 Cl4 Cu4 N28 O16 -","","","","Yoshiki Shii; Yuri Motoda; Toshihiro Matsuo; Fumiaki Kai; Toshio Nakashima; Jean-Pierre Tuchagues; Naohide Matsumoto","Deprotonation-Induced Enantioselective Aggregation and Deprotonation-Induced Ligand Rearrangement of Copper(II) Complexes Yield 1D Homochiral and Heterochiral Chains and a Cyclic Tetramer, Respectively","Inorganic Chemistry","1999","38","","3513","3522","10.1021/ic9813260","","","0.7107","MoKalpha","","","0.069","","","0.05","","","","","3.65","3.65","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322152","13.067","0.002","15.166","0.003","15.568","0.002","90","","108.138","0.01","90","","2931.9","0.8","20","","20","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H32 Cl Cu N7 O5 -","- C108 H120 Cl4 Cu4 N28 O20 -","- C108 H120 Cl4 Cu4 N28 O20 -","","","","Yoshiki Shii; Yuri Motoda; Toshihiro Matsuo; Fumiaki Kai; Toshio Nakashima; Jean-Pierre Tuchagues; Naohide Matsumoto","Deprotonation-Induced Enantioselective Aggregation and Deprotonation-Induced Ligand Rearrangement of Copper(II) Complexes Yield 1D Homochiral and Heterochiral Chains and a Cyclic Tetramer, Respectively","Inorganic Chemistry","1999","38","","3513","3522","10.1021/ic9813260","","","0.7107","MoKalpha","","","0.067","","","0.06","","","","","3.99","3.99","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322153","21.8","0.002","8.574","0.001","16.148","0.002","90","","130.282","0.004","90","","2302.6","0.5","20","","20","","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C15 H23 Cl2 Cu N7 O8 -","- C60 H92 Cl8 Cu4 N28 O36 -","- C60 H92 Cl8 Cu4 N28 O36 -","","","","Yoshiki Shii; Yuri Motoda; Toshihiro Matsuo; Fumiaki Kai; Toshio Nakashima; Jean-Pierre Tuchagues; Naohide Matsumoto","Deprotonation-Induced Enantioselective Aggregation and Deprotonation-Induced Ligand Rearrangement of Copper(II) Complexes Yield 1D Homochiral and Heterochiral Chains and a Cyclic Tetramer, Respectively","Inorganic Chemistry","1999","38","","3513","3522","10.1021/ic9813260","","","0.7107","MoKalpha","","","0.045","","","0.033","","","","","3.82","3.82","","","","","has coordinates","191075","2020-10-21","18:00:00",""
"4322154","17.318","0.003","17.3177","","30.432","0.004","90","","90","","90","","9127","2","20","","20","","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C15 H30 Cl Cu N7 O8 -","- C240 H352 Cl16 Cu16 N112 O116 -","- C240 H352 Cl16 Cu16 N112 O116 -","","","","Yoshiki Shii; Yuri Motoda; Toshihiro Matsuo; Fumiaki Kai; Toshio Nakashima; Jean-Pierre Tuchagues; Naohide Matsumoto","Deprotonation-Induced Enantioselective Aggregation and Deprotonation-Induced Ligand Rearrangement of Copper(II) Complexes Yield 1D Homochiral and Heterochiral Chains and a Cyclic Tetramer, Respectively","Inorganic Chemistry","1999","38","","3513","3522","10.1021/ic9813260","","","0.7107","MoKalpha","","","0.083","","","0.056","","","","","1.77","1.77","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322155","8.2994","0.0008","8.557","0.001","18.683","0.003","79.45","0.01","83.55","0.01","72.79","0.01","1243.6","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H28 Cl2 Cu N10 O9 -","- C12 H28 Cl2 Cu N10 O9 -","- C24 H56 Cl4 Cu2 N20 O18 -","2","1","","Paul V. Bernhardt","A Supramolecular Synthon for H-Bonded Transition Metal Arrays","Inorganic Chemistry","1999","38","","3481","3483","10.1021/ic990074f","","","0.71073","MoKα","","0.1343","0.0893","","0.3012","0.2597","","","","1.083","1.199","1.199","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:36",""
"4322156","8.436","0.002","8.439","0.002","22.997","0.008","97.85","0.03","91.82","0.02","111.4","0.02","1504.1","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H36 Cl2 Cu N12 O14 -","- C16 H36 Cl2 Cu N12 O14 -","- C32 H72 Cl4 Cu2 N24 O28 -","2","1","","Paul V. Bernhardt","A Supramolecular Synthon for H-Bonded Transition Metal Arrays","Inorganic Chemistry","1999","38","","3481","3483","10.1021/ic990074f","","","0.71073","MoKα","","0.28","0.1192","","0.4124","0.2873","","","","1.032","1.269","1.269","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:36",""
"4322157","13.993","0.002","14.401","0.002","15.727","0.001","75.29","0.009","65.41","0.01","69.677","0.009","2680.1","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H68 Cl2 Cu2 N26 O20 -","- C30 H68 Cl2 Cu2 N26 O20 -","- C60 H136 Cl4 Cu4 N52 O40 -","2","1","","Paul V. Bernhardt","A Supramolecular Synthon for H-Bonded Transition Metal Arrays","Inorganic Chemistry","1999","38","","3481","3483","10.1021/ic990074f","","","0.71073","MoKα","","0.187","0.0538","","0.173","0.1216","","","","1.012","1.169","1.169","","","","","has coordinates,has disorder","179324","2020-10-21","18:00:00",""
"4322158","17.311","0.006","34.761","0.01","18.052","0.006","90","","94.73","0.02","90","","10826","6","133","2","130","2","","","","","","","","5","P 1 21 1","P 2yb","4","Au~3~(PhCH~2~N=COCH~3~)~3~","","","- C27 H30 Au3 N3 O3 -","- C27 H30 Au3 N3 O3 -","- C432 H480 Au48 N48 O48 -","16","8","","Alan L. Balch; Marilyn M. Olmstead; Jess C. Vickery","Gold(I) Compounds without Significant Aurophilic Intermolecular Interactions: Synthesis, Structure, and Electronic Properties of Ph~3~PAuC(O)NHCH~3~ and Au~3~(PhCH~2~N=COCH~3~)~3~: Comparative Monomeric and Trimeric Analogues of the Solvoluminescent Trimer, Au~3~(CH~3~N=COCH~3~)~3~.","Inorganic Chemistry","1999","38","","3494","3499","10.1021/ic990080b","","","0.71073","MoKα","","0.1145","0.0735","","0.2149","0.1775","","","","1.002","","","1.032","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322159","8.993","0.002","22.583","0.005","8.932","0.002","90","","98.22","0.02","90","","1795.4","0.7","123","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Ph~3~PAuC(O)NHCH~3~","","","- C20 H19 Au N O P -","- C20 H19 Au N O P -","- C80 H76 Au4 N4 O4 P4 -","4","1","","Alan L. Balch; Marilyn M. Olmstead; Jess C. Vickery","Gold(I) Compounds without Significant Aurophilic Intermolecular Interactions: Synthesis, Structure, and Electronic Properties of Ph~3~PAuC(O)NHCH~3~ and Au~3~(PhCH~2~N=COCH~3~)~3~: Comparative Monomeric and Trimeric Analogues of the Solvoluminescent Trimer, Au~3~(CH~3~N=COCH~3~)~3~.","Inorganic Chemistry","1999","38","","3494","3499","10.1021/ic990080b","","","1.54178","CuKα","","0.0755","0.0455","","0.1072","0.0942","","","","1.01","","","1.045","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322160","10.267","0.002","19.845","0.004","34.907","0.007","90","","93.22","0.03","90","","7101","2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48.5 H36.5 Fe N0.5 O13 S32 -","- C48.5 H36.5 Fe N0.5 O13 S32 -","- C194 H146 Fe4 N2 O52 S128 -","4","0.5","","Scott S. Turner; Peter Day; K. M. Abdul Malik; Michael B. Hursthouse; Simon J. Teat; Elizabeth J. MacLean; Lee Martin; Samual A. French","Effect of Included Solvent Molecules on the Physical Properties of the Paramagnetic Charge Transfer Salts β''-(bedt-ttf)4[(H3O)Fe(C2O4)3].Solvent (bedt-ttf = Bis(ethylenedithio)tetrathiafulvalene)","Inorganic Chemistry","1999","38","","3543","3549","10.1021/ic990102u","","","0.71069","MoKα","","0.0974","0.0606","","0.1832","0.1657","","","","0.983","1.16","1.16","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322161","10.2557","0.0015","19.818","0.003","34.801","0.005","90","","93.273","0.004","90","","7061.7","1.8","90","2","90","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C51 H32 Fe N O13 S32 -","- C51 H32 Fe N O13 S32 -","- C204 H128 Fe4 N4 O52 S128 -","4","0.5","","Scott S. Turner; Peter Day; K. M. Abdul Malik; Michael B. Hursthouse; Simon J. Teat; Elizabeth J. MacLean; Lee Martin; Samual A. French","Effect of Included Solvent Molecules on the Physical Properties of the Paramagnetic Charge Transfer Salts β''-(bedt-ttf)4[(H3O)Fe(C2O4)3].Solvent (bedt-ttf = Bis(ethylenedithio)tetrathiafulvalene)","Inorganic Chemistry","1999","38","","3543","3549","10.1021/ic990102u","","","0.6883","","","0.1509","0.124","","","0.2952","0.3087","","","","","","1.278","","","","has coordinates,has disorder","179324","2020-10-21","18:00:00",""
"4322162","12.124","0.004","12.124","0.004","8.13","0.003","90","","90","","120","","1034.9","0.6","293","2","293","2","","","","","","","","5","P -3","-P 3","147","","","","- H26 Mo8 N6 O44 Te8 -","- Mo8 N6 O44 Te8 -","- Mo8 N6 O44 Te8 -","1","0.166667","","Vidyavathy; K. Vidyasagar","Hydrothermal Synthesis and Characterization of a Novel Two-Dimensional Tellurite of Molybdenum(VI), (NH4)6Mo8Te8O43.H2O","Inorganic Chemistry","1999","38","","3458","3462","10.1021/ic9901160","","","0.71073","MoKα","","0.0656","0.0646","","0.1638","0.1635","","","","1.376","1.395","1.395","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322163","7.1306","0.0005","13.885","0.0009","13.94","0.0009","96.309","0.001","100.413","0.001","99.315","0.001","1325.71","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H28 Cl3 Eu N6 O4 -","- C22 H20 Cl3 Eu N6 O4 -","- C44 H40 Cl6 Eu2 N12 O8 -","2","1","","Raphaël Wietzke; Marinella Mazzanti; Jean-Marc Latour; Jacques Pécaut","Crystal Structure and Solution Fluxionality of Lanthanide Complexes of 2,4,6,-Tris-2-pyridyl-1,3,5-triazine","Inorganic Chemistry","1999","38","","3581","3585","10.1021/ic990122w","","","0.71073","MoKα","","0.0642","0.0622","","0.1681","0.1664","","","","1.1","1.126","1.126","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322164","9.369","0.004","11.168","0.004","12.663","0.004","93.01","0.03","105.534","0.015","92.57","0.02","1272.4","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H50 N12 O14 Pr2 -","- C50 H42 N12 O14 Pr2 -","- C50 H42 N12 O14 Pr2 -","1","0.5","","Raphaël Wietzke; Marinella Mazzanti; Jean-Marc Latour; Jacques Pécaut","Crystal Structure and Solution Fluxionality of Lanthanide Complexes of 2,4,6,-Tris-2-pyridyl-1,3,5-triazine","Inorganic Chemistry","1999","38","","3581","3585","10.1021/ic990122w","","","0.71073","MoKα","","0.0646","0.0516","","0.1372","0.1295","","","","1.023","1.062","1.062","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322165","10.954","0.001","10.954","0.001","10.954","0.001","90","","90","","90","","1314.4","0.2","293","2","293","2","","","","","","","prepared from tin, red phosphorus and tin(IV) iodide","3","P m -3 n","-P 4n 2 3","223","tin(II) phosphide iodide","tin(II) phosphide iodide","","- I8 P19.29 Sn24 -","- I8 P19.294 Sn24 -","- I8 P19.294 Sn24 -","1","0.0208333","","Mikhail M. Shatruk; Kirill A. Kovnir; Andrei V. Shevelkov; Igor A. Presniakov; Boris A. Popovkin","First Tin Pnictide Halides Sn24P19.3I8 and Sn24As19.3I8: Synthesis and the Clathrate-I Type of the Crystal Structure","Inorganic Chemistry","1999","38","","3455","3457","10.1021/ic990153r","","","0.71069","MoKα","","0.0263","0.026","","0.054","0.054","","","","1.266","1.275","1.275","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322166","9.472","0.0004","19.3027","0.0008","13.0634","0.0005","90","","91.155","0.001","90","","2387.96","0.17","296.2","","153","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 Cu F5 N6 Nb O3 -","- C20 H22 Cu F5 N6 Nb O3 -","- C80 H88 Cu4 F20 N24 Nb4 O12 -","4","1","","Alexander J. Norquist; Charlotte L. Stern; Kenneth R. Poeppelmeier","Cu(C10H9N3)2MOF5.2H2O (M = Nb, Ta): Aligned [MOF5]2- Oxide Fluoride Anions","Inorganic Chemistry","1999","38","","3448","3449","10.1021/ic990366g","","","0.7107","MoKα","","0.0234","0.023","","0.025","","0.025","","","2.002","","","2","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322167","9.489","0.0004","19.332","0.0008","13.1053","0.0006","90","","91.253","0.001","90","","2403.48","0.18","296.2","","296.2","","","","","","","","hydro(solvato)thermal synthesis","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 Cu F5 N6 O3 Ta -","- C20 H22 Cu F5 N6 O3 Ta -","- C80 H88 Cu4 F20 N24 O12 Ta4 -","4","1","","Alexander J. Norquist; Charlotte L. Stern; Kenneth R. Poeppelmeier","Cu(C10H9N3)2MOF5.2H2O (M = Nb, Ta): Aligned [MOF5]2- Oxide Fluoride Anions","Inorganic Chemistry","1999","38","","3448","3449","10.1021/ic990366g","","","0.7107","MoKα","","0.0185","0.019","","0.022","","0.022","","","1.398","","","1.4","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322168","11.437","0.002","13.537","0.006","13.764","0.004","89.15","0.01","108.86","0.01","103.96","0.02","1952.4","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C44.9 H29.8 Cl2.8 Mo N4 O5 -","- C44.9 H28 Cl2.8 Mo N4 O5 -","- C89.8 H56 Cl5.6 Mo2 N8 O10 -","2","1","","Brent J. Hamstra; Beisong Cheng; Mary K. Ellison; W. Robert Scheidt","Molybdenum(V) on an Oxide String. Synthesis and Structure of the Novel Linear Trinuclear Complex {[MoO(TPP)][O-Mo(TPP)-O][MoO(TPP)]}ClO4","Inorganic Chemistry","1999","38","","3554","3561","10.1021/ic990566s","","","0.71073","MoKα","","0.0496","0.0426","","0.1124","0.1082","","","","1.079","1.101","1.101","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322169","13.2138","0.0007","13.5959","0.0012","14.6676","0.0011","74.292","0.008","69.114","0.008","69.03","0.005","2267.7","0.3","127","2","127","2","","","","","","","","6","P -1","-P 1","2","","","","- C54.5 H42 Cl Mo N4 O6 -","- C54.5 H41.5 Cl Mo N4 O6 -","- C109 H83 Cl2 Mo2 N8 O12 -","2","1","","Brent J. Hamstra; Beisong Cheng; Mary K. Ellison; W. Robert Scheidt","Molybdenum(V) on an Oxide String. Synthesis and Structure of the Novel Linear Trinuclear Complex {[MoO(TPP)][O-Mo(TPP)-O][MoO(TPP)]}ClO4","Inorganic Chemistry","1999","38","","3554","3561","10.1021/ic990566s","","","0.71073","MoKα","","0.0597","0.0488","","0.1145","0.1087","","","","1.08","1.101","1.101","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322170","26.428","0.006","18.683","0.006","28.692","0.004","90","","113.98","0.02","90","","12944","6","127","2","127","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C142 H84 Cl10 Mo3 N12 O12 -","- C141.404 H90 Cl7.808 Mo3 N12 O11.972 -","- C565.616 H360 Cl31.232 Mo12 N48 O47.888 -","4","1","","Brent J. Hamstra; Beisong Cheng; Mary K. Ellison; W. Robert Scheidt","Molybdenum(V) on an Oxide String. Synthesis and Structure of the Novel Linear Trinuclear Complex {[MoO(TPP)][O-Mo(TPP)-O][MoO(TPP)]}ClO4","Inorganic Chemistry","1999","38","","3554","3561","10.1021/ic990566s","","","0.71073","MoKα","","0.171","0.0889","","0.2524","0.1878","","","","1.12","1.159","1.159","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322171","7.885","0.003","10.406","0.007","25.233","0.011","90","","98.11","0.02","90","","2049.7","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C7 H19.5 Mn2 Mo N7 O9.75 -","- C7 Mn2 Mo N7 O9.75 -","- C28 Mn8 Mo4 N28 O39 -","4","1","","Joulia Larionova; Olivier Kahn; Stéphane Golhen; Lahcène Ouahab; Rodolphe Clérac","Magnetic Transitions in the Cyano-Bridged Bimetallic Ferromagnet Mn2(H2O)5Mo(CN)7.4.75H2O (β Phase)","Inorganic Chemistry","1999","38","","3621","3627","10.1021/ic981262t","","","0.71073","MoKα","","0.1201","0.0475","","0.1555","0.1025","","","","1.09","1.129","1.129","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322172","16.444","0.003","16.444","0.003","14.178","0.005","90","","90","","90","","3833.8","1.7","295","","295","","","","","","","","chemical synthesis","5","I 4/m","-I 4","87","","","","- C9 H19 Co2 N5 O13 -","- C9 H11 Co2 N4.5 O10 -","- C72 H88 Co16 N36 O80 -","8","0.5","","Donatella Armentano; Giovanni De Munno; Francesc Lloret; Miguel Julve","Novel Three-Dimensional Cage Assembly of a μ4-Carbonato-Bridged Cobalt(II) Compound [Co2(bpm)(H2O)2(CO3)(OH)]NO3.4H2O","Inorganic Chemistry","1999","38","","3744","3747","10.1021/ic981323n","","","0.71073","MoKα","","17.48","9.49","","19.83","14.78","","","","","1.537","1.537","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322173","21.332","0.004","9.391","0.002","25.938","0.005","90","","113.84","0.03","90","","4753","2","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C46 H50 N2 P2 S2 Si2 Zn -","- C46 H50 N2 P2 S2 Si2 Zn -","- C184 H200 N8 P8 S8 Si8 Zn4 -","4","0.5","","Paulo Pérez-Lourido; Jaime Romero; José A. García-Vázquez; Antonio Sousa; Kevin P. Maresca; Jon Zubieta","Synthesis and Characterization of Zinc and Cadmium Compounds with Arenephosphinothiol Ligands. Crystal and Molecular Structures of [Cd2{2-(Ph2PO)C6H4S}4], [Zn{2-(Ph2P)-6-(Me3Si)C6H3S}2], [Cd{2-(Ph2PO)-6-(Me3Si)C6H3S}2(CH3OH)], and [Zn{PhPO(C6H4S-2)2}(bipy)]","Inorganic Chemistry","1999","38","","3709","3715","10.1021/ic981405b","","","1.54178","CuKα","","0.0396","0.0377","","0.0953","0.0949","","","","1.029","1.03","1.03","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322174","12.1237","0.0004","14.0586","0.0004","15.0938","0.0002","70.836","0.002","83.41","0.002","65.397","0.002","2208.72","0.11","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C43 H48 Cd O3 P2 S2 Si2 -","- C43 H48 Cd O3 P2 S2 Si2 -","- C86 H96 Cd2 O6 P4 S4 Si4 -","2","1","","Paulo Pérez-Lourido; Jaime Romero; José A. García-Vázquez; Antonio Sousa; Kevin P. Maresca; Jon Zubieta","Synthesis and Characterization of Zinc and Cadmium Compounds with Arenephosphinothiol Ligands. Crystal and Molecular Structures of [Cd2{2-(Ph2PO)C6H4S}4], [Zn{2-(Ph2P)-6-(Me3Si)C6H3S}2], [Cd{2-(Ph2PO)-6-(Me3Si)C6H3S}2(CH3OH)], and [Zn{PhPO(C6H4S-2)2}(bipy)]","Inorganic Chemistry","1999","38","","3709","3715","10.1021/ic981405b","","","0.71073","MoKα","","0.0885","0.0738","","0.1553","0.143","","","","1.208","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322175","8.9556","0.0003","12.7911","0.0004","14.0598","0.0005","82.671","0.001","73.14","0.001","74.113","0.001","1480.44","0.09","296","2","296","2","","","","","","","","8","P -1","-P 1","2","","","","- C29 H22 Cl3 N2 O P S2 Zn -","- C29 H22 Cl3 N2 O P S2 Zn -","- C58 H44 Cl6 N4 O2 P2 S4 Zn2 -","2","1","","Paulo Pérez-Lourido; Jaime Romero; José A. García-Vázquez; Antonio Sousa; Kevin P. Maresca; Jon Zubieta","Synthesis and Characterization of Zinc and Cadmium Compounds with Arenephosphinothiol Ligands. Crystal and Molecular Structures of [Cd2{2-(Ph2PO)C6H4S}4], [Zn{2-(Ph2P)-6-(Me3Si)C6H3S}2], [Cd{2-(Ph2PO)-6-(Me3Si)C6H3S}2(CH3OH)], and [Zn{PhPO(C6H4S-2)2}(bipy)]","Inorganic Chemistry","1999","38","","3709","3715","10.1021/ic981405b","","","0.71073","MoKα","","0.0567","0.0511","","0.1322","0.1262","","","","1.01","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322176","9.234","0.004","13.858","0.003","25.79","0.003","90","","90.532","0.002","90","","3300.1","1.6","180.2","","180.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 F29 Mo2 O8 Sb5 -","- C8 F29 Mo2 O8 Sb5 -","- C32 F116 Mo8 O32 Sb20 -","4","1","","Raimund Bröchler; Daniel Freidank; Matthias Bodenbinder; Iona H. T. Sham; Helge Willner; Steven J. Rettig; James Trotter; Friedhelm Aubke","Synthesis and Structure of [{Mo(CO)4}2(cis-μ-F2SbF4)3]x[Sb2F11]x: An Ionic Coordination Polymer","Inorganic Chemistry","1999","38","","3684","3687","10.1021/ic981439j","","","0.7107","MoKα","","0.0935","0.048","","0.0971","","0.0971","","","1.741","","","1.741","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322177","13.701","0.004","24.447","0.011","13.995","0.005","90","","99.62","0.03","90","","4622","3","295","2","295","2","","","","","","","'synthesis described in the paper'","6","P 1 21/n 1","-P 2yn","14","","'bis-μ-hydroxo-bis[aquahydroxodotriacontaoxo-μ12-(tetraoxosilicato)-' '(β-4,10-dinickeldecatungsten)ate](12-)","","- H48 K12 Ni4 O98 Si2 W20 -","- K12 Ni4 O98 Si2 W20 -","- K24 Ni8 O196 Si4 W40 -","2","0.5","","Ulrich Kortz; Yves P. Jeannin; André Tézé; Gilbert Hervé; Samih Isber","A Novel Dimeric Ni-Substituted β-Keggin Silicotungstate: Structure and Magnetic Properties of K12[{β-SiNi2W10O36(OH)2(H2O)}2].20H2O","Inorganic Chemistry","1999","38","","3670","3675","10.1021/ic990008d","","","0.71069","MoKα","","","0.046","","","0.0542","","","","","9.4654","9.4654","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322178","11.187","0.001","12.172","0.003","11.661","0.001","90","","114.96","0.01","90","","1439.6","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","aquabis(L-prolinate)copper(II) diaquabis(L-prolinate)copper(II) monohydrate","","- C20 H42 Cu2 N4 O13 -","- C20 Cu2 N4 O13 -","- C40 Cu4 N8 O26 -","2","1","","R. P. Sartoris; L. Ortigoza; N. M. C. Casado; Rafael Calvo; E. E. Castellano; O. E. Piro","Structure, Single Crystal EPR Spectra, and Exchange Interactions in [Cu(l-proline)2]2.5H2O and Cu(d,l-proline)2.2H2O","Inorganic Chemistry","1999","38","","3598","3604","10.1021/ic9900758","","","0.71073","MoKα","","","0.038","","","0.04","","","","","1.23","1.23","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322179","15.598","0.003","10.44","0.002","7.533","0.003","90","","90","","90","","1226.7","0.6","198","2","194","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","Bis(phenylthiolato)tellurium","","- C12 H10 S2 Te -","- C12 H10 S2 Te -","- C48 H40 S8 Te4 -","4","0.5","","Holger Fleischer; Sandra Stauf; Dieter Schollmeyer","Experimental Investigations and Ab Initio Studies of Tellurium(II) Dithiolates, Te(SR)2","Inorganic Chemistry","1999","38","","3725","3729","10.1021/ic990104e","","","0.71069","MoKα","","0.1154","0.044","","","0.0761","0.0946","","","","","","1.026","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322180","8.636","0.002","8.677","0.001","8.915","0.001","85.52","0.01","63.67","0.01","61.3","0.01","517.39","0.17","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","telluriumbis(isopropanethiolate)","","- C6 H14 S2 Te -","- C6 H14 S2 Te -","- C12 H28 S4 Te2 -","2","1","","Holger Fleischer; Sandra Stauf; Dieter Schollmeyer","Experimental Investigations and Ab Initio Studies of Tellurium(II) Dithiolates, Te(SR)2","Inorganic Chemistry","1999","38","","3725","3729","10.1021/ic990104e","","","0.71069","MoKα","","0.0279","0.0276","","","0.0747","0.0749","","","","","","1.173","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322181","16.013","0.002","10.135","0.002","9.037","0.002","90","","122.61","0.01","90","0.001","1235.4","0.4","195","2","195","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Bis(terbutylthiolato)tellurium","","- C8 H18 S2 Te -","- C8 H18 S2 Te -","- C32 H72 S8 Te4 -","4","0.5","","Holger Fleischer; Sandra Stauf; Dieter Schollmeyer","Experimental Investigations and Ab Initio Studies of Tellurium(II) Dithiolates, Te(SR)2","Inorganic Chemistry","1999","38","","3725","3729","10.1021/ic990104e","","","0.71069","MoKα","","0.0192","0.016","","","0.0371","0.038","","","","","","1.036","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322182","13.009","0.003","13.626","0.003","16.031","0.003","73.06","0.03","74.12","0.03","86.48","0.03","2614.1","1.1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C86 H72 B2 F48 N4 Ni2 O S2 -","- C86 H72 B2 F48 N4 Ni2 O S2 -","- C86 H72 B2 F48 N4 Ni2 O S2 -","1","0.5","","Craig A. Grapperhaus; John A. Bellefeuille; Joseph H. Reibenspies; Marcetta Y. Darensbourg","Synthesis and Dimer Cleavage Reactions of the N2S Thiolate Bridged Dimer [(mmp-dach)2Ni2]Cl2","Inorganic Chemistry","1999","38","","3698","3703","10.1021/ic990106z","","","0.71073","MoKα","","0.1051","0.081","","","0.2153","0.2375","","","","","","1.075","","","","has coordinates,has disorder","179324","2020-10-21","18:00:00",""
"4322183","12.5651","0.0005","13.2138","0.0004","8.8586","0.0005","90","","97.094","0.004","90","","1459.56","0.11","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H14 Mn O12 -","- C10 H14 Mn O12 -","- C40 H56 Mn4 O48 -","4","0.5","","Hazel-Ann Hosein; Hema Jaggernauth; Bert D. Alleyne; Lincoln A. Hall; Andrew J. P. White; David J. Williams","First-Row Transition-Metal Complexes of the 1-Methoxycyclobutenedionate(1-) Ion","Inorganic Chemistry","1999","38","","3716","3720","10.1021/ic990199k","","","1.54178","CuKα","","0.0551","0.0411","","0.1039","0.096","","","","1.057","1.086","1.086","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322184","12.398","0.002","13.1594","0.0015","8.7505","0.0008","90","","96.709","0.009","90","","1417.9","0.3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H14 O12 Zn -","- C10 H14 O12 Zn -","- C40 H56 O48 Zn4 -","4","0.5","","Hazel-Ann Hosein; Hema Jaggernauth; Bert D. Alleyne; Lincoln A. Hall; Andrew J. P. White; David J. Williams","First-Row Transition-Metal Complexes of the 1-Methoxycyclobutenedionate(1-) Ion","Inorganic Chemistry","1999","38","","3716","3720","10.1021/ic990199k","","","0.71073","MoKα","","0.0641","0.0404","","0.089","0.0789","","","","1.037","1.068","1.068","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322185","16.2535","0.0011","16.2535","0.0011","8.1426","0.0007","90","","90","","90","","2151.1","0.3","293","2","293","2","","","","","","","","4","P 4/n :2","-P 4a","85","","","","- C4 H4.5 Cu O6.25 -","- C4 H4 Cu0.833333 O6.25 -","- C48 H48 Cu10 O75 -","12","1.5","","Hazel-Ann Hosein; Hema Jaggernauth; Bert D. Alleyne; Lincoln A. Hall; Andrew J. P. White; David J. Williams","First-Row Transition-Metal Complexes of the 1-Methoxycyclobutenedionate(1-) Ion","Inorganic Chemistry","1999","38","","3716","3720","10.1021/ic990199k","","","0.71073","MoKα","","0.0612","0.0451","","0.1219","0.1126","","","","1.121","1.167","1.167","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322186","9.6717","0.0019","10.576","0.002","17.653","0.002","80.216","0.013","83.631","0.015","84.642","0.017","1763.3","0.5","256","2","256","2","","","","","","","","6","P -1","-P 1","2","","Cu2[(C6H5)3P]4B6H6","","- C76 H72 B6 Cu2 N2 P4 -","- C76 H66 B6 Cu2 N2 P4 -","- C76 H66 B6 Cu2 N2 P4 -","1","0.5","","Raifah M. Kabbani; Arnold L. Rheingold; Kin-Chung Lam; Yevgeniy Margulis; Max Vovchenko","Synthesis and Crystal Structure of a New Hexahydro-closo-hexaborate Copper(I) Complex Cu2[(C6H5)3P]4B6H6","Inorganic Chemistry","1999","38","","3748","3750","10.1021/ic990248t","","","0.71073","MoKα","","0.1064","0.0597","","","0.1286","0.1499","","","","","","1.013","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322187","8.579","0.001","9.182","0.001","12.043","0.001","104.62","0.01","90.26","0.01","110.74","0.01","853.82","0.17","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- B3 H3 N12 -","- B3 H3 N12 -","- B12 H12 N48 -","4","2","","Robert T. Paine; Wolfgang Koestle; Theodore T. Borek; Gary L. Wood; Eugene A. Pruss; Eileen N. Duesler; Michael A. Hiskey","Synthesis, Characterization, and Explosive Properties of the Nitrogen-Rich Borazine [H3N3B3(N3)3]","Inorganic Chemistry","1999","38","","3738","3743","10.1021/ic990316b","","","0.71073","MoKα","","0.0465","0.0289","","0.0597","","0.0576","","","1.003","","","1.193","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322188","10.649","0.002","11.737","0.003","13.364","0.004","90","","90","","90","","1670.3","0.7","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H17 N4 P -","- C18 H17 N4 P -","- C72 H68 N16 P4 -","4","1","","Robert T. Paine; Wolfgang Koestle; Theodore T. Borek; Gary L. Wood; Eugene A. Pruss; Eileen N. Duesler; Michael A. Hiskey","Synthesis, Characterization, and Explosive Properties of the Nitrogen-Rich Borazine [H3N3B3(N3)3]","Inorganic Chemistry","1999","38","","3738","3743","10.1021/ic990316b","","","0.71073","MoKα","","0.0521","0.0334","","0.0532","","0.0509","","","0.888","","","1.016","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322189","14.914","0.003","9.321","0.002","23.219","0.004","90","","97.35","0.004","90","","3201.2","1.1","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H54 Mg N6 O4 S2 -","- C22 H54 Mg N6 O4 S2 -","- C88 H216 Mg4 N24 O16 S8 -","4","1","","Justin K. Brask; Tristram Chivers; Masood Parvez; Glenn P. A. Yap","Assembly of a Heterobimetallic Diazasulfate Cluster via an Li4O4 Ladder","Inorganic Chemistry","1999","38","","3594","3595","10.1021/ic9903578","","","0.71073","MoKα","","0.1305","0.0645","","","0.1514","0.1626","","","","","","1.036","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322190","13.944","0.008","17.369","0.007","13.641","0.008","107.75","0.05","112.96","0.05","90.06","0.04","2870","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H90 Li4 Mg N6 O10.5 S3 -","- C42 H86 Li4 Mg N6 O10.5 S3 -","- C84 H172 Li8 Mg2 N12 O21 S6 -","2","1","","Justin K. Brask; Tristram Chivers; Masood Parvez; Glenn P. A. Yap","Assembly of a Heterobimetallic Diazasulfate Cluster via an Li4O4 Ladder","Inorganic Chemistry","1999","38","","3594","3595","10.1021/ic9903578","","","0.71069","MoKα","","0.3878","0.0746","","","0.1714","0.2867","","","","","","0.937","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322191","22.7553","0.001","15.1678","0.001","22.7921","0.001","90","","116.69","","90","","7028.5","0.6","210","2","210","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C24 H57 Cl N4 Si3 U -","- C24 H57 Cl N4 Si3 U -","- C192 H456 Cl8 N32 Si24 U8 -","8","4","","Paul Roussel; Nathaniel W. Alcock; Rita Boaretto; Andrew J. Kingsley; Ian J. Munslow; Christopher J. Sanders; Peter Scott","Complexes of Triamidoamines with the Early Actinides. Synthetic Routes to Monomeric Compounds of Tetravalent Uranium and Thorium Containing Halide and Amide Ligands","Inorganic Chemistry","1999","38","","3651","3656","10.1021/ic990563f","","","0.71073","MoKα","","0.0738","0.0611","","","0.1574","0.1718","","","","","","1.242","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322192","29.923","0.006","23.872","0.005","20.837","0.004","90","","107.81","0.03","90","","14171","5","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H57 Br N4 Si3 U -","- C24 H57 Br N4 Si3 U -","- C384 H912 Br16 N64 Si48 U16 -","16","4","","Paul Roussel; Nathaniel W. Alcock; Rita Boaretto; Andrew J. Kingsley; Ian J. Munslow; Christopher J. Sanders; Peter Scott","Complexes of Triamidoamines with the Early Actinides. Synthetic Routes to Monomeric Compounds of Tetravalent Uranium and Thorium Containing Halide and Amide Ligands","Inorganic Chemistry","1999","38","","3651","3656","10.1021/ic990563f","","","0.71073","MoKα","","0.1547","0.0764","","0.22","0.1867","","","","1.125","1.335","1.335","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322193","9.7632","0.001","22.5063","0.001","16.0909","0.0015","90","","97.772","0.005","90","","3503.2","0.5","180","2","180","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H57 I N4 Si3 U -","- C24 H57 I N4 Si3 U -","- C96 H228 I4 N16 Si12 U4 -","4","1","","Paul Roussel; Nathaniel W. Alcock; Rita Boaretto; Andrew J. Kingsley; Ian J. Munslow; Christopher J. Sanders; Peter Scott","Complexes of Triamidoamines with the Early Actinides. Synthetic Routes to Monomeric Compounds of Tetravalent Uranium and Thorium Containing Halide and Amide Ligands","Inorganic Chemistry","1999","38","","3651","3656","10.1021/ic990563f","","","0.71073","MoKα","","0.081","0.0496","","0.1086","0.1029","","","","0.813","1.02","1.02","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322194","10.0133","0.0015","23.364","0.003","16.599","0.003","90","","98.217","0.001","90","","3843.5","1","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H67 N5 Si3 U -","- C28 H67 N5 Si3 U -","- C112 H268 N20 Si12 U4 -","4","1","","Paul Roussel; Nathaniel W. Alcock; Rita Boaretto; Andrew J. Kingsley; Ian J. Munslow; Christopher J. Sanders; Peter Scott","Complexes of Triamidoamines with the Early Actinides. Synthetic Routes to Monomeric Compounds of Tetravalent Uranium and Thorium Containing Halide and Amide Ligands","Inorganic Chemistry","1999","38","","3651","3656","10.1021/ic990563f","","","0.71073","MoKα","","0.0944","0.0435","","0.0918","0.0797","","","","0.909","1.019","1.019","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322195","13.578","0.0002","13.8505","0.0002","13.9526","0.0002","106.622","0.001","109.693","0.001","107.137","0.001","2133.3","0.07","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H37 Cd N3 O2 P2 S2 -","- C42 H37 Cd N3 O2 P2 S2 -","- C84 H74 Cd2 N6 O4 P4 S4 -","2","1","","Paulo Pérez-Lourido; Jaime Romero; José A. García-Vázquez; Antonio Sousa; Kevin P. Maresca; Jon Zubieta","Synthesis and Characterization of Zinc and Cadmium Compounds with Arenephosphinothiol Ligands. Crystal and Molecular Structures of [Cd2{2-(Ph2PO)C6H4S}4], [Zn{2-(Ph2P)-6-(Me3Si)C6H3S}2], [Cd{2-(Ph2PO)-6-(Me3Si)C6H3S}2(CH3OH)], and [Zn{PhPO(C6H4S-2)2}(bipy)]","Inorganic Chemistry","1999","38","","3709","3715","10.1021/ic981405b","","","0.71073","MoKα","","0.0577","0.0483","","0.1613","0.146","","","","1.082","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322196","13.8621","0.0011","14.0457","0.001","15.2496","0.0011","82.367","0.001","80.105","0.001","62.32","0.001","2585.4","0.3","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","Salben{B(OSiPh3)2}2","","- C59 H56 B N O3 Si2 -","- C59 H53 B N O3 Si2 -","- C118 H106 B2 N2 O6 Si4 -","2","1","","Pingrong Wei; Timothy Keizer; David A. Atwood","Synthesis and Structures of Salen-Supported Borates Containing Siloxides","Inorganic Chemistry","1999","38","","3914","3918","10.1021/ic9812003","","","0.71073","MoKα","","0.0742","0.0602","","0.1709","0.1531","","","","1","1.026","1.026","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322197","13.6279","0.0009","13.6578","0.0009","14.0519","0.001","65.838","0.001","61.104","0.001","64.21","0.001","1994.9","0.2","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H39 B N O3 Si2 -","- C45 H39 B N O3 Si2 -","- C90 H78 B2 N2 O6 Si4 -","2","1","","Pingrong Wei; Timothy Keizer; David A. Atwood","Synthesis and Structures of Salen-Supported Borates Containing Siloxides","Inorganic Chemistry","1999","38","","3914","3918","10.1021/ic9812003","","","0.71073","MoKα","","0.0567","0.0461","","0.135","0.1194","","","","0.544","0.526","0.526","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322198","13.1273","0.001","13.7481","0.001","19.705","0.01","78.269","0.01","80.961","0.01","68.002","0.01","3215.6","1.7","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C66 H80 B2 N2 O6 Si2 -","- C66 H72 B2 N2 O6 Si2 -","- C132 H144 B4 N4 O12 Si4 -","2","1","","Pingrong Wei; Timothy Keizer; David A. Atwood","Synthesis and Structures of Salen-Supported Borates Containing Siloxides","Inorganic Chemistry","1999","38","","3914","3918","10.1021/ic9812003","","","0.71073","MoKα","","0.097","0.0753","","0.2051","0.1691","","","","1.33","1.414","1.414","","","","","has coordinates","179324","2020-10-21","18:00:00",""
"4322199","13.75","0.006","7.875","0.009","20.487","0.009","90","","90.48","0.03","90","","2218","3","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H26 Br3 N5 O -","- C18 H24 Br3 N5 O -","- C72 H96 Br12 N20 O4 -","4","1","","Carla Bazzicalupi; Andrea Bencini; Antonio Bianchi; Claudia Giorgi; Vieri Fusi; Barbara Valtancoli; M. Alexandra Bernardo; Fernando Pina","Effect of Protonation and Zn(II) Coordination on the Fluorescence Emission of a Phenanthroline-Containing Macrocycle. An Unusual Case of ""Nonemissive"" Zn(II) Complex","Inorganic Chemistry","1999","38","","3806","3813","10.1021/ic981374k","","","0.71069","MoKα","","0.1498","0.0655","","0.184","0.1363","","","","1.021","1.095","1.095","","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4322200","14.194","0.004","11.959","0.004","15.082","0.006","90","","114.9","0.02","90","","2322.1","1.4","298","","298","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H23 Cl2 N5 O9 Zn -","- C18 H13 Cl2 N5 O9 Zn -","- C72 H52 Cl8 N20 O36 Zn4 -","4","1","","Carla Bazzicalupi; Andrea Bencini; Antonio Bianchi; Claudia Giorgi; Vieri Fusi; Barbara Valtancoli; M. Alexandra Bernardo; Fernando Pina","Effect of Protonation and Zn(II) Coordination on the Fluorescence Emission of a Phenanthroline-Containing Macrocycle. An Unusual Case of ""Nonemissive"" Zn(II) Complex","Inorganic Chemistry","1999","38","","3806","3813","10.1021/ic981374k","","","0.71069","MoKα","","0.1552","0.0836","","0.2468","0.1961","","","","1.023","1.119","1.119","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322201","16.6358","0.0002","18.7583","0.0001","19.4375","0.0002","90","","103.97","0.001","90","","5886.24","0.1","173","2","173","2","","","","","","","J. Thorman / Prof. K. Woo - ISU","4","P 1 21/n 1","-P 2yn","14","98061","","","- C70.5 H69 N5 Zr -","- C70.5 H69 N5 Zr -","- C282 H276 N20 Zr4 -","4","1","","Joseph L. Thorman; Ilia A. Guzei; Victor G. Young; L. Keith Woo","Synthesis, Structure, and Reactivity of Zirconium and Hafnium Imido Metalloporphyrins","Inorganic Chemistry","1999","38","","3814","3824","10.1021/ic981399j","","","0.71073","MoKα","","0.062","0.0403","","0.1093","0.0984","","","","0.977","1.029","1.029","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322202","16.6081","0.0002","18.636","0.0003","19.391","0.0001","90","","104.029","0.001","90","","5822.67","0.12","173","2","173","2","","","","","","","J. Thorman / Prof. K. Woo - ISU","4","P 1 21/n 1","-P 2yn","14","98063","","","- C70.5 H69 Hf N5 -","- C70.5 H69 Hf N5 -","- C282 H276 Hf4 N20 -","4","1","","Joseph L. Thorman; Ilia A. Guzei; Victor G. Young; L. Keith Woo","Synthesis, Structure, and Reactivity of Zirconium and Hafnium Imido Metalloporphyrins","Inorganic Chemistry","1999","38","","3814","3824","10.1021/ic981399j","","","0.71073","MoKα","","0.0343","0.0263","","0.0602","0.0573","","","","1.055","1.076","1.076","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322203","13.5421","0.001","15.4623","0.0011","16.7239","0.0012","98.0192","0.0014","100.834","0.0014","113.989","0.0011","3050","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H74 N6 O Zr -","- C65 H62 N6 O Zr -","- C130 H124 N12 O2 Zr2 -","2","1","","Joseph L. Thorman; Ilia A. Guzei; Victor G. Young; L. Keith Woo","Synthesis, Structure, and Reactivity of Zirconium and Hafnium Imido Metalloporphyrins","Inorganic Chemistry","1999","38","","3814","3824","10.1021/ic981399j","","","0.71073","MoKα","","0.0418","0.034","","","0.091","0.0954","","","","","","0.999","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322204","12.9237","0.0008","16.3912","0.001","16.659","0.001","97.137","0.001","105.196","0.001","100.532","0.001","3292.6","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C80 H77 N6 O Zr -","- C80 H77 N6 O Zr -","- C160 H154 N12 O2 Zr2 -","2","1","","Joseph L. Thorman; Ilia A. Guzei; Victor G. Young; L. Keith Woo","Synthesis, Structure, and Reactivity of Zirconium and Hafnium Imido Metalloporphyrins","Inorganic Chemistry","1999","38","","3814","3824","10.1021/ic981399j","","","0.71073","MoKα","","0.0785","0.0547","","","0.1457","0.158","","","","","","0.995","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322205","14.8756","0.0008","16.7514","0.0009","26.1874","0.0015","90","","91.796","0.001","90","","6522.4","0.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C74 H75 Hf N7 -","- C67 H67 Hf N7 -","- C268 H268 Hf4 N28 -","4","1","","Joseph L. Thorman; Ilia A. Guzei; Victor G. Young; L. Keith Woo","Synthesis, Structure, and Reactivity of Zirconium and Hafnium Imido Metalloporphyrins","Inorganic Chemistry","1999","38","","3814","3824","10.1021/ic981399j","","","0.71073","MoKα","","0.0401","0.0316","","","0.0814","0.085","","","","","","1.027","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322206","19.142","0.004","9.876","0.002","12.846","0.003","90","","90","","90","","2428.5","0.9","293","2","293","2","","","","","","","","5","I b a 2","I 2 -2c","45","","bis((m2-cyclooctane-1,5-diyl-borane-oxo) dimethylaluminum)","","- C20 H40 Al2 B2 O2 -","- C20 H40 Al2 B2 O2 -","- C80 H160 Al8 B8 O8 -","4","0.5","","Romana Anulewicz-Ostrowska; Sergiusz Luliński; Janusz Serwatowski","Synthesis and Characterization of Dialkylmetal Boryloxides [(μ-9-BBN-9-O)MMe2]2, M = Al, Ga, In","Inorganic Chemistry","1999","38","","3796","3800","10.1021/ic981454o","","","1.54178","CuKα","","0.07","0.0568","","0.1567","0.1437","","","","1.082","1.122","1.122","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322207","19.063","0.004","9.838","0.002","12.934","0.003","90","","90","","90","","2425.7","0.9","293","2","293","2","","","","","","","","5","I b a m","-I 2 2c","72","","bis((m2-cyclooctane-1,5-diyl-borane-oxo)dimethyl-gallium)","","- C20 H40 B2 Ga2 O2 -","- C20 H44 B2 Ga2 O2 -","- C80 H176 B8 Ga8 O8 -","4","0.25","","Romana Anulewicz-Ostrowska; Sergiusz Luliński; Janusz Serwatowski","Synthesis and Characterization of Dialkylmetal Boryloxides [(μ-9-BBN-9-O)MMe2]2, M = Al, Ga, In","Inorganic Chemistry","1999","38","","3796","3800","10.1021/ic981454o","","","1.54178","CuKα","","0.0631","0.055","","0.183","0.1659","","","","1.118","1.134","1.134","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322208","19.136","0.004","9.83","0.002","13.423","0.003","90","","90","","90","","2525","0.9","293","2","293","2","","","","","","","","5","I b a m","-I 2 2c","72","","bis((m2-cyclooctane-1,5-diylborane-oxo)dimethylindium)","","- C20 H40 B2 In2 O2 -","- C20 H40 B2 In2 O2 -","- C80 H160 B8 In8 O8 -","4","0.25","","Romana Anulewicz-Ostrowska; Sergiusz Luliński; Janusz Serwatowski","Synthesis and Characterization of Dialkylmetal Boryloxides [(μ-9-BBN-9-O)MMe2]2, M = Al, Ga, In","Inorganic Chemistry","1999","38","","3796","3800","10.1021/ic981454o","","","1.54178","CuKα","","0.1072","0.0751","","0.2488","0.2127","","","","1.079","1.174","1.174","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322209","9.209","0.002","10.184","0.002","10.503","0.002","69.55","0.03","67.75","0.03","77.23","0.03","849.7","0.4","293","2","293","2","","","","","","","","5","P 1","P 1","1","","bis((m2-cyclooctane-1,5-diyl-borane-oxo)bis(tert-butyl)gallium)","","- C32 H64 B2 Ga2 O2 -","- C32 H64 B2 Ga2 O2 -","- C32 H64 B2 Ga2 O2 -","1","1","","Romana Anulewicz-Ostrowska; Sergiusz Luliński; Janusz Serwatowski","Synthesis and Characterization of Dialkylmetal Boryloxides [(μ-9-BBN-9-O)MMe2]2, M = Al, Ga, In","Inorganic Chemistry","1999","38","","3796","3800","10.1021/ic981454o","","","1.54178","CuKα","","0.0612","0.0533","","0.1472","0.1375","","","","1.036","1.039","1.039","","","","","has coordinates","256620","2020-10-21","18:00:00",""
"4322210","9.588","0.001","17.364","0.003","24.378","0.003","90","","90","","90","","4058.6","1","293","2","293","2","","","","","","","G.Speier (Univ. of Veszprém)","5","P 21 21 21","P 2ac 2ab","19","","","","- C51 H39 Cu O3 P2 -","- C51 H39 Cu O3 P2 -","- C204 H156 Cu4 O12 P8 -","4","1","","Éva Balogh-Hergovich; József Kaizer; Gábor Speier; Vilmos Fülöp; László Párkányi","Quercetin 2,3-Dioxygenase Mimicking Ring Cleavage of the Flavonolate Ligand Assisted by Copper. Synthesis and Characterization of Copper(I) Complexes [Cu(PPh~3~)~2~(fla)] (fla = Flavonolate) and [Cu(PPh~3~)~2~(O-bs)] (O-bs = O-Benzoylsalicylate)","Inorganic Chemistry","1999","38","","3787","3795","10.1021/ic990175d","","","1.54184","CuKa","","0.1038","0.0496","","0.1419","0.1238","","","","1.007","1.142","1.142","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322211","13.154","0.001","17.991","0.001","20.495","0.001","80.01","0.01","88.02","0.01","71.83","0.01","4537.5","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C53 H45 Cu O5 P2 -","- C53 H45 Cu O5 P2 -","- C212 H180 Cu4 O20 P8 -","4","2","","Éva Balogh-Hergovich; József Kaizer; Gábor Speier; Vilmos Fülöp; László Párkányi","Quercetin 2,3-Dioxygenase Mimicking Ring Cleavage of the Flavonolate Ligand Assisted by Copper. Synthesis and Characterization of Copper(I) Complexes [Cu(PPh~3~)~2~(fla)] (fla = Flavonolate) and [Cu(PPh~3~)~2~(O-bs)] (O-bs = O-Benzoylsalicylate)","Inorganic Chemistry","1999","38","","3787","3795","10.1021/ic990175d","","","1.5418","CuKa","","0.0607","0.0403","","0.1331","0.1167","","","","1.047","1.074","1.074","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322212","9.2791","0.0013","13.371","0.003","20.137","0.003","95.145","0.013","97.282","0.01","92.32","0.02","2464.9","0.8","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H52 La N3 O20 -","- C48 H30 La N3 O20 -","- C96 H60 La2 N6 O40 -","2","1","","Bert D. Alleyne; Leonard St. Bernard; Hema Jaggernauth; Lincoln A. Hall; Ian Baxter; Andrew J. P. White; David J. Williams","Lanthanide Complexes of 3-Diphenylamino-4-hydroxycyclobut-3-ene-1,2-dione (Diphenylaminosquarate)","Inorganic Chemistry","1999","38","","3774","3778","10.1021/ic990200f","","","1.54178","CuKα","","0.1091","0.0819","","0.2248","0.1982","","","","1.063","1.082","1.082","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322213","9.2009","0.0003","9.7464","0.0011","19.0556","0.0006","78.049","0.006","82.33","0.003","88.012","0.005","1656.8","0.2","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H64 Eu2 N6 O30 -","- C64 H64 Eu2 N6 O30 -","- C64 H64 Eu2 N6 O30 -","1","0.5","","Bert D. Alleyne; Leonard St. Bernard; Hema Jaggernauth; Lincoln A. Hall; Ian Baxter; Andrew J. P. White; David J. Williams","Lanthanide Complexes of 3-Diphenylamino-4-hydroxycyclobut-3-ene-1,2-dione (Diphenylaminosquarate)","Inorganic Chemistry","1999","38","","3774","3778","10.1021/ic990200f","","","1.54178","CuKα","","0.0635","0.0549","","0.149","0.1414","","","","1.046","1.059","1.059","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322214","9.1961","0.001","9.7555","0.0013","19.062","0.002","78.137","0.009","82.334","0.009","88.046","0.009","1658.6","0.3","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H64 Gd2 N6 O30 -","- C64 H64 Gd2 N6 O30 -","- C64 H64 Gd2 N6 O30 -","1","0.5","","Bert D. Alleyne; Leonard St. Bernard; Hema Jaggernauth; Lincoln A. Hall; Ian Baxter; Andrew J. P. White; David J. Williams","Lanthanide Complexes of 3-Diphenylamino-4-hydroxycyclobut-3-ene-1,2-dione (Diphenylaminosquarate)","Inorganic Chemistry","1999","38","","3774","3778","10.1021/ic990200f","","","0.71073","MoKα","","0.0365","0.0291","","0.0678","0.0648","","","","1.057","1.078","1.078","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322215","9.1838","0.0006","9.7409","0.0008","19.0378","0.001","78.17","0.005","82.396","0.005","88.13","0.007","1652.2","0.2","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H64 N6 O30 Tb2 -","- C64 H64 N6 O30 Tb2 -","- C64 H64 N6 O30 Tb2 -","1","0.5","","Bert D. Alleyne; Leonard St. Bernard; Hema Jaggernauth; Lincoln A. Hall; Ian Baxter; Andrew J. P. White; David J. Williams","Lanthanide Complexes of 3-Diphenylamino-4-hydroxycyclobut-3-ene-1,2-dione (Diphenylaminosquarate)","Inorganic Chemistry","1999","38","","3774","3778","10.1021/ic990200f","","","0.71073","MoKα","","0.0403","0.0334","","0.0793","0.0757","","","","1.039","1.06","1.06","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322216","7.746","0.0007","26.45","0.002","6.9099","0.0006","90","","92.062","0.009","90","","1414.8","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H13 N O4 -","- C16 H13 N O4 -","- C64 H52 N4 O16 -","4","1","","Bert D. Alleyne; Leonard St. Bernard; Hema Jaggernauth; Lincoln A. Hall; Ian Baxter; Andrew J. P. White; David J. Williams","Lanthanide Complexes of 3-Diphenylamino-4-hydroxycyclobut-3-ene-1,2-dione (Diphenylaminosquarate)","Inorganic Chemistry","1999","38","","3774","3778","10.1021/ic990200f","","","1.54178","CuKα","","0.0736","0.0608","","0.1918","0.1754","","","","1.063","1.104","1.104","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322217","11.994","0.0002","35.0895","0.0008","22.2423","0.0004","90","","90","","90","","9361","0.3","193","2","386","2","","","","","","","","5","C 2 2 21","C 2c 2","20","","","","- C100 H144 N4 Ni O8 -","- C100 H144 N4 Ni O8 -","- C400 H576 N16 Ni4 O32 -","4","0.5","","Céline Pérollier; Jacques Pécaut; René Ramasseul; Jean-Claude Marchon","Asymmetric Epoxidation of 1,2-Dihydronaphthalene Catalyzed by Manganese Chiroporphyrins: Stereoinduction Directed by Steric Exclusion","Inorganic Chemistry","1999","38","","3758","3759","10.1021/ic990295l","","","0.71073","MoKα","","0.1215","0.079","","0.2045","0.184","","","","1.13","1.264","1.264","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322218","16.1891","0.0008","21.6791","0.0011","11.9781","0.0006","90","","90","","90","","4203.9","0.4","193","2","293","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C90 H114 N14 Ni O10 -","- C87 H100 N13 Ni O9 -","- C174 H200 N26 Ni2 O18 -","2","0.5","","Céline Pérollier; Jacques Pécaut; René Ramasseul; Jean-Claude Marchon","Asymmetric Epoxidation of 1,2-Dihydronaphthalene Catalyzed by Manganese Chiroporphyrins: Stereoinduction Directed by Steric Exclusion","Inorganic Chemistry","1999","38","","3758","3759","10.1021/ic990295l","","","0.71073","MoKα","","0.0863","0.0558","","","0.1417","0.1578","","","","","","1.112","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322219","14.1515","0.0012","10.8017","0.0009","22.9054","0.0019","90","","101.503","0.002","90","","3431","0.5","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H43 O5 Re2 S7 -","- C25 H43 O5 Re2 S7 -","- C100 H172 O20 Re8 S28 -","4","1","","Josemon Jacob; Gábor Lente; Ilia A. Guzei; James H. Espenson","Monomerization of a Rhenium(V) Dimer by Ligation","Inorganic Chemistry","1999","38","","3762","3763","10.1021/ic990370s","","","0.71073","MoKα","","0.1012","0.0621","","","0.1352","0.1504","","","","","","0.997","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322220","11.83","0.003","12.134","0.002","12.356","0.002","83.41","0.01","74.8","0.02","63.02","0.02","1525.3","0.6","173","2","173","2","","","","","","","synthesized","5","P -1","-P 1","2","","Tetrachloro-bis(1,3-bis(diphenylphosphino)-propane- -di-rhenium (II, II), dichloromethane solvate","","- C58 H60 Cl12 P4 Re2 -","- C58 H60 Cl12 P4 Re2 -","- C58 H60 Cl12 P4 Re2 -","1","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 6. Rare or Unprecedented Isomers of [Re2Cl6(PR3)2] Stoichiometry","Inorganic Chemistry","1999","38","","3889","3894","10.1021/ic9906095","","","0.71073","MoKα","","0.0245","0.0231","","0.0605","0.0599","","","","1.12","1.128","1.128","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322221","12.758","0.001","15.755","0.005","24.16","0.003","90","","104.22","0.01","90","","4707.4","1.7","213","2","213","2","","","","","","","synthesized","6","P 1 21/n 1","-P 2yn","14","","Hexachloro-bis(tripropylphosphine)-di-rhenium (II, III), 1,7-isomer, tetrabutylammonium salt","","- C34 H78 Cl6 N P2 Re2 -","- C34 H78 Cl6 N P2 Re2 -","- C136 H312 Cl24 N4 P8 Re8 -","4","1","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 6. Rare or Unprecedented Isomers of [Re2Cl6(PR3)2] Stoichiometry","Inorganic Chemistry","1999","38","","3889","3894","10.1021/ic9906095","","","0.71073","MoKα","","0.0407","0.0341","","0.0803","0.0753","","","","1.122","1.121","1.121","","","","","has coordinates,has disorder","179325","2020-10-21","18:00:00",""
"4322222","16.3355","0.0008","12.656","0.001","22.892","0.002","90","","94.735","0.006","90","","4716.6","0.6","213","2","213","2","","","","","","","synthesized","6","P 1 21/c 1","-P 2ybc","14","","Hexachloro-bis(tripropylphosphine)-di-rhenium (II, III), 1,6-isomer, terabutylammonium salt","","- C34 H78 Cl6 N P2 Re2 -","- C34 H78 Cl6 N P2 Re2 -","- C136 H312 Cl24 N4 P8 Re8 -","4","1","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 6. Rare or Unprecedented Isomers of [Re2Cl6(PR3)2] Stoichiometry","Inorganic Chemistry","1999","38","","3889","3894","10.1021/ic9906095","","","0.71073","MoKα","","0.0499","0.0451","","0.1007","0.097","","","","1.206","1.212","1.212","","","","","has coordinates,has disorder","179325","2020-10-21","18:00:00",""
"4322223","11.868","0.001","12.125","0.002","15.375","0.003","88.01","0.01","82.64","0.01","88.47","0.01","2192.4","0.6","173","2","173","2","","","","","","","synthesized","6","P -1","-P 1","2","","Hexachloro-bis(diethylphenylphosphine)-di-rhenium (II, III), 1,7-isomer, tetrabutylammonium salt","","- C36 H66 Cl6 N P2 Re2 -","- C36 H66 Cl6 N P2 Re2 -","- C72 H132 Cl12 N2 P4 Re4 -","2","1","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 6. Rare or Unprecedented Isomers of [Re2Cl6(PR3)2] Stoichiometry","Inorganic Chemistry","1999","38","","3889","3894","10.1021/ic9906095","","","0.71073","MoKα","","0.0301","0.0247","","0.0671","0.0646","","","","1.101","1.115","1.115","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:36",""
"4322224","11.8986","0.0004","11.913","0.001","18.383","0.002","102.23","0.02","108.003","0.005","97.38","0.01","2368.6","0.4","213","2","213","2","","","","","","","synthesized","6","P -1","-P 1","2","","Hexachloro-(1,3-bis(diphenylphosphino)-propane)-di- -rhenium (II, III), tetrabutylammonium salt","","- C43 H62 Cl6 N P2 Re2 -","- C43 H62 Cl6 N P2 Re2 -","- C86 H124 Cl12 N2 P4 Re4 -","2","1","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 6. Rare or Unprecedented Isomers of [Re2Cl6(PR3)2] Stoichiometry","Inorganic Chemistry","1999","38","","3889","3894","10.1021/ic9906095","","","0.71073","MoKα","","0.0446","0.0388","","0.1027","0.0965","","","","1.136","1.149","1.149","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322225","11.0686","0.0004","11.0686","0.0004","28.069","0.004","90","","90","","120","","2978.1","0.5","213","2","213","2","","","","","","","synthesized","5","P 31","P 31","144","","Pentachloro-tris(tripropylphosphine)-di-rhenium (II, III), 1,3,6-isomer","","- C27 H63 Cl5 P3 Re2 -","- C27 H63 Cl5 P3 Re2.002 -","- C81 H189 Cl15 P9 Re6.006 -","3","1","","F. Albert Cotton; Evgeny V. Dikarev; Marina A. Petrukhina","Mixed Chloride/Phosphine Complexes of the Dirhenium Core. 6. Rare or Unprecedented Isomers of [Re2Cl6(PR3)2] Stoichiometry","Inorganic Chemistry","1999","38","","3889","3894","10.1021/ic9906095","","","0.71073","MoKα","","0.051","0.0496","","0.1324","0.1305","","","","1.055","1.052","1.052","","","","","has coordinates,has disorder","179325","2020-10-21","18:00:00",""
"4322226","10.027","0.003","11.713","0.003","26.821","0.009","90","","93.85","0.02","90","","3142.9","1.6","23","","23","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H34 Cl Co Mn N5 O9 -","- C112 H136 Cl4 Co4 Mn4 N20 O52 -","- C112 H136 Cl4 Co4 Mn4 N20 O52 -","","","","Satoru Kita; Hideki Furutachi; Hisashi Ōkawa","(μ-Phenoxo)2CoIIMII (M = Mn, Co, Zn) Complexes with a Co(salen) Entity in a Macrocyclic Framework: Core Structures and Neighboring MII Effects upon Oxygenation at the Co(salen) Center","Inorganic Chemistry","1999","38","","4038","4045","10.1021/ic9809456","","","0.7107","MoKalpha","","","0.054","","","0.09","","","","","2.15","2.15","","","","","has coordinates","189896","2020-10-21","18:00:00",""
"4322227","10.166","0.005","11.934","0.003","27.38","0.006","90","","93.97","0.03","90","","3314","2","23","","23","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C29 H36 Co F6 Mn N5 O5 P -","- C116 H144 Co4 F32 Mn4 N20 O20 P4 -","- C116 H144 Co4 F32 Mn4 N20 O20 P4 -","","","","Satoru Kita; Hideki Furutachi; Hisashi Ōkawa","(μ-Phenoxo)2CoIIMII (M = Mn, Co, Zn) Complexes with a Co(salen) Entity in a Macrocyclic Framework: Core Structures and Neighboring MII Effects upon Oxygenation at the Co(salen) Center","Inorganic Chemistry","1999","38","","4038","4045","10.1021/ic9809456","","","0.7107","MoKalpha","","","0.048","","","0.034","","","","","2.64","2.64","","","","","has coordinates","189896","2020-10-21","18:00:00",""
"4322228","12.097","0.003","12.209","0.005","9.977","0.004","112.29","0.03","99.19","0.03","77.69","0.03","1327","0.9","20","","20","","","","","","","","","7","P -1","-P 1","2","","","","- C25 H27 Cl Co N4 O8 Zn -","- C50 H54 Cl2 Co2 N8 O16 Zn2 -","- C50 H54 Cl2 Co2 N8 O16 Zn2 -","","","","Satoru Kita; Hideki Furutachi; Hisashi Ōkawa","(μ-Phenoxo)2CoIIMII (M = Mn, Co, Zn) Complexes with a Co(salen) Entity in a Macrocyclic Framework: Core Structures and Neighboring MII Effects upon Oxygenation at the Co(salen) Center","Inorganic Chemistry","1999","38","","4038","4045","10.1021/ic9809456","","","0.7107","MoKalpha","","","0.045","","","0.031","","","","","5.26","5.26","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322229","12.118","0.003","12.156","0.002","9.977","0.001","112.49","0.01","99.22","0.02","77.63","0.02","1321.4","0.4","20","","20","","","","","","","","","6","P -1","-P 1","2","","","","- C25 H27 Cl Co2 N4 O8 -","- C50 H54 Cl2 Co4 N8 O16 -","- C50 H54 Cl2 Co4 N8 O16 -","","","","Satoru Kita; Hideki Furutachi; Hisashi Ōkawa","(μ-Phenoxo)2CoIIMII (M = Mn, Co, Zn) Complexes with a Co(salen) Entity in a Macrocyclic Framework: Core Structures and Neighboring MII Effects upon Oxygenation at the Co(salen) Center","Inorganic Chemistry","1999","38","","4038","4045","10.1021/ic9809456","","","0.7107","MoKalpha","","","0.038","","","0.025","","","","","3.39","3.39","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322230","31.374","0.003","12.1153","0.0012","21.252","0.002","90","","130.958","0.005","90","","6100.4","1.1","158","","158","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C56 H70 Cl8 N8 Os3 -","- C56 H70 Cl8 N8 Os3 -","- C224 H280 Cl32 N32 Os12 -","4","0.5","","Claire Newton; Kimberly D. Edwards; Joseph W. Ziller; Nancy M. Doherty","Electron-Rich Nitrido-Bridged Complexes. Structure and Bonding in Triosmium Dinitrido Compounds","Inorganic Chemistry","1999","38","","4032","4037","10.1021/ic981257p","","","0.71073","MoKα","","0.0461","0.0274","","0.058","0.052","","","","1.031","1.055","1.055","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322231","17.4716","0.0013","17.4716","0.0013","26.435","0.004","90","","90","","90","","8069.5","1.5","158","","158","","","","","","","","","5","I 41 2 2","I 4bw 2bw","98","","","","- C70 H98 Cl12 N8 Os3 -","- C70 H60 Cl12 N8 Os3 -","- C280 H240 Cl48 N32 Os12 -","4","0.25","","Claire Newton; Kimberly D. Edwards; Joseph W. Ziller; Nancy M. Doherty","Electron-Rich Nitrido-Bridged Complexes. Structure and Bonding in Triosmium Dinitrido Compounds","Inorganic Chemistry","1999","38","","4032","4037","10.1021/ic981257p","","","0.71073","MoKα","","0.0406","0.0325","","0.085","0.0815","","","","1.119","1.143","1.143","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322232","8.473","0.003","9.236","0.003","7.709","0.004","109.9","0.03","92.26","0.04","107.89","0.03","532.8","0.4","170.2","","170.2","","","","","","","","","6","P -1","-P 1","2","","","","- C5 H12 Cl2 N2 S Se -","- C5 H12 Cl2 N2 S Se -","- C10 H24 Cl4 N4 S2 Se2 -","2","1","","Arto Maaninen; Tristram Chivers; Masood Parvez; Jarkko Pietikäinen; Risto S. Laitinen","Syntheses of THF Solutions of SeX2 (X = Cl, Br) and a New Route to Selenium Sulfides SenS8-n (n= 1-5): X-ray Crystal Structures of SeCl2(tht)2 and SeCl2.tmtu","Inorganic Chemistry","1999","38","","4093","4097","10.1021/ic981430h","","","0.7107","MoKα","","0.0517","0.0517","","0.0484","0.0484","","","","2.099","2.099","2.099","","","","","has coordinates","189896","2020-10-21","18:00:00",""
"4322233","12.946","0.001","16.178","0.001","12.396","0.001","106.26","0.01","92.12","0.01","96.58","0.01","2469.5","0.3","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C37 H85 I3 Ir N O P2 -","- C37 H85 I3 Ir N O P2 -","- C74 H170 I6 Ir2 N2 O2 P4 -","2","1","","Robert D. Simpson; William J. Marshall; Amy A. Farischon; D. Christopher Roe; Vladimir V. Grushin","Anionic Iridium Monohydrides","Inorganic Chemistry","1999","38","","4171","4173","10.1021/ic990068j","","x-ray","0.71","Mo","","","3.49","","","3.9","","","","","2.05","2.05","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322234","9.4321","0.0007","14.1919","0.0014","26.5484","0.0014","90","","90","","90","","3553.8","0.5","293","2","150","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H24 N2 O3 V -","- C18 H24 N2 O3 V -","- C144 H192 N16 O24 V8 -","8","1","","Henk Hagen; Antonio Barbon; Ernst E. van Faassen; Bert T. G. Lutz; Jaap Boersma; Anthony L. Spek; Gerard van Koten","Synthesis and Characterization of O,N-Chelated Vanadium(IV) Oxo Phenolate Complexes: Electronic Effect of Meta and Para Substituents on the Vanadium Center","Inorganic Chemistry","1999","38","","4079","4086","10.1021/ic9901564","","","0.71073","MoKα","","0.1466","0.0565","","0.1049","0.0829","","","","0.973","1.115","1.115","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322235","17.9977","0.0015","15.7445","0.0009","14.4986","0.0006","90","","113.206","0.005","90","","3776","0.4","225","","225","","","","","","","","see text","6","C 1 2/c 1","-C 2yc","15","","","","- C13.5 H23 Cl3 N2 O2 V -","- C13.5 H23 Cl3 N2 O2 V -","- C108 H184 Cl24 N16 O16 V8 -","8","1","","Henk Hagen; Antonio Barbon; Ernst E. van Faassen; Bert T. G. Lutz; Jaap Boersma; Anthony L. Spek; Gerard van Koten","Synthesis and Characterization of O,N-Chelated Vanadium(IV) Oxo Phenolate Complexes: Electronic Effect of Meta and Para Substituents on the Vanadium Center","Inorganic Chemistry","1999","38","","4079","4086","10.1021/ic9901564","","","0.71073","MoKα","","0.0588","0.0416","","","0.101","0.1104","","","","","","1.028","","","","has coordinates","258736","2020-11-05","08:57:04",""
"4322236","6.8225","0.0004","16.7914","0.001","15.6088","0.0009","90","","92.893","0.001","90","","1785.85","0.18","203","","203","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H24 Cl2 O5 U -","- C12 H24 Cl2 O5 U -","- C48 H96 Cl8 O20 U4 -","4","1","","Marianne P. Wilkerson; Carol J. Burns; Robert T. Paine; Brian L. Scott","Synthesis and Crystal Structure of UO2Cl2(THF)3: A Simple Preparation of an Anhydrous Uranyl Reagent","Inorganic Chemistry","1999","38","","4156","4158","10.1021/ic990159g","","","0.71073","MoKα","","0.0592","0.0395","","0.1199","0.107","","","","0.799","0.81","0.81","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322237","18.393","0.005","14.428","0.002","17.396","0.002","90","","90","","90","","4616.4","1.5","296.2","","296.2","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C33 H39 Cl6 N3 O13 Ru3 -","- C33 H39 Cl6 N3 O13 Ru3 -","- C132 H156 Cl24 N12 O52 Ru12 -","4","0.5","","Ken-ichiro Ota; Hirokazu Sasaki; Taeko Matsui; Tomohiko Hamaguchi; Tadashi Yamaguchi; Tasuku Ito; Hiroaki Kido; Clifford P. Kubiak","Syntheses and Properties of a Series of Oxo-Centered Triruthenium Complexes and Their Bridged Dimers with Isocyanide Ligands at Terminal and Bridging Positions","Inorganic Chemistry","1999","38","","4070","4078","10.1021/ic990234n","","","0.7107","MoKα","","","0.0314","","","0.0356","","","","","","","1.829","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322238","12.329","0.007","14.501","0.009","18.504","0.009","112.23","0.05","98.45","0.08","101.13","0.09","2915","4","298","","298","","","","","","","","","7","P -1","-P 1","2","","","","- C47 H73 B Br2 N6 O6 Zn2 -","- C48 H66 B Br2 N6 O5 Zn2 -","- C96 H132 B2 Br4 N12 O10 Zn4 -","2","1","","Carla Bazzicalupi; Andrea Bencini; Emanuela Berni; Antonio Bianchi; Valentina Fedi; Vieri Fusi; Claudia Giorgi; Piero Paoletti; Barbara Valtancoli","Carboxy and Diphosphate Ester Hydrolysis by a Dizinc Complex with a New Alcohol-Pendant Macrocycle","Inorganic Chemistry","1999","38","","4115","4122","10.1021/ic9902929","","","0.71069","MoKα","","0.1788","0.0822","","0.2805","0.2202","","","","1.053","1.155","1.155","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322239","13.9442","0.0003","15.2151","0.0004","15.7164","0.0003","109.032","0.001","97.975","0.001","115.697","0.001","2682.42","0.11","188","2","188","2","","","","","","","","6","P -1","-P 1","2","","","","- C45 H50.5 F12 Fe2 N3.5 O16 -","- C44.98 H40 F12 Fe2 N3.49 O16 -","- C89.96 H80 F24 Fe4 N6.98 O32 -","2","1","","Tadashi J. Mizoguchi; Roman M. Davydov; Stephen J. Lippard","Structural and Spectroscopic Comparisons between (μ-Oxo)- and (μ-Hydroxo)bis(μ-carboxylato)diiron(III) Complexes That Contain All-Oxygen-Donor Ligands","Inorganic Chemistry","1999","38","","4098","4103","10.1021/ic990303y","","","0.71073","MoKα","","0.058","0.0476","","","0.1312","0.1372","","","","","","1.034","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322240","16.005","0.005","20.859","0.008","24.328","0.004","90","","90","","90","","8122","4","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C62 H119.3 Co N14 O30.65 P S -","- C62 H104 Co N14 O30.65 P S -","- C248 H416 Co4 N56 O122.6 P4 S4 -","4","1","","Lucio Randaccio; Silvano Geremia; Giorgio Nardin; Miroslav Šlouf; Ivana Srnova","Crystal Chemistry of Cobalamins. Structural Characterization of the Co-S Bond in Cobalamins","Inorganic Chemistry","1999","38","","4087","4092","10.1021/ic9903376","","","0.8","","","0.0581","0.0535","","0.1535","0.1498","","","","1.052","1.079","1.079","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322241","15.699","0.014","22.32","0.02","24.8","0.07","90","","90","","90","","8690","3","100","2","100","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C63 H112.8 Cl Co N15 O24.4 P S -","- C63 H77 Cl Co N15 O24.4 P S -","- C252 H308 Cl4 Co4 N60 O97.6 P4 S4 -","4","1","","Lucio Randaccio; Silvano Geremia; Giorgio Nardin; Miroslav Šlouf; Ivana Srnova","Crystal Chemistry of Cobalamins. Structural Characterization of the Co-S Bond in Cobalamins","Inorganic Chemistry","1999","38","","4087","4092","10.1021/ic9903376","","","1","","","0.1156","0.1129","","","0.3183","0.3265","","","","","","1.58","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322242","9.9001","0.0014","9.9001","0.0014","9.9001","0.0014","90","","90","","90","","970.3","0.2","294","2","294","2","","","","","","","Pyrolysis of cesium dibromoamino-tris(trifluoromethyl)borate","5","P 21 3","P 2ac 2ab 3","198","","Cesium bromo-tris(trifluoromethyl)borate","","- C3 B Br Cs F9 -","- C3 B Br Cs F9 -","- C12 B4 Br4 Cs4 F36 -","4","0.333333","","David J. Brauer; Hans Bürger; Yonas Chebude; Gottfried Pawelke","Halogenation of (CF3)3B.NH3: N,N-Dihaloamino- and Halo-tris(trifluoromethyl)borates [(CF3)3B-NX2]- and [(CF3)3B-X]-, X = F, Cl, Br","Inorganic Chemistry","1999","38","","3972","3977","10.1021/ic990352a","","","0.71073","MoKα","","0.0631","0.0463","","0.149","0.1445","","","","1.024","1.2","1.2","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322243","22.802","0.005","7.0965","0.0013","11","0.002","90","","102.795","0.015","90","","1735.8","0.6","293","2","293","2","","","","","","","Reaction of cesium hydroxide with amminetris(trifluoromethyl)borane","6","C 1 2/c 1","-C 2yc","15","","Cesium hydrogen bis(aminotris(trifluoromethyl)borate)","","- C6 H5 B2 Cs F18 N2 -","- C6 H5 B2 Cs F18 N2 -","- C24 H20 B8 Cs4 F72 N8 -","4","0.5","","David J. Brauer; Hans Bürger; Yonas Chebude; Gottfried Pawelke","Halogenation of (CF3)3B.NH3: N,N-Dihaloamino- and Halo-tris(trifluoromethyl)borates [(CF3)3B-NX2]- and [(CF3)3B-X]-, X = F, Cl, Br","Inorganic Chemistry","1999","38","","3972","3977","10.1021/ic990352a","","","0.71073","MoKα","","0.0374","0.0328","","0.0945","0.0916","","","","1.031","1.072","1.072","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322244","20.121","0.004","16.765","0.003","10.005","0.002","90","","118.416","0.012","90","","2968.3","1","294","2","294","2","","","","","","","Reaction of Cs[B(CF3)3NBr2] with fluorine in the presence of H2O and CH3CN","8","C 1 2/c 1","-C 2yc","15","","Cesium tribromoacetamido-tris(trifluoromethyl)borate","","- C5 H B Br3 Cs F9 N O -","- C5 H B Br3 Cs F9 N O -","- C40 H8 B8 Br24 Cs8 F72 N8 O8 -","8","1","","David J. Brauer; Hans Bürger; Yonas Chebude; Gottfried Pawelke","Halogenation of (CF3)3B.NH3: N,N-Dihaloamino- and Halo-tris(trifluoromethyl)borates [(CF3)3B-NX2]- and [(CF3)3B-X]-, X = F, Cl, Br","Inorganic Chemistry","1999","38","","3972","3977","10.1021/ic990352a","","","1.54184","CuKα","","0.068","0.0589","","0.1766","0.1678","","","","1.067","1.107","1.107","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322245","9.8059","0.0009","9.8059","0.0009","9.8059","0.0009","90","","90","","90","","942.89","0.15","294","2","294","2","","","","","","","Pyrolysis of Cesium dichloroamino-tris(trifluoromethyl)borate","5","P 21 3","P 2ac 2ab 3","198","","Cesium chloro-tris(trifluoromethyl)borate","","- C3 B Cl Cs F9 -","- C3 B Cl Cs F9 -","- C12 B4 Cl4 Cs4 F36 -","4","0.333333","","David J. Brauer; Hans Bürger; Yonas Chebude; Gottfried Pawelke","Halogenation of (CF3)3B.NH3: N,N-Dihaloamino- and Halo-tris(trifluoromethyl)borates [(CF3)3B-NX2]- and [(CF3)3B-X]-, X = F, Cl, Br","Inorganic Chemistry","1999","38","","3972","3977","10.1021/ic990352a","","","0.71073","MoKα","","0.0252","0.0237","","0.0639","0.0633","","","","1.082","1.099","1.099","","","","","has coordinates","301838","2025-08-20","22:17:36",""
"4322246","6.8588","0.0009","11.271","0.002","13.978","0.006","88.88","0.02","89.38","0.02","78.279","0.014","1057.8","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H46 Mn N6 O10 -","- C38 H46 Mn N6 O10 -","- C38 H46 Mn N6 O10 -","1","0.5","","Mohammed Fettouhi; Mazen Khaled; Abdel Waheed; Stéphane Golhen; Lahcène Ouahab; Jean-Pascal Sutter; Olivier Kahn","Manganese (II) Coordination Complexes Involving Nitronyl Nitroxide Radicals","Inorganic Chemistry","1999","38","","3967","3971","10.1021/ic9905751","","","0.71073","MoKα","","0.0748","0.0392","","","0.0898","0.1017","","","","","","1.005","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322247","7.177","0.004","13.767","0.003","13.928","0.004","90.2","0.02","102.94","0.04","91.86","0.04","1340.4","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H64 Mn N18 O8 -","- C48 H64 Mn N18 O8 -","- C48 H64 Mn N18 O8 -","1","0.5","","Mohammed Fettouhi; Mazen Khaled; Abdel Waheed; Stéphane Golhen; Lahcène Ouahab; Jean-Pascal Sutter; Olivier Kahn","Manganese (II) Coordination Complexes Involving Nitronyl Nitroxide Radicals","Inorganic Chemistry","1999","38","","3967","3971","10.1021/ic9905751","","","0.71073","MoKα","","0.0795","0.0418","","","0.1041","0.1215","","","","","","0.906","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322248","7.0037","0.0019","13.8849","0.0013","14.0362","0.0019","90.34","0.01","101.417","0.018","92.919","0.013","1336","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H64 Mn N18 O4 -","- C48 H64 Mn N18 O4 -","- C48 H64 Mn N18 O4 -","1","0.5","","Mohammed Fettouhi; Mazen Khaled; Abdel Waheed; Stéphane Golhen; Lahcène Ouahab; Jean-Pascal Sutter; Olivier Kahn","Manganese (II) Coordination Complexes Involving Nitronyl Nitroxide Radicals","Inorganic Chemistry","1999","38","","3967","3971","10.1021/ic9905751","","","0.71073","MoKα","","0.0945","0.0485","","","0.1225","0.1414","","","","","","1.017","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322249","13.532","0.002","13.4642","0.0013","13.447","0.002","90","","99.681","0.007","90","","2415.1","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- La16 Mo21 O56 -","- La16 Mo21 O56 -","- La32 Mo42 O112 -","2","0.5","","Philippe Gall; Régis Gautier; Jean-François Halet; Patrick Gougeon","Synthesis, Physical Properties, and Theoretical Study of R~16~Mo~21~O~56~ Compounds (R = La, Ce, Pr, and Nd) Containing Bioctahedral Mo~10~ Clusters and Single Mo Atoms","Inorganic Chemistry","1999","38","","4455","4461","10.1021/ic981234a","","","0.7107","MoKα","","0.0375","0.0264","","0.0584","0.0565","","","","1.248","1.302","1.302","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322250","27.9972","0.0009","8.8713","0.0003","19.5939","0.0006","90","","90","","90","","4866.6","0.3","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C15 H26 Cl2 Cu2 N2 O14 -","- C15 H22 Cl2 Cu2 N2 O14 -","- C120 H176 Cl16 Cu16 N16 O112 -","8","1","","Anbanandam Asokan; Babu Varghese; Periakaruppan T. Manoharan","Synthesis, Structure, Magnetic Properties, and 1H NMR Studies of a Moderately Antiferromagnetically Coupled Binuclear Copper(II) Complex","Inorganic Chemistry","1999","38","","4393","4399","10.1021/ic9813617","","","0.71073","MoKα","","0.0799","0.0586","","0.1866","0.1677","","","","1.113","1.15","1.15","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322251","14.7387","0.0014","10.6738","0.001","16.999","0.003","90","","90.954","0.002","90","","2673.9","0.6","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H41 Cl3 N P2 V -","- C22 H41 Cl3 N P2 V -","- C88 H164 Cl12 N4 P8 V4 -","4","1","","Francisco Montilla; Angeles Monge; Enrique Gutiérrez-Puebla; Antonio Pastor; Diego del Río; Norge Cruz Hernández; Javier Fernández Sanz; Agustín Galindo","Synthesis, Structural Characterization, and MO Calculations of Vanadium Imido Complexes Containing Bidentate Phosphine Coligands","Inorganic Chemistry","1999","38","","4462","4466","10.1021/ic9900152","","","0.71073","MoKα","","0.0894","0.0544","","0.1175","0.1046","","","","0.983","1.063","1.063","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322252","21.011","0.003","21.011","0.003","13.39","0.003","90","","90","","120","","5119.2","1.5","298","","298","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C15 H63 N3 O18 W -","- C15 H63 N3 O18 W -","- C90 H378 N18 O108 W6 -","6","0.333333","","Murray V. Baker; Michael R. North; Brian W. Skelton; Allan H. White","Oxidations of (R3tach)M(CO)3 Complexes [M = Cr, Mo, W; R3tach = 1,3,5-Trialkyl-1,3,5-triazacyclohexane (R =t-Bu, Bn)]. Crystal Structures of (t-Bu3tach)MO3.15H2O (M = Mo, W)","Inorganic Chemistry","1999","38","","4515","4521","10.1021/ic990031z","","","0.71073","Mo-Kα","","0.044","0.022","","0.019","0.019","","","","2.916","3.541","3.541","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322253","21.026","0.002","21.026","0.002","13.418","0.002","90","","90","","120","","5137.3","1","293","","293","","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","","","- C15 H63 Mo N3 O18 -","- C15 H45 Mo N3 O18 -","- C90 H270 Mo6 N18 O108 -","6","0.333333","","Murray V. Baker; Michael R. North; Brian W. Skelton; Allan H. White","Oxidations of (R3tach)M(CO)3 Complexes [M = Cr, Mo, W; R3tach = 1,3,5-Trialkyl-1,3,5-triazacyclohexane (R =t-Bu, Bn)]. Crystal Structures of (t-Bu3tach)MO3.15H2O (M = Mo, W)","Inorganic Chemistry","1999","38","","4515","4521","10.1021/ic990031z","","","0.71073","Mo-Kα","","0.042","0.028","","0.043","0.032","","","","4.328","3.747","3.747","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4322254","25.027","0.004","11.593","0.002","14.556","0.002","90","","95.82","0.01","90","","4201.5","1.1","200","","200","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C29 H35 Cl2 N4 Ni2 O12 S4 -","- C29 H35 Cl2 N4 Ni2 O12 S4 -","- C116 H140 Cl8 N16 Ni8 O48 S16 -","4","0.5","","Matthias Konrad; Franc Meyer; Albrecht Jacobi; Peter Kircher; Peter Rutsch; Laszlo Zsolnai","Coordination and Conversion of Urea at Dinuclear μ-Acetato Nickel(II) Complexes with Symmetric and Asymmetric Cores","Inorganic Chemistry","1999","38","","4559","4566","10.1021/ic990137u","","","0.71073","MoKα","","0.1218","0.078","","","0.2181","0.241","","","","","","1.204","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322255","10.764","0.002","11.242","0.002","23.776","0.005","93.19","0.03","95.28","0.03","113.15","0.03","2620.9","1.1","200","","200","","","","","","","","","7","P -1","-P 1","2","","","","- C39 H64 Cl2 N8 Ni2 O12 S4 -","- C39 H64 Cl2 N8 Ni2 O12 S4 -","- C78 H128 Cl4 N16 Ni4 O24 S8 -","2","1","","Matthias Konrad; Franc Meyer; Albrecht Jacobi; Peter Kircher; Peter Rutsch; Laszlo Zsolnai","Coordination and Conversion of Urea at Dinuclear μ-Acetato Nickel(II) Complexes with Symmetric and Asymmetric Cores","Inorganic Chemistry","1999","38","","4559","4566","10.1021/ic990137u","","","0.71073","MoKα","","0.1032","0.0607","","","0.1808","0.196","","","","","","1.051","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322256","13.932","0.003","18.748","0.004","15.517","0.003","90","","91.07","0.03","90","","4052.3","1.5","200","","200","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C112 H232 Cl8 N32 Ni8 O44 S8 -","- C28 H58 Cl2 N8 Ni2 O11 S2 -","- C112 H232 Cl8 N32 Ni8 O44 S8 -","4","1","","Matthias Konrad; Franc Meyer; Albrecht Jacobi; Peter Kircher; Peter Rutsch; Laszlo Zsolnai","Coordination and Conversion of Urea at Dinuclear μ-Acetato Nickel(II) Complexes with Symmetric and Asymmetric Cores","Inorganic Chemistry","1999","38","","4559","4566","10.1021/ic990137u","","","0.71073","MoKα","","0.1792","0.0582","","","0.1295","0.162","","","","","","0.854","","","","has coordinates,has disorder","179325","2020-10-21","18:00:00",""
"4322257","18.538","0.004","12.072","0.002","19.971","0.004","90","","98.54","0.03","90","","4419.8","1.5","200","","200","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25.5 H53.5 Cl2 N10 Ni2 O14.5 -","- C25.5 H53.5 Cl2 N10 Ni2 O14.5 -","- C102 H214 Cl8 N40 Ni8 O58 -","4","1","","Matthias Konrad; Franc Meyer; Albrecht Jacobi; Peter Kircher; Peter Rutsch; Laszlo Zsolnai","Coordination and Conversion of Urea at Dinuclear μ-Acetato Nickel(II) Complexes with Symmetric and Asymmetric Cores","Inorganic Chemistry","1999","38","","4559","4566","10.1021/ic990137u","","","0.71073","MoKα","","0.1051","0.0582","","","0.1735","0.1983","","","","","","1.036","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322258","15.129","0.003","9.9","0.002","37.062","0.007","90","","101.14","0.01","90","","5446.4","1.9","200","","200","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C40.8 H57.6 B0.8 N4.8 Na0.8 Ni1.6 O7.2 -","- C51 H72 B N6 Na Ni2 O9 -","- C204 H288 B4 N24 Na4 Ni8 O36 -","4","1","","Matthias Konrad; Franc Meyer; Albrecht Jacobi; Peter Kircher; Peter Rutsch; Laszlo Zsolnai","Coordination and Conversion of Urea at Dinuclear μ-Acetato Nickel(II) Complexes with Symmetric and Asymmetric Cores","Inorganic Chemistry","1999","38","","4559","4566","10.1021/ic990137u","","","0.71073","MoKα","","0.219","0.0975","","","0.2055","0.2725","","","","","","1.049","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322259","4.6115","0.0009","4.6115","0.0009","8.615","0.002","90","","90","","90","","183.21","0.07","293","2","293","2","","","","","","","","3","P 4/m m m","-P 4 2","123","","","","- Ba Mg4 Si3 -","- Ba Mg4 Si3 -","- Ba Mg4 Si3 -","1","0.0625","","Fabio Zürcher; Steffen Wengert; Reinhard Nesper","Chemical Twinning in Zintl Phases","Inorganic Chemistry","1999","38","","4567","4569","10.1021/ic990147v","","","0.71073","MoKα","","0.0166","0.0166","","","0.0402","0.0402","","","","","","1.175","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322260","4.6335","0.0008","4.6335","0.0008","8.746","0.002","90","","90","","90","","187.77","0.06","298","2","298","2","","","","","","","","3","P 4/m m m","-P 4 2","123","","","","- Ba Ge3 Mg4 -","- Ba Ge3 Mg4 -","- Ba Ge3 Mg4 -","1","0.0625","","Fabio Zürcher; Steffen Wengert; Reinhard Nesper","Chemical Twinning in Zintl Phases","Inorganic Chemistry","1999","38","","4567","4569","10.1021/ic990147v","","","0.71073","MoKα","","0.0231","0.0221","","0.0545","0.0541","","","","1.146","1.166","1.166","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322261","7.8326","0.001","8.008","0.001","15.5072","0.001","79.839","0.01","85.097","0.01","74.14","0.01","920.25","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H32 Fe N14 S2 -","- C36 H32 Fe N14 S2 -","- C36 H32 Fe N14 S2 -","1","0.5","","Loreto Ballester; Angel Gutiérrez; M. Felisa Perpiñán; Susana Rico; M. Teresa Azcondo; Carlo Bellitto","Magnetic Behavior and Crystal Structure of [Fe(cyclam)(NCS)2](TCNQ)2: An Unusual One-Dimensional (TCNQ)2-Radical-Ion System","Inorganic Chemistry","1999","38","","4430","4434","10.1021/ic990217y","","","0.71073","MoKα","","0.0906","0.0344","","0.1035","0.0881","","","","1.063","1.1","1.1","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322262","21.3967","0.0013","18.3406","0.0011","20.0887","0.0013","90","","115.877","0.001","90","","7092.9","0.8","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H36 F18 In2 O6 -","- C24 H36 F18 In2 O6 -","- C192 H288 F144 In16 O48 -","8","1","","Liliana A. Mîinea; Seigi Suh; David M. Hoffman","Indium Fluoroalkoxide Compounds","Inorganic Chemistry","1999","38","","4447","4454","10.1021/ic990315j","","","0.71073","MoKα","","0.0631","0.056","","","0.1384","0.1444","","","","","","1.052","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322263","9.6785","0.0006","10.8725","0.0006","19.4295","0.0011","79.394","0.001","89.845","0.001","78.846","0.001","1970.5","0.2","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H37 F24 In N2 O5 -","- C24 H27 F24 In N2 O5 -","- C48 H54 F48 In2 N4 O10 -","2","1","","Liliana A. Mîinea; Seigi Suh; David M. Hoffman","Indium Fluoroalkoxide Compounds","Inorganic Chemistry","1999","38","","4447","4454","10.1021/ic990315j","","","0.71073","MoKα","","0.0365","0.0301","","","0.0784","0.0913","","","","","","1.182","","","","has coordinates","189895","2020-10-21","18:00:00",""
"4322264","14.7601","0.001","11.3221","0.0008","17.8837","0.0012","90","","112.893","0.001","90","","2753.2","0.3","223","2","223","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H22 F18 In N O3 -","- C18 H22 F18 In N O3 -","- C72 H88 F72 In4 N4 O12 -","4","1","","Liliana A. Mîinea; Seigi Suh; David M. Hoffman","Indium Fluoroalkoxide Compounds","Inorganic Chemistry","1999","38","","4447","4454","10.1021/ic990315j","","","0.71073","MoKα","","0.0241","0.0208","","","0.0513","0.0543","","","","","","1.068","","","","has coordinates","189895","2020-10-21","18:00:00",""
"4322265","11.9987","0.0006","19.7512","0.0009","20.2069","0.0009","90","","101.747","0.001","90","","4688.5","0.4","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C43 H67 N8 Y -","- C43 H67 N8 Y -","- C172 H268 N32 Y4 -","4","1","","Dirk Pfeiffer; Bhekumusa J. Ximba; Louise M. Liable-Sands; Arnold L. Rheingold; Mary Jane Heeg; David M. Coleman; H. Bernhard Schlegel; Thomas F. Kuech; Charles H. Winter","Synthesis, Structure, and Molecular Orbital Studies of Yttrium, Erbium, and Lutetium Complexes Bearing η2-Pyrazolato Ligands: Development of a New Class of Precursors for Doping Semiconductors","Inorganic Chemistry","1999","38","","4539","4548","10.1021/ic990319o","","","0.71073","MoKα","","0.1145","0.0662","","0.147","0.1282","","","","1.012","1.129","1.129","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322266","9.8446","0.0004","24.4973","0.0013","22.1925","0.0012","90","","94","0.01","90","","5339","0.5","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C47 H81 Er N10 -","- C47 H81 Er N10 -","- C188 H324 Er4 N40 -","4","1","","Dirk Pfeiffer; Bhekumusa J. Ximba; Louise M. Liable-Sands; Arnold L. Rheingold; Mary Jane Heeg; David M. Coleman; H. Bernhard Schlegel; Thomas F. Kuech; Charles H. Winter","Synthesis, Structure, and Molecular Orbital Studies of Yttrium, Erbium, and Lutetium Complexes Bearing η2-Pyrazolato Ligands: Development of a New Class of Precursors for Doping Semiconductors","Inorganic Chemistry","1999","38","","4539","4548","10.1021/ic990319o","","","0.71073","MoKα","","0.1368","0.0451","","0.1005","0.0796","","","","0.787","1.046","1.046","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322267","19.052","0.001","21.658","0.001","26.677","0.001","90","","90","","90","","11007.7","0.9","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C51 H83 Lu N8 -","- C51 H83 Lu N8 -","- C408 H664 Lu8 N64 -","8","1","","Dirk Pfeiffer; Bhekumusa J. Ximba; Louise M. Liable-Sands; Arnold L. Rheingold; Mary Jane Heeg; David M. Coleman; H. Bernhard Schlegel; Thomas F. Kuech; Charles H. Winter","Synthesis, Structure, and Molecular Orbital Studies of Yttrium, Erbium, and Lutetium Complexes Bearing η2-Pyrazolato Ligands: Development of a New Class of Precursors for Doping Semiconductors","Inorganic Chemistry","1999","38","","4539","4548","10.1021/ic990319o","","","0.71073","MoKα","","0.0828","0.0489","","0.1115","0.0979","","","","1.094","1.161","1.161","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322268","19.027","0.0006","21.5576","0.0008","26.6172","0.0009","90","","90","","90","","10917.7","0.6","219","2","219","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C51 H83 Er N8 -","- C51 H83 Er N8 -","- C408 H664 Er8 N64 -","8","1","","Dirk Pfeiffer; Bhekumusa J. Ximba; Louise M. Liable-Sands; Arnold L. Rheingold; Mary Jane Heeg; David M. Coleman; H. Bernhard Schlegel; Thomas F. Kuech; Charles H. Winter","Synthesis, Structure, and Molecular Orbital Studies of Yttrium, Erbium, and Lutetium Complexes Bearing η2-Pyrazolato Ligands: Development of a New Class of Precursors for Doping Semiconductors","Inorganic Chemistry","1999","38","","4539","4548","10.1021/ic990319o","","","0.71073","MoKα","","0.0433","0.0309","","0.1002","0.0881","","","","2.169","2.173","2.173","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322269","20.9714","0.0003","10.6371","0.0002","22.1332","0.0001","90","","93.397","0.001","90","","4928.69","0.12","218","2","218","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H77 Er N8 -","- C44 H77 Er N8 -","- C176 H308 Er4 N32 -","4","1","","Dirk Pfeiffer; Bhekumusa J. Ximba; Louise M. Liable-Sands; Arnold L. Rheingold; Mary Jane Heeg; David M. Coleman; H. Bernhard Schlegel; Thomas F. Kuech; Charles H. Winter","Synthesis, Structure, and Molecular Orbital Studies of Yttrium, Erbium, and Lutetium Complexes Bearing η2-Pyrazolato Ligands: Development of a New Class of Precursors for Doping Semiconductors","Inorganic Chemistry","1999","38","","4539","4548","10.1021/ic990319o","","","0.71073","MoKα","","0.0371","0.0298","","0.0848","0.0808","","","","1.689","1.759","1.759","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322270","11.9169","0.0001","19.573","0.0002","20.1065","0.0002","90","","101.791","0.0007","90","","4590.87","0.08","218","2","218","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C43 H67 Er N8 -","- C43 H67 Er N8 -","- C172 H268 Er4 N32 -","4","1","","Dirk Pfeiffer; Bhekumusa J. Ximba; Louise M. Liable-Sands; Arnold L. Rheingold; Mary Jane Heeg; David M. Coleman; H. Bernhard Schlegel; Thomas F. Kuech; Charles H. Winter","Synthesis, Structure, and Molecular Orbital Studies of Yttrium, Erbium, and Lutetium Complexes Bearing η2-Pyrazolato Ligands: Development of a New Class of Precursors for Doping Semiconductors","Inorganic Chemistry","1999","38","","4539","4548","10.1021/ic990319o","","","0.71073","MoKα","","0.1231","0.051","","","0.085","0.1044","","","","","","0.982","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322271","13.6404","0.0003","13.6404","0.0003","19.1118","0.0004","90","","90","","90","","3555.95","0.13","218","2","218","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","","- C33 H47 Er N8 -","- C33 H47 Er N8 -","- C132 H188 Er4 N32 -","4","0.5","","Dirk Pfeiffer; Bhekumusa J. Ximba; Louise M. Liable-Sands; Arnold L. Rheingold; Mary Jane Heeg; David M. Coleman; H. Bernhard Schlegel; Thomas F. Kuech; Charles H. Winter","Synthesis, Structure, and Molecular Orbital Studies of Yttrium, Erbium, and Lutetium Complexes Bearing η2-Pyrazolato Ligands: Development of a New Class of Precursors for Doping Semiconductors","Inorganic Chemistry","1999","38","","4539","4548","10.1021/ic990319o","","","0.71073","MoKα","","0.0392","0.0269","","0.0831","0.0501","","","","0.88","0.889","0.889","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322272","10.5218","0.0003","12.1113","0.0004","22.0125","0.0007","90","","97.99","","90","","2777.88","0.15","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H16 Cu Mo4 N4 O13 -","- C24 H16 Cu Mo4 N4 O13 -","- C96 H64 Cu4 Mo16 N16 O52 -","4","1","","Pamela J. Hagrman; Jon Zubieta","Solid-State Coordination Chemistry of Metal Oxides: Hydrothermal Synthesis and Structural Characterization of o-Phenanthroline-Ligated Copper- and Zinc-Molybdenum Oxides","Inorganic Chemistry","1999","38","","4480","4485","10.1021/ic990340p","","","0.71073","MoKα","","0.095","0.0622","","0.1617","0.1484","","","","0.958","1.127","1.127","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322273","14.05","0.001","5.8818","0.0004","16.2268","0.0011","90","","103.586","0.001","90","","1303.45","0.16","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H10 Cu Mo N2 O5 -","- C12 H8 Cu Mo N2 O5 -","- C48 H32 Cu4 Mo4 N8 O20 -","4","1","","Pamela J. Hagrman; Jon Zubieta","Solid-State Coordination Chemistry of Metal Oxides: Hydrothermal Synthesis and Structural Characterization of o-Phenanthroline-Ligated Copper- and Zinc-Molybdenum Oxides","Inorganic Chemistry","1999","38","","4480","4485","10.1021/ic990340p","","","0.71073","MoKα","","0.1101","0.0753","","","0.1845","0.2054","","","","","","1.021","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322274","8.7714","0.0007","6.4172","0.0002","10.6524","0.001","90","","100.702","0.005","90","","589.17","0.08","120","2","120","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C12 H8 Mo N2 O4 Zn -","- C12 H8 Mo N2 O4 Zn -","- C24 H16 Mo2 N4 O8 Zn2 -","2","0.5","","Pamela J. Hagrman; Jon Zubieta","Solid-State Coordination Chemistry of Metal Oxides: Hydrothermal Synthesis and Structural Characterization of o-Phenanthroline-Ligated Copper- and Zinc-Molybdenum Oxides","Inorganic Chemistry","1999","38","","4480","4485","10.1021/ic990340p","","","0.71073","MoKα","","0.0209","0.019","","0.0485","0.0479","","","","1.092","1.124","1.124","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322275","24.837","0.016","7.327","0.006","31.521","0.02","90","","111.06","0.1","90","","5353","7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H28 N P2 S2 Tc -","- C28 H28 N P2 S2 Tc -","- C224 H224 N8 P16 S16 Tc8 -","8","1","","Cristina Bolzati; Alessandra Boschi; Licia Uccelli; Erica Malagò; Giuliano Bandoli; Francesco Tisato; Fiorenzo Refosco; Roberto Pasqualini; Adriano Duatti","Synthesis of a Novel Class of trigonal Bipyramidal Nitrido Tc(V) Complexes with Phosphino-Thiol Ligands. Crystal Structure of [99gTc(N)(L1)2] [L1= 2-(Diphenylphosphino)ethanethiolato] and [99gTc(N)(L5)2] [L5= 2-(Ditolylphosphino)propanethiolato]","Inorganic Chemistry","1999","38","","4473","4479","10.1021/ic9903477","","","0.71073","MoKα","","0.075","0.0572","","0.1532","0.1404","","","","1.06","1.112","1.112","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322276","11.0899","0.0012","14.3874","0.0015","11.0872","0.0013","90","","113.615","0.008","90","","1620.9","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H40 N P2 S2 Tc -","- C34 N2 P2 S2 Tc -","- C68 N4 P4 S4 Tc2 -","2","0.5","","Cristina Bolzati; Alessandra Boschi; Licia Uccelli; Erica Malagò; Giuliano Bandoli; Francesco Tisato; Fiorenzo Refosco; Roberto Pasqualini; Adriano Duatti","Synthesis of a Novel Class of trigonal Bipyramidal Nitrido Tc(V) Complexes with Phosphino-Thiol Ligands. Crystal Structure of [99gTc(N)(L1)2] [L1= 2-(Diphenylphosphino)ethanethiolato] and [99gTc(N)(L5)2] [L5= 2-(Ditolylphosphino)propanethiolato]","Inorganic Chemistry","1999","38","","4473","4479","10.1021/ic9903477","","","0.71073","MoKα","","0.0763","0.0603","","0.1802","0.1646","","","","1.066","1.106","1.106","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322277","9.271","0.001","9.271","0.001","35.985","0.009","90","","90","","120","","2678.6","0.8","293","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- K2 Mo9 S11 -","- K2 Mo9 S11 -","- K12 Mo54 S66 -","6","0.166667","","Soazig Picard; Patrick Gougeon; Michel Potel","Synthesis, Structural Evolution, and Theoretical and Physical Studies of the Novel Compounds M2Mo9S11 (M = K, Rb) and Related Metastable Materials CuxK1.8Mo9S11 (x = 0 or 2) Containing Bioctahedral Mo9 Clusters","Inorganic Chemistry","1999","38","","4422","4429","10.1021/ic990362b","","x-ray","0.71073","MoKα","","0.0237","0.0186","","0.0208","0.0207","","","","2.04","2.14","2.14","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322278","9.356","0.002","9.356","0.002","35.935","0.009","90","","90","","120","","2724.1","1.1","293","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- Mo9 Rb2 S11 -","- Mo9 Rb2 S11 -","- Mo54 Rb12 S66 -","6","0.166667","","Soazig Picard; Patrick Gougeon; Michel Potel","Synthesis, Structural Evolution, and Theoretical and Physical Studies of the Novel Compounds M2Mo9S11 (M = K, Rb) and Related Metastable Materials CuxK1.8Mo9S11 (x = 0 or 2) Containing Bioctahedral Mo9 Clusters","Inorganic Chemistry","1999","38","","4422","4429","10.1021/ic990362b","","x-ray","0.71073","MoKα","","0.0679","0.0368","","0.0394","0.0379","","","","1.55","1.76","1.76","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322279","9.4215","0.0004","9.4215","0.0004","35.444","0.002","90","","90","","120","","2724.7","0.2","293","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","","","- Cu2 K1.8 Mo9 S11 -","- Cu2.04 K1.777 Mo9 S11 -","- Cu12.24 K10.662 Mo54 S66 -","6","0.166667","","Soazig Picard; Patrick Gougeon; Michel Potel","Synthesis, Structural Evolution, and Theoretical and Physical Studies of the Novel Compounds M2Mo9S11 (M = K, Rb) and Related Metastable Materials CuxK1.8Mo9S11 (x = 0 or 2) Containing Bioctahedral Mo9 Clusters","Inorganic Chemistry","1999","38","","4422","4429","10.1021/ic990362b","","x-ray","0.71073","MoKα","","0.0453","0.0238","","0.0222","0.0213","","","","1.42","1.56","1.56","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322280","9.2801","0.0008","9.2801","0.0008","35.833","0.007","90","","90","","120","","2672.5","0.6","293","","","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","","- K2 Mo9 S11 -","- K1.776 Mo9 S11 -","- K10.656 Mo54 S66 -","6","0.166667","","Soazig Picard; Patrick Gougeon; Michel Potel","Synthesis, Structural Evolution, and Theoretical and Physical Studies of the Novel Compounds M2Mo9S11 (M = K, Rb) and Related Metastable Materials CuxK1.8Mo9S11 (x = 0 or 2) Containing Bioctahedral Mo9 Clusters","Inorganic Chemistry","1999","38","","4422","4429","10.1021/ic990362b","","x-ray","0.71073","MoKα","","0.0455","0.0219","","0.0223","0.0215","","","","1.71","1.96","1.96","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322281","10.7156","0.0002","23.1049","0.0001","19.8373","0.0003","90","","98.829","0.001","90","","4853.18","0.12","157","2","157","2","","","","","","","synthetic","6","P 1 21/n 1","-P 2yn","14","Ferric Macrobicyclic TRENSAM","","","- C36 H39 Br4 Fe2 N8 O9 -","- C46.79 H54 Br Fe N10 O11.71 -","- C187.16 H216 Br4 Fe4 N40 O46.84 -","4","1","","Seth M. Cohen; Stéphane Petoud; Kenneth N. Raymond","A Novel Salicylate-Based Macrobicycle with a ""Split Personality""","Inorganic Chemistry","1999","38","","4522","4529","10.1021/ic990411k","","","0.71073","MoKα","","0.0886","0.059","","0.1474","0.1278","","","","1.133","1.15","1.15","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322282","11.1144","0.0002","22.8382","0.0004","19.4525","0.0004","90","","99.247","0.001","90","","4873.52","0.16","137","2","137","2","","","","","","","synthetic","6","P 1 21/n 1","-P 2yn","14","Gallium Macrobicyclic TRENSAM","","","- C46 H62 Cl Ga N10 O15.3 -","- C46 H62 Cl Ga N10 O15.3 -","- C184 H248 Cl4 Ga4 N40 O61.2 -","4","1","","Seth M. Cohen; Stéphane Petoud; Kenneth N. Raymond","A Novel Salicylate-Based Macrobicycle with a ""Split Personality""","Inorganic Chemistry","1999","38","","4522","4529","10.1021/ic990411k","","","0.71073","MoKα","","0.0758","0.0573","","0.1551","0.1414","","","","1.111","1.141","1.141","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322283","12.0203","0.0004","12.6996","0.0004","24.6435","0.0008","83.146","0.001","88.531","0.001","85.282","0.001","3721.9","0.2","171","2","171","2","","","","","","","synthetic","5","P -1","-P 1","2","Ferric TRENIAM","Ferric(III)[tris(2-hydroxyisophthalylmethylamide)-2-aminoethyl]amine","","- C35.5 H41 Fe N7 O10 -","- C35.5 H41 Fe N7 O10 -","- C142 H164 Fe4 N28 O40 -","4","2","","Seth M. Cohen; Stéphane Petoud; Kenneth N. Raymond","A Novel Salicylate-Based Macrobicycle with a ""Split Personality""","Inorganic Chemistry","1999","38","","4522","4529","10.1021/ic990411k","","","0.71073","MoKα","","0.0758","0.0568","","0.1487","0.1264","","","","1.156","1.097","1.097","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322284","11.978","0.0002","12.6417","0.0003","24.5404","0.0006","83.324","0.001","88.488","0.001","85.038","0.001","3676.43","0.14","185","2","185","2","","","","","","","synthetic","5","P -1","-P 1","2","Gallium TRENIAM","Gallium(III)[tris(2-hydroxyisophthalylmethylamide)-2-aminoethyl]amine","","- C35.35 H41 Ga N7 O10.35 -","- C35.35 H41 Ga N7 O10.35 -","- C141.4 H164 Ga4 N28 O41.4 -","4","2","","Seth M. Cohen; Stéphane Petoud; Kenneth N. Raymond","A Novel Salicylate-Based Macrobicycle with a ""Split Personality""","Inorganic Chemistry","1999","38","","4522","4529","10.1021/ic990411k","","","0.71073","MoKα","","0.1319","0.0752","","0.1795","0.1486","","","","1.083","1.153","1.153","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322285","64.12","0.03","9.195","0.004","17.28","0.02","90","","93.63","0.05","90","","10168","13","296.2","","296.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C16 H38 Mo P2 S4 -","- C16 H38 Mo P2 S4 -","- C256 H608 Mo16 P32 S64 -","16","2","","Yasuhiro Arikawa; Hiroyuki Kawaguchi; Kazuo Kashiwabara; Kazuyuki Tatsumi","Synthesis of Bis{(2-dimethylphosphino)ethane-1-thiolato}bis(tert-butylthiolato)- molybdenum(IV) and Its Cluster-Forming Reactions with FeCl2 and CuBr","Inorganic Chemistry","1999","38","","4549","4553","10.1021/ic990435r","","","0.7107","MoKα","","0.0727","0.0581","","","0.0697","0.0737","","","","","","1.383","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322286","14.74","0.002","13.778","0.002","19.537","0.002","90","","97.713","0.01","90","","3931.8","0.9","296.2","","296.2","","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C18 H44 Cl6 Fe Mo2 O2 P4 S4 -","- C18 H44 Cl6 Fe Mo2 O2 P4 S4 -","- C72 H176 Cl24 Fe4 Mo8 O8 P16 S16 -","4","0.5","","Yasuhiro Arikawa; Hiroyuki Kawaguchi; Kazuo Kashiwabara; Kazuyuki Tatsumi","Synthesis of Bis{(2-dimethylphosphino)ethane-1-thiolato}bis(tert-butylthiolato)- molybdenum(IV) and Its Cluster-Forming Reactions with FeCl2 and CuBr","Inorganic Chemistry","1999","38","","4549","4553","10.1021/ic990435r","","","0.7107","MoKα","","0","0","","","0","0.0538","","","","","","1.107","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322287","16.156","0.008","13.482","0.003","26.102","0.009","90","0.03","100.92","0.03","90","0.03","5582","4","296.2","","296.2","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C31 H73 Br2 Cu4 Mo2 O P4 S8 -","- C31 H58 Br2 Cu4 Mo2 O P4 S8 -","- C124 H232 Br8 Cu16 Mo8 O4 P16 S32 -","4","1","","Yasuhiro Arikawa; Hiroyuki Kawaguchi; Kazuo Kashiwabara; Kazuyuki Tatsumi","Synthesis of Bis{(2-dimethylphosphino)ethane-1-thiolato}bis(tert-butylthiolato)- molybdenum(IV) and Its Cluster-Forming Reactions with FeCl2 and CuBr","Inorganic Chemistry","1999","38","","4549","4553","10.1021/ic990435r","","","0.7107","MoKα","","0.0427","0.0427","","","0.0586","0.0586","","","","","","1.067","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322288","4.521","0.003","4.331","0.003","11.913","0.007","90","","99.668","0.0011","90","","229.9","0.3","293","2","293","2","","","","","","","","3","P 1 21/m 1","-P 2yb","11","Lanthanum Indium Diantimonide","","","- In0.8 La Sb2 -","- In0.812 La Sb2 -","- In1.624 La2 Sb4 -","2","0.5","","Michael J. Ferguson; Robert E. Ellenwood; Arthur Mar","A New Rare-Earth Indium Antimonide, (RE)In1-xSb2 (RE = La-Nd), Featuring In Zigzag Chains and Sb Square Nets","Inorganic Chemistry","1999","38","","4503","4509","10.1021/ic9905244","","","0.71073","MoKα","","0.0555","0.0491","","","0.1282","0.1308","","","","","","1.177","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322289","18.77","0.002","28.113","0.004","16.461","0.003","90","0.01","120.65","0.01","90","0.01","7473","2","153","5","153","5","","","","","","","","5","C 1 2/m 1","-C 2y","12","","(py)8Sm8Se6(SePh)12,3(py)","","- C31.75 H28.75 N2.75 Se4.5 Sm2 -","- C32.3 H28.8 N2.76 Se4.5 Sm2 -","- C258.4 H230.4 N22.08 Se36 Sm16 -","8","1","","Deborah Freedman; Thomas J. Emge; John G. Brennan","(THF)8Ln8E6(EPh)12 Cluster Reactivity: Systematic Control of Ln, E, EPh, and Neutral Donor Ligands","Inorganic Chemistry","1999","38","","4400","4404","10.1021/ic9905493","","","0.71073","MoKα","","0.1216","0.051","","","0.1289","0.1424","","","","","","1.08","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322290","19.803","0.003","22.446","0.003","26.072","0.004","90","0.01","90","0.01","90","0.01","11589","3","153","5","153","5","","","","","","","","6","P c a b","-P 2bc 2ac","61","","(THF)8Sm8S6(SePh)12","","- C52 H62 O4 S3 Se6 Sm4 -","- C52 H62 O4 S3 Se6 Sm4 -","- C416 H496 O32 S24 Se48 Sm32 -","8","1","","Deborah Freedman; Thomas J. Emge; John G. Brennan","(THF)8Ln8E6(EPh)12 Cluster Reactivity: Systematic Control of Ln, E, EPh, and Neutral Donor Ligands","Inorganic Chemistry","1999","38","","4400","4404","10.1021/ic9905493","","","0.71073","MoKα","","0.1063","0.0439","","","0.085","0.093","","","","","","1.029","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322291","17.637","0.007","18.337","0.005","20.466","0.012","103.04","0.04","94.71","0.04","94.28","0.03","6397","5","153","5","153","5","","","","","","","","6","P -1","-P 1","2","","(THF)8Sm8Se6(SPh)12,3(THF)","","- C116 H148 O11 S12 Se6 Sm8 -","- C116 H148 O11 S12 Se6 Sm8 -","- C232 H296 O22 S24 Se12 Sm16 -","2","1","","Deborah Freedman; Thomas J. Emge; John G. Brennan","(THF)8Ln8E6(EPh)12 Cluster Reactivity: Systematic Control of Ln, E, EPh, and Neutral Donor Ligands","Inorganic Chemistry","1999","38","","4400","4404","10.1021/ic9905493","","","0.71073","MoKα","","0.0473","0.0349","","","0.0845","0.0879","","","","","","1.058","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322292","14.336","0.007","9.713","0.004","19.524","0.008","90","","92.71","0.04","90","","2716","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C28 H31 N2 O5 V -","- C28 H31 N2 O5 V -","- C112 H124 N8 O20 V4 -","4","1","","Sankar Prasad Rath; Kajal Krishna Rajak; Animesh Chakravorty","Synthesis, Structure, and Catecholase Reaction of a Vanadate Ester System Incorporating Monoionized Catechol Chelation","Inorganic Chemistry","1999","38","","4376","4377","10.1021/ic990551u","","","0.71073","MoKα","","0.1312","0.0636","","0.1844","0.135","","","","1.046","1.147","1.147","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322293","12.9778","0.0002","13.1556","0.0002","22.3756","0.0002","75.259","0.001","86.892","0.001","70.295","0.001","3476.03","0.09","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C51 H96 Cl3 Cu7 N24 O15 -","- C51 H96 Cl3 Cu7 N24 O15 -","- C102 H192 Cl6 Cu14 N48 O30 -","2","1","","Mi Young Han; Kil Sik Min; Myunghyun Paik Suh","Synthesis and Properties of a Molecular Dumbbell with Bis-μ4-oxo Copper(II/I) Hepta Metal Centers","Inorganic Chemistry","1999","38","","4374","4375","10.1021/ic990555z","","","0.71073","MoKα","","0.0726","0.0554","","","0.1265","0.1382","","","","","","1.076","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322294","12.236","0.002","14.419","0.002","22.748","0.004","76.441","0.013","75.981","0.015","70.978","0.012","3628","1.1","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C85 H70 N4 O4 P4 S W -","- C85 H70 N4 O4 P4 S W -","- C170 H140 N8 O8 P8 S2 W2 -","2","1","","Donald J. Darensbourg; Jennifer D. Draper; Brian J. Frost; Joseph H. Reibenspies","Structural and Spectroscopic Studies of 16-Electron, Unsaturated Derivatives of Low-Valent, Group 6 Carbonyl Complexes Containing π-Donor Ligands","Inorganic Chemistry","1999","38","","4705","4714","10.1021/ic9804216","","","0.71073","MoKa","","0.1336","0.0713","","0.1672","0.1357","","","","1.017","1.057","1.057","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322295","11.5823","0.0011","10.7906","0.0012","10.4487","0.001","90","","100.867","0.007","90","","1282.5","0.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 O4 P2 W -","- C10 H8 O4 P2 W -","- C40 H32 O16 P8 W4 -","4","1","","Donald J. Darensbourg; Jennifer D. Draper; Brian J. Frost; Joseph H. Reibenspies","Structural and Spectroscopic Studies of 16-Electron, Unsaturated Derivatives of Low-Valent, Group 6 Carbonyl Complexes Containing π-Donor Ligands","Inorganic Chemistry","1999","38","","4705","4714","10.1021/ic9804216","","","0.71073","MoKα","","0.0542","0.0427","","0.1141","0.1064","","","","1.026","1.063","1.063","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322296","11.054","0.002","28.14","0.006","12.566","0.002","90","","90.583","0.01","90","","3908.6","1.3","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C89 H76 N7 O3 P4 S W -","- C89 H77 N7 O3 P4 S W -","- C178 H154 N14 O6 P8 S2 W2 -","2","1","","Donald J. Darensbourg; Jennifer D. Draper; Brian J. Frost; Joseph H. Reibenspies","Structural and Spectroscopic Studies of 16-Electron, Unsaturated Derivatives of Low-Valent, Group 6 Carbonyl Complexes Containing π-Donor Ligands","Inorganic Chemistry","1999","38","","4705","4714","10.1021/ic9804216","","","0.71073","MoKα","","0.0471","0.0362","","0.0975","0.0854","","","","1.051","1.031","1.031","","","","","has coordinates","255805","2020-10-21","18:00:00",""
"4322297","12.6497","0.001","14.8095","0.0013","21.053","0.002","77.182","0.007","78.334","0.007","66.579","0.007","3500.1","0.6","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C82 H64 N2 O4 P4 S2 W -","- C82 H64 N2 O4 P4 S2 W -","- C164 H128 N4 O8 P8 S4 W2 -","2","1","","Donald J. Darensbourg; Jennifer D. Draper; Brian J. Frost; Joseph H. Reibenspies","Structural and Spectroscopic Studies of 16-Electron, Unsaturated Derivatives of Low-Valent, Group 6 Carbonyl Complexes Containing π-Donor Ligands","Inorganic Chemistry","1999","38","","4705","4714","10.1021/ic9804216","","","0.71073","MoKα","","0.0459","0.0346","","0.0903","0.0819","","","","1.07","1.055","1.055","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322298","13.869","0.003","23.128","0.005","12.056","0.002","104.84","0.03","106.91","0.03","95.29","0.03","3517.9","1.6","193","2","193","2","","","","","","","","7","P -1","-P 1","2","","","","- C84 H68 Cr N3 O5 P4 S -","- C83.82 H64 Cr N3 O4.72 P4 S -","- C167.64 H128 Cr2 N6 O9.44 P8 S2 -","2","1","","Donald J. Darensbourg; Jennifer D. Draper; Brian J. Frost; Joseph H. Reibenspies","Structural and Spectroscopic Studies of 16-Electron, Unsaturated Derivatives of Low-Valent, Group 6 Carbonyl Complexes Containing π-Donor Ligands","Inorganic Chemistry","1999","38","","4705","4714","10.1021/ic9804216","","","0.71073","MoKα","","0.2001","0.0815","","0.2404","0.1878","","","","1.003","1.159","1.159","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322299","10.853","0.002","10.976","0.001","21.641","0.003","103.58","0.01","95.55","0.01","101.42","0.01","2428.3","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C54 H45 Nb O P2 S5 -","- C54 H45 Nb O P2 S5 -","- C108 H90 Nb2 O2 P4 S10 -","2","1","","Jung Woo Park; Sang Man Koo","Monomeric Niobium Persulfide Complexes: The Synthesis and Structural Characterization of Pentagonal-Pyramidal [Ph4P]2[Nb(E)(S2)2(SPh)] (E = O, S) Complexes","Inorganic Chemistry","1999","38","","4898","4900","10.1021/ic981328k","","","0.71069","MoKα","","0.0494","0.0417","","0.1001","0.0964","","","","1.126","1.175","1.175","","","","","has coordinates","179325","2020-10-21","18:00:00",""
"4322300","10.821","0.005","21.559","0.008","21.273","0.007","90","","94.23","0.03","90","","4949","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H45 Nb P2 S6 -","- C54 H45 Nb P2 S6 -","- C216 H180 Nb4 P8 S24 -","4","1","","Jung Woo Park; Sang Man Koo","Monomeric Niobium Persulfide Complexes: The Synthesis and Structural Characterization of Pentagonal-Pyramidal [Ph4P]2[Nb(E)(S2)2(SPh)] (E = O, S) Complexes","Inorganic Chemistry","1999","38","","4898","4900","10.1021/ic981328k","","","0.71073","MoKα","","0.1384","0.0646","","0.176","0.135","","","","1.06","1.156","1.156","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322301","10.118","0.01","11.086","0.014","11.205","0.003","94.15","0.04","105.62","0.05","113.88","0.06","1083.1","1.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C52 H50 Fe N6 -","- C52 H50 Fe N6 -","- C52 H50 Fe N6 -","1","0.5","","Orde Q. Munro; P. Sizwe Madlala; Richard A. F. Warby; Takele B. Seda; Giovanni Hearne","Structural, Conformational, and Spectroscopic Studies of Primary Amine Complexes of Iron(II) Porphyrins","Inorganic Chemistry","1999","38","","4724","4736","10.1021/ic990178q","","","0.71069","MoKα","","0.0541","0.0401","","","0.0985","0.1108","","","","","","1.094","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322302","11.742","0.005","12.348","0.006","17.404","0.004","97.69","0.03","101.97","0.03","112.16","0.04","2222.7","1.8","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C58 H46 Fe N6 -","- C58 H46 Fe N6 -","- C116 H92 Fe2 N12 -","2","1","","Orde Q. Munro; P. Sizwe Madlala; Richard A. F. Warby; Takele B. Seda; Giovanni Hearne","Structural, Conformational, and Spectroscopic Studies of Primary Amine Complexes of Iron(II) Porphyrins","Inorganic Chemistry","1999","38","","4724","4736","10.1021/ic990178q","","","0.71069","MoKα","","0.071","0.0436","","","0.1004","0.1226","","","","","","1.078","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322303","10.9625","0.0016","11.203","0.003","11.299","0.004","75.23","0.03","89.12","0.02","60.419","0.017","1156.8","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H50 Fe N6 -","- C60 H50 Fe N6 -","- C60 H50 Fe N6 -","1","0.5","","Orde Q. Munro; P. Sizwe Madlala; Richard A. F. Warby; Takele B. Seda; Giovanni Hearne","Structural, Conformational, and Spectroscopic Studies of Primary Amine Complexes of Iron(II) Porphyrins","Inorganic Chemistry","1999","38","","4724","4736","10.1021/ic990178q","","","0.71069","MoKα","","0.0405","0.0319","","","0.0806","0.089","","","","","","1.13","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322304","12.2303","0.0008","6.764","0.0004","17.866","0.001","90.493","0.006","94.133","0.006","91.163","0.006","1473.76","0.15","293","2","","","","","","","","","","3","P -1","-P 1","2","","","","- Bi4 P6 Se18 -","- Bi4 P6 Se18 -","- Bi8 P12 Se36 -","2","1","","Jennifer A. Aitken; Shannon Brown; Konstantinos Chondroudis; Stéphane Jobic; Raymond Brec; Mercouri G. Kanatzidis","β-Bi4(P2Se6)3: A New Ternary Selenophosphate Obtained in a P2Se5 Flux","Inorganic Chemistry","1999","38","","4795","4800","10.1021/ic990180h","","x-ray","0.71073","MoKα","","0.0396","0.0396","","0.0427","0.0427","","","","0.71","0.71","0.71","","","","","has coordinates,has Fobs","179326","2020-10-21","18:00:00",""
"4322305","12.09","0.006","6.433","0.005","15.731","0.006","90","","99.3","0.02","90","","1207.4","1.2","295","2","295","2","","","","","","","chemical synthesis","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H4 I2 S5 -","- C5 H4 I2 S5 -","- C20 H16 I8 S20 -","4","1","","Francesco Bigoli; Paola Deplano; Andrea Ienco; Carlo Mealli; Maria Laura Mercuri; Maria Angela Pellinghelli; Gloria Pintus; Giuseppe Saba; Emanuele F. Trogu","Structure and Bonding of Diiodine Adducts of the Sulfur-Rich Donors 1,3-Dithiacyclohexane-2-thione (ptc) and 4,5-Ethylenedithio-1,3-dithiole-2-thione (ttb)","Inorganic Chemistry","1999","38","","4626","4636","10.1021/ic9901867","","","0.71073","MoKa","","0.0784","0.0419","","0.1471","0.1016","","","","1.227","1.046","1.046","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322306","8.691","0.006","9.01","0.006","13.237","0.005","90","","103.43","0.02","90","","1008.2","1","295","2","295","2","","","","","","","chemical synthesis","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H6 I2 S3 -","- C4 H6 I2 S3 -","- C16 H24 I8 S12 -","4","1","","Francesco Bigoli; Paola Deplano; Andrea Ienco; Carlo Mealli; Maria Laura Mercuri; Maria Angela Pellinghelli; Gloria Pintus; Giuseppe Saba; Emanuele F. Trogu","Structure and Bonding of Diiodine Adducts of the Sulfur-Rich Donors 1,3-Dithiacyclohexane-2-thione (ptc) and 4,5-Ethylenedithio-1,3-dithiole-2-thione (ttb)","Inorganic Chemistry","1999","38","","4626","4636","10.1021/ic9901867","","","0.71073","MoKar","","0.0681","0.0305","","0.0661","0.0611","","","","0.775","0.9","0.9","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322307","17.755","0.016","13.62","0.004","13.832","0.017","90","","100.04","0.05","90","","3294","5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H32 Fe N9 O2 S4 -","- C26 H32 Fe N9 O2 S4 -","- C104 H128 Fe4 N36 O8 S16 -","4","0.5","","Mohammed Fettouhi; Mohammed Morsy; Abdel Waheed; Stéphane Golhen; Lahcène Ouahab; Jean-Pascal Sutter; Olivier Kahn; Nieves Menendez; François Varret","Spin-Crossover in the Complex Bis(cis-1,2-dicyano-1,2-ethylenedithiolato) [2-(p-pyridyl)-4,4,5,5-tetramethylimidazolinium]iron(III)","Inorganic Chemistry","1999","38","","4910","4912","10.1021/ic990299q","","","0.71073","MoKα","","0.1785","0.0542","","","0.103","0.1288","","","","","","0.984","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322308","22.25","0.005","11.245","0.003","19.089","0.004","90","","96.59","0.02","90","","4744.5","1.9","295","","295","","","","","","","","chemical synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H40 As2 Cl4 O4 Re -","- C50 H40 As2 Cl4 O4 Re -","- C200 H160 As8 Cl16 O16 Re4 -","4","1","","Raúl Chiozzone; Ricardo González; Carlos Kremer; Giovanni De Munno; Joan Cano; Francesc Lloret; Miguel Julve; Juan Faus","Synthesis, Crystal Structure, and Magnetic Properties of Tetraphenylarsonium Tetrachloro(oxalato)rhenate(IV) and Bis(2,2'-bipyridine)tetrachloro(μ-oxalato)copper(II)rhenium(IV)","Inorganic Chemistry","1999","38","","4745","4752","10.1021/ic990376h","","","0.71073","MoKα","","4.69","3.43","","5.33","4.89","","","","","1.34","1.34","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322309","9.421","0.002","16.909","0.004","16.179","0.004","90","","93.97","0.02","90","","2571.1","1","295","","295","","","","","","","","chemical synthesis","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 Cl4 Cu N4 O4 Re -","- C22 H17 Cl4 Cu N4 O4 Re -","- C88 H68 Cl16 Cu4 N16 O16 Re4 -","4","1","","Raúl Chiozzone; Ricardo González; Carlos Kremer; Giovanni De Munno; Joan Cano; Francesc Lloret; Miguel Julve; Juan Faus","Synthesis, Crystal Structure, and Magnetic Properties of Tetraphenylarsonium Tetrachloro(oxalato)rhenate(IV) and Bis(2,2'-bipyridine)tetrachloro(μ-oxalato)copper(II)rhenium(IV)","Inorganic Chemistry","1999","38","","4745","4752","10.1021/ic990376h","","","0.71073","MoKα","","5.31","4.37","","6.13","6.52","","","","","1.54","1.54","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322310","15.289","0.002","15.289","0.002","15.289","0.002","90","","90","","90","","3573.9","0.8","295","","295","","","","","","","","?","7","P 21 3","P 2ac 2ab 3","198","","","","- C36 H26 Cr Li N6 O13 Ru -","- C36 H24 Cr Li N6 O13 Ru -","- C144 H96 Cr4 Li4 N24 O52 Ru4 -","4","0.333333","","Román Andrés; Michel Gruselle; Bernard Malézieux; Michel Verdaguer; Jacqueline Vaissermann","Enantioselective Synthesis of Optically Active Polymeric Homo- and Bimetallic Oxalate-Bridged Networks [M2(ox)3]n","Inorganic Chemistry","1999","38","","4637","4646","10.1021/ic9904135","","","0.71069","MoKα","","","0.0305","","","0.0351","","","","","1.1143","1.1143","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322311","15.38","0.005","15.38","0.005","15.38","0.005","90","","90","","90","","3638","2","295","","295","","","","","","","","?","7","P 21 3","P 2ac 2ab 3","198","","","","- C36 H26 Cr Li N6 Ni O13 -","- C36 H24 Cr Li N6 Ni O13 -","- C144 H96 Cr4 Li4 N24 Ni4 O52 -","4","0.333333","","Román Andrés; Michel Gruselle; Bernard Malézieux; Michel Verdaguer; Jacqueline Vaissermann","Enantioselective Synthesis of Optically Active Polymeric Homo- and Bimetallic Oxalate-Bridged Networks [M2(ox)3]n","Inorganic Chemistry","1999","38","","4637","4646","10.1021/ic9904135","","","0.71069","MoKα","","","0.0476","","","0.0578","","","","","0.9549","0.9549","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322312","9.3243","0.0004","10.9036","0.0005","15.5432","0.0004","90.276","0.002","100.009","0.002","94.139","0.002","1551.9","0.11","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H22 Cu2 N6 O9 S2 -","- C28 H16 Cu2 N6 O9 S2 -","- C56 H32 Cu4 N12 O18 S4 -","2","1","","Isabel Castro; María Luisa Calatayud; Jorunn Sletten; Francesc Lloret; Juan Cano; Miguel Julve; Gunther Seitz; Klaus Mann","Ferro- and Antiferromagnetic Coupling through 1,n-Dithiosquarate Bridges (n= 2, 3) in Copper(II) Dimers. Syntheses, Crystal Structures, and Magnetic Properties of [Cu2(bpca)2(1,2-dtsq)(H2O)].2H2O and [Cu2(bpca)2(1,3-dtsq)].2H2O","Inorganic Chemistry","1999","38","","4680","4687","10.1021/ic9904384","","","0.71073","MoKα","","0.1062","0.0662","","0.1854","0.1612","","","","1.014","1.106","1.106","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322313","7.656","0.002","9.351","0.003","11.587","0.002","109.02","0.02","97.4","0.02","110.27","0.02","707.8","0.4","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H20 Cu2 N6 O8 S2 -","- C28 H16 Cu2 N6 O7.98 S2 -","- C28 H16 Cu2 N6 O7.98 S2 -","1","0.5","","Isabel Castro; María Luisa Calatayud; Jorunn Sletten; Francesc Lloret; Juan Cano; Miguel Julve; Gunther Seitz; Klaus Mann","Ferro- and Antiferromagnetic Coupling through 1,n-Dithiosquarate Bridges (n= 2, 3) in Copper(II) Dimers. Syntheses, Crystal Structures, and Magnetic Properties of [Cu2(bpca)2(1,2-dtsq)(H2O)].2H2O and [Cu2(bpca)2(1,3-dtsq)].2H2O","Inorganic Chemistry","1999","38","","4680","4687","10.1021/ic9904384","","","0.71073","MoKα","","0.1271","0.09","","","0.2133","0.2381","","","","","","1.084","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322314","5.5362","0.0002","12.8676","0.0005","15.4337","0.0005","90","","99.279","0.001","90","","1085.07","0.07","295","","295","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H28 Fe2 N2 O16 P4 -","- C8 H28 Fe2 N2 O16 P4 -","- C16 H56 Fe4 N4 O32 P8 -","2","0.5","","Li-Min Zheng; Hui-Hua Song; Chia-Heir Lin; Sue-Lein Wang; Zheng Hu; Zhi Yu; Xin","[NH3(CH2)4NH3]Fe2[CH3C(OH)(PO3)(PO3H)]2.2H2O: A Novel Iron(II) Diphosphonate with a Supramolecular Open Network Structure","Inorganic Chemistry","1999","38","","4618","4619","10.1021/ic990482j","","","0.71073","MoKα","","0.0341","0.0254","","0.0697","0.0668","","","","1.046","1.102","1.102","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322315","11.03","","11.03","","33.008","","90","","90","","120","","3477.77","","150","","150","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C4 H4 Cl0.67 Fe0.33 N6 O2.67 -","- C12 H12 Cl2 Fe N18 O8 -","- C72 H72 Cl12 Fe6 N108 O48 -","6","0.333333","","Yann Garcia; Olivier Kahn; Louis Rabardel; Benoit Chansou; Lionel Salmon; Jean Pierre Tuchagues","Two-Step Spin Conversion for the Three-Dimensional Compound Tris(4,4'-bis-1,2,4-triazole)iron(II) Diperchlorate","Inorganic Chemistry","1999","38","","4663","4670","10.1021/ic990511q","","","0.71073","MoKα","","","0.0719","","","0.0787","","","","","1.0762","1.0762","","","","","has coordinates","295997","2024-11-19","13:15:41",""
"4322316","10.971","","10.971","","35.517","","90","","90","","120","","3702.2","","260","","260","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C4 H4 Cl0.67 Fe0.33 N6 O2.67 -","- C12 H12 Cl2 Fe N18 O8 -","- C72 H72 Cl12 Fe6 N108 O48 -","6","0.333333","","Yann Garcia; Olivier Kahn; Louis Rabardel; Benoit Chansou; Lionel Salmon; Jean Pierre Tuchagues","Two-Step Spin Conversion for the Three-Dimensional Compound Tris(4,4'-bis-1,2,4-triazole)iron(II) Diperchlorate","Inorganic Chemistry","1999","38","","4663","4670","10.1021/ic990511q","","","0.71073","MoKα","","","0.0401","","","0.0447","","","","","1.1478","1.1478","","","","","has coordinates","295997","2024-11-19","13:15:41",""
"4322317","10.938","","10.938","","34.555","","90","","90","","120","","3580.28","","190","","190","","","","","","","","","6","R -3 :H","-R 3","148","","","","- C4 H4 Cl0.67 Fe0.33 N6 O2.67 -","- C12 H12 Cl2 Fe N18 O8 -","- C72 H72 Cl12 Fe6 N108 O48 -","6","0.333333","","Yann Garcia; Olivier Kahn; Louis Rabardel; Benoit Chansou; Lionel Salmon; Jean Pierre Tuchagues","Two-Step Spin Conversion for the Three-Dimensional Compound Tris(4,4'-bis-1,2,4-triazole)iron(II) Diperchlorate","Inorganic Chemistry","1999","38","","4663","4670","10.1021/ic990511q","","","0.71073","MoKα","","","0.0382","","","0.0418","","","","","1.1236","1.1236","","","","","has coordinates","295997","2024-11-19","13:15:41",""
"4322318","10.6672","0.0019","13.27","0.006","15.363","0.003","93.84","0.02","108.054","0.016","105.69","0.03","1963.4","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H28 F12 Mn N2 O7 P -","- C35 H28 F12 Mn N2 O7 P -","- C70 H56 F24 Mn2 N4 O14 P2 -","2","1","","Corinne Rancurel; Daniel B. Leznoff; Jean-Pascal Sutter; Stéphane Golhen; Lahcène Ouahab; Janis Kliava; Olivier Kahn","Synthesis, Structure, and Magnetism of Mono- and Binuclear Manganese(II) Compounds of Nitronyl Nitroxide Substituted Phosphine Oxides","Inorganic Chemistry","1999","38","","4753","4758","10.1021/ic990527g","","","0.71073","MoKα","","0.1634","0.0697","","","0.192","0.2342","","","","","","1.041","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322319","12.463","0.006","19.315","0.003","17.084","0.009","90","","98.49","0.02","90","","4067","3","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C70 H56 F24 Mn2 N4 O14 P2 -","- C70 H56 F24 Mn2 N4 O14 P2 -","- C140 H112 F48 Mn4 N8 O28 P4 -","2","0.5","","Corinne Rancurel; Daniel B. Leznoff; Jean-Pascal Sutter; Stéphane Golhen; Lahcène Ouahab; Janis Kliava; Olivier Kahn","Synthesis, Structure, and Magnetism of Mono- and Binuclear Manganese(II) Compounds of Nitronyl Nitroxide Substituted Phosphine Oxides","Inorganic Chemistry","1999","38","","4753","4758","10.1021/ic990527g","","","0.71073","MoKα","","0.1706","0.0683","","","0.1775","0.2213","","","","","","1.021","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322320","9.202","0.005","10.888","0.005","11.756","0.005","109.74","0.03","98.28","0.03","96.43","0.03","1080.6","0.9","220","2","220","2","","","","","","","","4","P -1","-P 1","2","","","","- C23.5 H27 Al N4 -","- C23.5 H27 Al N4 -","- C47 H54 Al2 N8 -","2","1","","Karl Hensen; Alexander Lemke; Thorsten Stumpf; Michael Bolte; Holger Fleischer; Colin R. Pulham; Robert O. Gould; Steven Harris","Synthesis and Structural Characterization of (1,4-Dihydropyrid-1-yl)aluminum Complexes","Inorganic Chemistry","1999","38","","4700","4704","10.1021/ic9905695","","","0.71073","MoKα","","0.0736","0.0498","","0.1354","","0.1163","","","1.021","","","1.03","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"4322321","16.3857","0.0002","16.3857","0.0002","13.7272","0.0002","90","","90","","90","","3685.63","0.08","173","","173","","","","","","","","","5","I -4","I -4","82","","","","- C40 H44 Al Li N8 -","- C40 H44 Al Li N8 -","- C160 H176 Al4 Li4 N32 -","4","0.5","","Karl Hensen; Alexander Lemke; Thorsten Stumpf; Michael Bolte; Holger Fleischer; Colin R. Pulham; Robert O. Gould; Steven Harris","Synthesis and Structural Characterization of (1,4-Dihydropyrid-1-yl)aluminum Complexes","Inorganic Chemistry","1999","38","","4700","4704","10.1021/ic9905695","","","0.71073","MoKα","","0.1265","0.0957","","0.2926","0.2575","0.2926","","","1.071","","","1.071","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322322","9.8484","0.0001","10.4148","0.0001","11.8007","0.0001","89.817","0.001","107.533","0.001","90.358","0.001","1154.13","0.02","173","","173","","","","","","","","","5","P 1","P 1","1","","","","- C48 H60 Al Li N8 -","- C48 H60 Al Li N8 -","- C48 H60 Al Li N8 -","1","1","","Karl Hensen; Alexander Lemke; Thorsten Stumpf; Michael Bolte; Holger Fleischer; Colin R. Pulham; Robert O. Gould; Steven Harris","Synthesis and Structural Characterization of (1,4-Dihydropyrid-1-yl)aluminum Complexes","Inorganic Chemistry","1999","38","","4700","4704","10.1021/ic9905695","","","0.71073","MoKα","","0.1071","0.0773","","0.228","0.202","0.228","","","0.955","","","0.955","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322323","14.0323","0.0003","11.9759","0.0002","16.8104","0.0002","90","","107.682","0.001","90","","2691.52","0.08","173","","173","","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","Tetra-(3,5-dimethylpyridin)Lithium-tetrakis(N-dihydro-3,5- dimethylpyridyl)-aluminate","","- C56 H76 Al Li N8 -","- C56 H76 Al Li N8 -","- C112 H152 Al2 Li2 N16 -","2","0.5","","Karl Hensen; Alexander Lemke; Thorsten Stumpf; Michael Bolte; Holger Fleischer; Colin R. Pulham; Robert O. Gould; Steven Harris","Synthesis and Structural Characterization of (1,4-Dihydropyrid-1-yl)aluminum Complexes","Inorganic Chemistry","1999","38","","4700","4704","10.1021/ic9905695","","","0.71073","MoKα","","0.1245","0.0714","","0.1553","0.1335","0.1553","","","1.074","","","1.074","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322324","12.826","0.003","17.121","0.003","13.23","0.003","90","","104.66","0.03","90","","2810.6","1.1","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C28 H66 F12 N2 P4 Re6 Sb2 Se8 -","- C28 H60 F12 N2 P4 Re6 Sb2 Se8 -","- C56 H120 F24 N4 P8 Re12 Sb4 Se16 -","2","0.5","","Zhiping Zheng; Thomas G. Gray; R. H. Holm","Synthesis and Structures of Solvated Monoclusters and Bridged Di- and Triclusters Based on the cubic Building Block [Re6(μ3-Se)8]2+","Inorganic Chemistry","1999","38","","4888","4895","10.1021/ic9906050","","","0.71073","MoKα","","0.0948","0.0678","","0.1985","0.1845","","","","1.091","1.239","1.239","","","","","has coordinates","264242","2021-04-16","08:52:17",""
"4322325","11.805","0.002","12.065","0.002","24.985","0.005","102.39","0.03","93.74","0.03","91.05","0.03","3466.4","1.2","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C32 H84 F12 O4 P4 Re6 S4 Sb2 Se8 -","- C32 H84 F12 O4 P4 Re6 S4 Sb2 Se8 -","- C64 H168 F24 O8 P8 Re12 S8 Sb4 Se16 -","2","1","","Zhiping Zheng; Thomas G. Gray; R. H. Holm","Synthesis and Structures of Solvated Monoclusters and Bridged Di- and Triclusters Based on the cubic Building Block [Re6(μ3-Se)8]2+","Inorganic Chemistry","1999","38","","4888","4895","10.1021/ic9906050","","","0.71073","MoKα","","0.0902","0.0602","","0.1575","0.1472","","","","0.946","1.109","1.109","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322326","12.55","0.002","12.55","0.002","27.039","0.005","90","","90","","120","","3688.2","1.1","293","2","293","2","","","","","","","","8","R -3 :H","-R 3","148","","","","- C18 H42 F12 N6 O6 Re6 Sb2 Se8 -","- C18 H42 F12 N6 O6 Re6 Sb2 Se8 -","- C54 H126 F36 N18 O18 Re18 Sb6 Se24 -","3","0.166667","","Zhiping Zheng; Thomas G. Gray; R. H. Holm","Synthesis and Structures of Solvated Monoclusters and Bridged Di- and Triclusters Based on the cubic Building Block [Re6(μ3-Se)8]2+","Inorganic Chemistry","1999","38","","4888","4895","10.1021/ic9906050","","","0.71073","MoKα","","0.0721","0.0337","","0.1009","0.0818","","","","0.569","0.618","0.618","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322327","9.337","0.002","11.578","0.002","13.498","0.003","100.36","0.03","94.52","0.03","95.38","0.03","1422.2","0.5","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C16 H48 F12 O8 Re6 S8 Sb2 Se8 -","- C16 H48 F12 O8 Re6 S8 Sb2 Se8 -","- C16 H48 F12 O8 Re6 S8 Sb2 Se8 -","1","0.5","","Zhiping Zheng; Thomas G. Gray; R. H. Holm","Synthesis and Structures of Solvated Monoclusters and Bridged Di- and Triclusters Based on the cubic Building Block [Re6(μ3-Se)8]2+","Inorganic Chemistry","1999","38","","4888","4895","10.1021/ic9906050","","","0.71073","MoKα","","0.0847","0.049","","0.1287","0.1175","","","","0.879","1.053","1.053","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322328","13.9972","0.0001","19.7337","0.0003","39.9367","0.0006","90","","93.897","0.001","90","","11005.7","0.2","213","2","213","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H30 F12 N6 Re6 Sb2 Se8 -","- C30 H30 F12 N6 Re6 Sb2 Se8 -","- C240 H240 F96 N48 Re48 Sb16 Se64 -","8","1","","Zhiping Zheng; Thomas G. Gray; R. H. Holm","Synthesis and Structures of Solvated Monoclusters and Bridged Di- and Triclusters Based on the cubic Building Block [Re6(μ3-Se)8]2+","Inorganic Chemistry","1999","38","","4888","4895","10.1021/ic9906050","","","0.71073","MoKα","","0.1099","0.0506","","0.1311","0.1089","","","","1.064","1.26","1.26","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322329","16.982","0.0003","18.9644","0.0004","23.2488","0.0001","97.449","0.001","96.387","0.001","96.211","0.001","7320.7","0.2","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C82 H170 Cl4 F24 N4 P10 Re12 Sb4 Se16 -","- C81 H167.5 Cl4 F24 N4 P10 Re12 Sb4 Se16 -","- C162 H335 Cl8 F48 N8 P20 Re24 Sb8 Se32 -","2","1","","Zhiping Zheng; Thomas G. Gray; R. H. Holm","Synthesis and Structures of Solvated Monoclusters and Bridged Di- and Triclusters Based on the cubic Building Block [Re6(μ3-Se)8]2+","Inorganic Chemistry","1999","38","","4888","4895","10.1021/ic9906050","","","0.71073","MoKα","","0.1039","0.0649","","0.1563","0.1255","","","","1.121","1.127","1.127","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322330","10.6065","0.0002","13.1141","0.0003","16.7533","0.0004","111.83","","104.684","0.001","94.803","0.001","2051.02","0.08","213","2","213","2","","","","","","","","9","P -1","-P 1","2","","","","- C38 H70 F12 N2 O P4 Re6 Sb2 Se8 -","- C52 H92 F12 N4 O2 P4 Re6 Sb2 Se8 -","- C52 H92 F12 N4 O2 P4 Re6 Sb2 Se8 -","1","0.5","","Zhiping Zheng; Thomas G. Gray; R. H. Holm","Synthesis and Structures of Solvated Monoclusters and Bridged Di- and Triclusters Based on the cubic Building Block [Re6(μ3-Se)8]2+","Inorganic Chemistry","1999","38","","4888","4895","10.1021/ic9906050","","","0.71073","MoKα","","0.1125","0.0675","","0.1789","0.1721","","","","0.938","1.294","1.294","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322331","12.6564","0.0001","22.9957","0.0001","23.5374","0.0004","90","","103.036","0.001","90","","6673.85","0.13","213","2","213","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C70 H158 F24 N2 P10 Re12 Sb4 Se16 -","- C70 H158 F24 N2 P10 Re12 Sb4 Se16 -","- C140 H316 F48 N4 P20 Re24 Sb8 Se32 -","2","0.5","","Zhiping Zheng; Thomas G. Gray; R. H. Holm","Synthesis and Structures of Solvated Monoclusters and Bridged Di- and Triclusters Based on the cubic Building Block [Re6(μ3-Se)8]2+","Inorganic Chemistry","1999","38","","4888","4895","10.1021/ic9906050","","","0.71073","MoKα","","0.1257","0.0627","","0.135","0.1101","","","","1.051","1.149","1.149","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322332","12.8813","0.0004","15.5023","0.0005","24.4935","0.0006","73.717","0.001","78.074","0.001","68.94","0.001","4350.6","0.2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C72 H160 F24 N2 P10 Re12 Sb4 Se16 -","- C120 H204 F24 N2 P10 Re12 Sb4 Se16 -","- C120 H204 F24 N2 P10 Re12 Sb4 Se16 -","1","0.5","","Zhiping Zheng; Thomas G. Gray; R. H. Holm","Synthesis and Structures of Solvated Monoclusters and Bridged Di- and Triclusters Based on the cubic Building Block [Re6(μ3-Se)8]2+","Inorganic Chemistry","1999","38","","4888","4895","10.1021/ic9906050","","","0.71073","MoKα","","0.1488","0.0575","","0.1461","0.1216","","","","0.901","1.175","1.175","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322333","8.6347","0.0003","9.678","0.001","13.773","0.004","73.182","0.005","74.622","0.005","89.76","0.01","1059","0.3","213","2","213","2","","","","","","","synthesized","5","P -1","-P 1","2","","Bis(tetrahydrofuran)-bis(μ3-trifluoroacetato)-hexakis (μ2-trifluoroacetato)-tetra-rhodium(II)","","- C12 H8 F12 O9 Rh2 -","- C12 H8 F12 O9 Rh2 -","- C24 H16 F24 O18 Rh4 -","2","1","","F. Albert Cotton; Evgeny V. Dikarev; Salah-Eddine Stiriba","Studies of Dirhodium Tetra(trifluoroacetate). 3. Solid State Isomers of the Compound Rh2(O2CCF3)4(THF) Prepared by Sublimation","Inorganic Chemistry","1999","38","","4877","4881","10.1021/ic990618d","","","0.71073","MoKα","","0.0689","0.0556","","0.1441","0.1283","","","","1.07","1.075","1.075","","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322334","9.557","0.002","10.126","0.002","11.84","0.004","95.97","0.02","90.4","0.02","115.58","0.01","1026.2","0.5","213","2","213","2","","","","","","","synthesized","5","P -1","-P 1","2","","Catena((μ2-tetrahydrofuran-O,O)-tetrakis(μ2-trifluoroacetato- -O,O')-di-rhodium(II))","","- C12 H8 F12 O9 Rh2 -","- C12 H8 F12 O9 Rh2 -","- C24 H16 F24 O18 Rh4 -","2","1","","F. Albert Cotton; Evgeny V. Dikarev; Salah-Eddine Stiriba","Studies of Dirhodium Tetra(trifluoroacetate). 3. Solid State Isomers of the Compound Rh2(O2CCF3)4(THF) Prepared by Sublimation","Inorganic Chemistry","1999","38","","4877","4881","10.1021/ic990618d","","","0.71073","MoKα","","0.0612","0.0496","","0.1195","0.1102","","","","1.067","1.078","1.078","","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322335","21.085","0.003","19.003","0.004","11.577","0.001","90","","101.432","0.009","90","","4546.6","1.2","213","2","213","2","","","","","","","synthesized","5","C 1 2/c 1","-C 2yc","15","","Bis(trans-dichloro-bis(4-tert-butylpyridine))-di-molybdenum (II), D2-isomer, benzene solvate","","- C42 H58 Cl4 Mo2 N4 -","- C42 H58 Cl4 Mo2 N4 -","- C168 H232 Cl16 Mo8 N16 -","4","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero; Barbara Modec","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 4. Rotational Isomers of Mo2Cl4(R-py)4 (R-py = 4-Picoline, 3,5-Lutidine, and 4-tert-Butylpyridine)","Inorganic Chemistry","1999","38","","4882","4887","10.1021/ic990728k","","","0.71073","MoKα","","0.0442","0.0376","","0.0899","0.0843","","","","1.106","1.108","1.108","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322336","15.1436","0.0006","10.7205","0.0005","19.866","0.001","90","","104.579","0.006","90","","3121.3","0.3","213","2","213","2","","","","","","","synthesized","5","C 1 2/c 1","-C 2yc","15","","Bis(trans-dichloro-bis(4-methylpyridine))-di-molybdenum (II), D2h-isomer, chloroform solvate","","- C25 H29 Cl7 Mo2 N4 -","- C25 H29 Cl7 Mo2 N4 -","- C100 H116 Cl28 Mo8 N16 -","4","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero; Barbara Modec","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 4. Rotational Isomers of Mo2Cl4(R-py)4 (R-py = 4-Picoline, 3,5-Lutidine, and 4-tert-Butylpyridine)","Inorganic Chemistry","1999","38","","4882","4887","10.1021/ic990728k","","","0.71073","MoKα","","0.0568","0.0482","","0.1253","0.1155","","","","1.085","1.085","1.085","","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322337","9.2958","0.0003","10.2669","0.0007","16.254","0.003","91.9","0.01","104.25","0.02","110.458","0.008","1396.5","0.3","213","2","213","2","","","","","","","synthesized","5","P -1","-P 1","2","","Bis(trans-dichloro-bis(4-methylpyridine))-di-molybdenum (II), D2d-isomer","","- C24 H28 Cl4 Mo2 N4 -","- C24 H28 Cl4 Mo2 N4 -","- C48 H56 Cl8 Mo4 N8 -","2","1","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero; Barbara Modec","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 4. Rotational Isomers of Mo2Cl4(R-py)4 (R-py = 4-Picoline, 3,5-Lutidine, and 4-tert-Butylpyridine)","Inorganic Chemistry","1999","38","","4882","4887","10.1021/ic990728k","","","0.71073","MoKα","","0.0548","0.0463","","0.1337","0.1237","","","","1.068","1.067","1.067","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322338","14.838","0.001","14.762","0.001","14.434","0.002","90","","90.67","0.008","90","","3161.4","0.5","213","2","213","2","","","","","","","synthesized","5","P 1 21/c 1","-P 2ybc","14","","Bis(trans-dichloro-bis(3,5-di-methylpyridine))-di-molybdenum, D2h-isomer","","- C28 H36 Cl4 Mo2 N4 -","- C28 H36 Cl4 Mo2 N4 -","- C112 H144 Cl16 Mo8 N16 -","4","1","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero; Barbara Modec","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 4. Rotational Isomers of Mo2Cl4(R-py)4 (R-py = 4-Picoline, 3,5-Lutidine, and 4-tert-Butylpyridine)","Inorganic Chemistry","1999","38","","4882","4887","10.1021/ic990728k","","","0.71073","MoKα","","0.0405","0.0341","","0.0855","0.0795","","","","1.136","1.129","1.129","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322339","13.738","0.002","14.0856","0.0005","16.686","0.003","90","","90","","90","","3228.9","0.8","213","2","213","2","","","","","","","synthesized","5","P n n b","-P 2b 2n","52","","Bis(trans-dichloro-bis(3,5-di-methylpyridine)-di-molybdenum (II), D2d-isomer","","- C28 H36 Cl4 Mo2 N4 -","- C28 H36 Cl4 Mo2 N4 -","- C112 H144 Cl16 Mo8 N16 -","4","0.5","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero; Barbara Modec","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 4. Rotational Isomers of Mo2Cl4(R-py)4 (R-py = 4-Picoline, 3,5-Lutidine, and 4-tert-Butylpyridine)","Inorganic Chemistry","1999","38","","4882","4887","10.1021/ic990728k","","","0.71073","MoKα","","0.0603","0.0456","","0.1168","0.1049","","","","1.134","1.155","1.155","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322340","11.616","0.0002","13.12","0.002","17.071","0.002","67.95","0.004","82.573","0.004","68.231","0.005","2239.2","0.4","213","2","213","2","","","","","","","synthesized","5","P -1","-P 1","2","","Bis(trans-dichloro-bis(4-tert-butylpyridine))-di-molibdenum (II), D2h-isomer, benzene solvate","","- C42 H58 Cl4 Mo2 N4 -","- C42 H58 Cl4 Mo2 N4 -","- C84 H116 Cl8 Mo4 N8 -","2","1","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero; Barbara Modec","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 4. Rotational Isomers of Mo2Cl4(R-py)4 (R-py = 4-Picoline, 3,5-Lutidine, and 4-tert-Butylpyridine)","Inorganic Chemistry","1999","38","","4882","4887","10.1021/ic990728k","","","0.71073","MoKα","","0.0508","0.0422","","0.1103","0.1003","","","","1.067","1.072","1.072","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322341","25.7267","0.0009","15.6628","0.0008","32.236","0.003","90","","90","","90","","12989.6","1.5","213","2","213","2","","","","","","","synthesized","6","P b c a","-P 2ac 2ab","61","","Bis(trans-dichloro-bis(4-tert-butylpyridine))-di-molybdenum (II), D2h/D2d-isomers, tetrahydrofurane solvate","","- C38.67 H57.33 Cl4 Mo2 N4 O0.67 -","- C38.6667 H57.3333 Cl4 Mo2 N4 O0.666667 -","- C464 H688 Cl48 Mo24 N48 O8 -","12","1.5","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero; Barbara Modec","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 4. Rotational Isomers of Mo2Cl4(R-py)4 (R-py = 4-Picoline, 3,5-Lutidine, and 4-tert-Butylpyridine)","Inorganic Chemistry","1999","38","","4882","4887","10.1021/ic990728k","","","0.71073","MoKα","","0.0531","0.0439","","0.1128","0.102","","","","1.124","1.11","1.11","","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322342","15.001","0.001","15.261","0.001","21.785","0.001","90","","103.79","0.006","90","","4843.5","0.5","213","2","213","2","","","","","","","synthesized","5","P 1 21/n 1","-P 2yn","14","","Bis(trans-dichloro-bis(4-tert-butylpyridine))-di-molybdenum (II), D2-isomer, hexane solvate","","- C40.5 H62.5 Cl4 Mo2 N4 -","- C40.476 H51.91 Cl4 Mo2 N4 -","- C161.904 H207.64 Cl16 Mo8 N16 -","4","1","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero; Barbara Modec","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 4. Rotational Isomers of Mo2Cl4(R-py)4 (R-py = 4-Picoline, 3,5-Lutidine, and 4-tert-Butylpyridine)","Inorganic Chemistry","1999","38","","4882","4887","10.1021/ic990728k","","","0.71073","MoKα","","0.074","0.0551","","0.1552","0.1342","","","","1.087","1.089","1.089","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322343","26.504","0.004","18.069","0.003","32.76","0.004","90","","110.52","0.01","90","","14693","4","213","2","213","2","","","","","","","synthesized","5","C 1 2/c 1","-C 2yc","15","","Bis(trans-dichloro-bis(4-tert-butylpyridine))-di-molybdenum (II), D2-isomer, dichloromethane solvate","","- C37.33 H54.67 Cl6.67 Mo2 N4 -","- C37.3267 H52 Cl6.65333 Mo2 N4 -","- C447.92 H624 Cl79.84 Mo24 N48 -","12","1.5","","F. Albert Cotton; Evgeny V. Dikarev; Santiago Herrero; Barbara Modec","Mixed Chloride/Amine Complexes of Dimolybdenum(II,II). 4. Rotational Isomers of Mo2Cl4(R-py)4 (R-py = 4-Picoline, 3,5-Lutidine, and 4-tert-Butylpyridine)","Inorganic Chemistry","1999","38","","4882","4887","10.1021/ic990728k","","","0.71073","MoKα","","0.1303","0.0932","","0.2771","0.2327","","","","1.088","1.11","1.11","","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322344","12.0371","0.0009","14.0188","0.0009","15.3362","0.0011","63.79","0.005","80.348","0.007","86.711","0.007","2288.6","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","[Pt2Au2(dmb)2(PPh3)4](PF6)2","","- C48 H48 Au F6 N2 P3 Pt -","- C48 H48 Au F6 N2 P3 Pt -","- C96 H96 Au2 F12 N4 P6 Pt2 -","2","1","","Tianle Zhang; Marc Drouin; Pierre D. Harvey","Preparation, Spectroscopic Characterization, and Frontier MO Study of the Heteronuclear Luminescent [Pt2Au2(dmb)2(PPh3)4](PF6)2 Cluster (dmb = 1,8-Diisocyano-p-menthane). A Cluster with a Formal Au0-Au0 Bond Encapsulated inside a ""Pt2(dmb)22+"" Fragment","Inorganic Chemistry","1999","38","","4928","4936","10.1021/ic981187m","","","1.5406","","","0.0617","0.0447","","","0.1304","0.1417","","","","","","1.092","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322345","22.757","0.005","13.566","0.003","12.12","0.002","90","","109.07","0.03","90","","3536.4","1.4","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C29 H20 Cl2 N2 O12 Pt2 -","- C29 H20 Cl2 N2 O12 Pt2 -","- C116 H80 Cl8 N8 O48 Pt8 -","4","0.5","","Richard A. Kortes; Steven J. Geib; Fu-Tyan Lin; Rex E. Shepherd","Crystal and Molecular Structure of a Potential DNA Groove-Spanning Chelate: [MV][Pt2(hdta)Cl2].4H2O (MV2+= 1,1'-Dimethyl-4,4'-bipyridinium, hdta4-= 1,6-Hexanediamine-N,N,N',N'-tetraacetate)","Inorganic Chemistry","1999","38","","5045","5052","10.1021/ic990123o","","","0.71073","MoKα","","0.0633","0.044","","","0.1117","0.1252","","","","","","0.93","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322346","9.8414","0.0014","17.337","0.002","26.086","0.003","101.078","0.01","98.179","0.01","102.857","0.01","4178","1","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C43.5 H39 Au Cl2 N O2.5 P2 S2 -","- C43.5 H36 Au Cl2 N O2.5 P2 S2 -","- C174 H144 Au4 Cl8 N4 O10 P8 S8 -","4","2","","José Vicente; María Teresa Chicote; Pablo González-Herrero; Peter G. Jones; Mark G. Humphrey; Marie P. Cifuentes; Marek Samoc; Barry Luther-Davies","Complexes with S-Donor Ligands. 7. New 1,1-Ethylenedithiolato Complexes of Thallium(I), Gold(I), and Gold(III): Syntheses, Structure, and Molecular cubic Hyperpolarizabilities","Inorganic Chemistry","1999","38","","5018","5026","10.1021/ic990379u","","","0.71073","MoKα","","0.0544","0.0311","","0.0646","0.0605","","","","0.898","1.002","1.002","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322347","6.99","0.001","7.985","0.001","21.177","0.001","90","","90","","90","","1182","0.2","173","2","173","2","","","","","","","","4","C m c e","-C 2ac 2","64","trifluoromethyl iodine dichloride","trifluoromethyl iodine dichloride","","- C Cl2 F3 I -","- C Cl2 F3 I -","- C8 Cl16 F24 I8 -","8","0.5","","Rolf Minkwitz; Michael Berkei","A New Method for Preparation and Crystal Structure of (Trifluoromethyl)iodine Dichloride","Inorganic Chemistry","1999","38","","5041","5044","10.1021/ic990441n","","","0.71069","MoKα","","0.0554","0.0341","","0.1151","0.0631","","","","1.876","1.177","1.177","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322348","18.96","0.007","25.99","0.015","20.669","0.005","90","","109.58","0.02","90","","9596","7","295","","295","","","","","","","","?","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H126 Mo12 N6 Ni2 O48 -","- C48 Mo12 N6 Ni2 O48 -","- C192 Mo48 N24 Ni8 O192 -","4","1","","Richard Villanneau; Anna Proust; Francis Robert; Pierre Veillet; Pierre Gouzerh","Synthesis, Structure, and Magnetic Properties of (n-Bu4N)2[{Ni(MeOH)2}2{Mo(NO)}2(μ3-OH)2(μ-OMe)4{Mo5O13(OMe)4(NO)}2], a New Type of Polyoxometalate Incorporating a Rhomb-like Cluster","Inorganic Chemistry","1999","38","","4981","4985","10.1021/ic990480z","","","0.71073","MoKα","","","0.0869","","","0.0942","","","","","3.1584","3.1584","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322349","6.2137","0.0013","14.7472","0.0015","11.1802","0.0012","90","","105.834","0.015","90","","985.6","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C4 H24 Cu3 N2 O18 P4 -","- C4 H24 Cu3 N2 O18 P4 -","- C8 H48 Cu6 N4 O36 P8 -","2","0.5","","Li-Min Zheng; Hui-Hua Song; Chun-Ying Duan; Xin","Template-Directed One- and Two-Dimensional Copper(II) Diphosphonates: Structures and Characterizations of (NH4)2Cu3(hedp)2(H2O)4, [NH3(CH2)4NH3]Cu3(hedp)2.2H2O, and [NH2(C2H4)2NH2]Cu3(hedp)2 (hedp = 1-Hydroxyethylidenediphosphonate)","Inorganic Chemistry","1999","38","","5061","5066","10.1021/ic990481r","","","0.71073","MoKα","","0.0439","0.0435","","0.1174","0.1168","","","","1.103","1.105","1.105","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322350","7.484","0.0012","8.032","0.003","10.007","0.002","111.68","0.02","96.188","0.014","96.97","0.02","547.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H13 Cu1.5 N O8 P2 -","- C3.999 H12.997 Cu1.5 N O8 P2 -","- C7.998 H25.994 Cu3 N2 O16 P4 -","2","1","","Li-Min Zheng; Hui-Hua Song; Chun-Ying Duan; Xin","Template-Directed One- and Two-Dimensional Copper(II) Diphosphonates: Structures and Characterizations of (NH4)2Cu3(hedp)2(H2O)4, [NH3(CH2)4NH3]Cu3(hedp)2.2H2O, and [NH2(C2H4)2NH2]Cu3(hedp)2 (hedp = 1-Hydroxyethylidenediphosphonate)","Inorganic Chemistry","1999","38","","5061","5066","10.1021/ic990481r","","","0.71073","MoKα","","0.0617","0.0527","","0.1523","0.1432","","","","1.057","1.084","1.084","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322351","7.0155","0.0006","8.0904","0.0009","9.2644","0.0011","112.611","0.013","90.819","0.008","92.824","0.007","484.51","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H20 Cu3 N2 O14 P4 -","- C8 H20 Cu3 N2 O14 P4 -","- C8 H20 Cu3 N2 O14 P4 -","1","0.5","","Li-Min Zheng; Hui-Hua Song; Chun-Ying Duan; Xin","Template-Directed One- and Two-Dimensional Copper(II) Diphosphonates: Structures and Characterizations of (NH4)2Cu3(hedp)2(H2O)4, [NH3(CH2)4NH3]Cu3(hedp)2.2H2O, and [NH2(C2H4)2NH2]Cu3(hedp)2 (hedp = 1-Hydroxyethylidenediphosphonate)","Inorganic Chemistry","1999","38","","5061","5066","10.1021/ic990481r","","","0.71073","MoKα","","0.0308","0.0297","","0.0849","0.0839","","","","1.073","1.086","1.086","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322352","8.1143","0.0005","12.6757","0.0007","16.698","0.001","80.445","0.001","76.152","0.001","86.876","0.001","1644.21","0.17","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H36 Cl4 Cu2 N8 O16 -","- C19 H36 Cl4 Cu2 N8 O16 -","- C38 H72 Cl8 Cu4 N16 O32 -","2","1","","A. McAuley; M. J. Zaworotko; K. Biradha","Stepwise Complexation of Ni(II) and Cu(II) Ions by 6,6'-C-spirobi(cyclam) (cyclam = 1,4,8,11-Tetraazacyclotetradecane), L1. Syntheses and Redox Chemistry of [M(H2L1)]X4 (M = Cu2+, Ni2+), [Cu2(L1)]X4, and [CuNi(L1)]X4 (X = ClO4-) and the X-ray Crystal Structure of [Cu2(L1)](ClO4)4","Inorganic Chemistry","1999","38","","5078","5085","10.1021/ic9904844","","","0.71073","MoKα","","0.12","0.1056","","0.3328","0.32","","","","1.099","1.185","1.185","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322353","11.071","0.002","14.937","0.003","18.08","0.004","91.31","0.03","101.23","0.03","109.95","0.03","2743.7","1.2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C44 H86 B2 Li2 N4 O4 P2 Si -","- C44 H86 B2 Li2 N4 O4 P2 Si -","- C88 H172 B4 Li4 N8 O8 P4 Si2 -","2","1","","Tuqiang Chen; Eileen N. Duesler; Robert T. Paine; Heinrich Nöth","Synthesis and Chemistry of Bis(borylphosphino)silanes and -germanes","Inorganic Chemistry","1999","38","","4993","4999","10.1021/ic990507e","","","0.71073","MoKα","","0.097","0.0447","","","0.0936","0.1059","","","","","","1.008","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322354","11.083","0.001","14.978","0.001","18.134","0.002","91.17","0.001","101.43","0.01","110.05","0.01","2758.9","0.5","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C44 H86 B2 Ge Li2 N4 O4 P2 -","- C44 H86 B2 Ge Li2 N4 O4 P2 -","- C88 H172 B4 Ge2 Li4 N8 O8 P4 -","2","1","","Tuqiang Chen; Eileen N. Duesler; Robert T. Paine; Heinrich Nöth","Synthesis and Chemistry of Bis(borylphosphino)silanes and -germanes","Inorganic Chemistry","1999","38","","4993","4999","10.1021/ic990507e","","","0.71073","MoKα","","0.0896","0.0417","","","0.081","0.0918","","","","","","1.036","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322355","11.939","0.002","24.516","0.003","21.572","0.003","90","","101.52","0.01","90","","6186.9","1.6","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C44 H94 B2 Li2 N4 O4 P2 Si5 -","- C44 H94 B2 Li2 N4 O4 P2 Si5 -","- C176 H376 B8 Li8 N16 O16 P8 Si20 -","4","1","","Tuqiang Chen; Eileen N. Duesler; Robert T. Paine; Heinrich Nöth","Synthesis and Chemistry of Bis(borylphosphino)silanes and -germanes","Inorganic Chemistry","1999","38","","4993","4999","10.1021/ic990507e","","","0.71073","MoKα","","0.1273","0.0377","","","0.0856","0.132","","","","","","1.001","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322356","15.043","0.002","16.146","0.002","16.596","0.002","63.73","0.01","69.64","0.01","63.23","0.01","3171.1","0.8","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C140 H158 Cl6 I2 N10 Rh2 -","- C140 H158 Cl6 I2 N10 Rh2 -","- C140 H158 Cl6 I2 N10 Rh2 -","1","0.5","","Hee-Joon Kim; James E. Redman; Moshe Nakash; Neil Feeder; Simon J. Teat; Jeremy K. M. Sanders","Synthesis, Structure, and Modeling of a Cyclic Rhodium(III) Porphyrin Dimer with an Encapsulated 4,4'-Bipyridine Ligand","Inorganic Chemistry","1999","38","","5178","5183","10.1021/ic990593i","","","0.6917","Synchrotron","","0.1572","0.0934","","","0.2086","0.2384","","","","","","1.184","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322357","15.207","0.002","17.479","0.002","12.347","0.002","110.27","0.02","90.74","0.02","95.93","0.02","3058","0.8","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C132 H164 Cl4 I2 N10 Rh2 -","- C132 H164 Cl4 I2 N10 Rh2 -","- C132 H164 Cl4 I2 N10 Rh2 -","1","0.5","","Hee-Joon Kim; James E. Redman; Moshe Nakash; Neil Feeder; Simon J. Teat; Jeremy K. M. Sanders","Synthesis, Structure, and Modeling of a Cyclic Rhodium(III) Porphyrin Dimer with an Encapsulated 4,4'-Bipyridine Ligand","Inorganic Chemistry","1999","38","","5178","5183","10.1021/ic990593i","","","0.71073","MoKα","","0.0643","0.0476","","","0.1179","0.1296","","","","","","1.102","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322358","15.28","0.002","16.062","0.002","12.583","0.002","108.48","0.01","93.77","0.01","99.22","0.01","2868.6","0.7","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C65 H81 I N5 Rh -","- C65 H81 I N5 Rh -","- C130 H162 I2 N10 Rh2 -","2","1","","Hee-Joon Kim; James E. Redman; Moshe Nakash; Neil Feeder; Simon J. Teat; Jeremy K. M. Sanders","Synthesis, Structure, and Modeling of a Cyclic Rhodium(III) Porphyrin Dimer with an Encapsulated 4,4'-Bipyridine Ligand","Inorganic Chemistry","1999","38","","5178","5183","10.1021/ic990593i","","","0.71073","MoKα","","0.0606","0.041","","","0.0927","0.0984","","","","","","1.045","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322359","14.963","0.002","19.046","0.002","10.191","0.002","97.58","0.01","107.461","0.01","71.33","0.01","2622.6","0.7","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C61 H79 N4 Rh -","- C61 H79 N4 Rh -","- C122 H158 N8 Rh2 -","2","1","","Hee-Joon Kim; James E. Redman; Moshe Nakash; Neil Feeder; Simon J. Teat; Jeremy K. M. Sanders","Synthesis, Structure, and Modeling of a Cyclic Rhodium(III) Porphyrin Dimer with an Encapsulated 4,4'-Bipyridine Ligand","Inorganic Chemistry","1999","38","","5178","5183","10.1021/ic990593i","","","0.71073","MoKα","","0.0925","0.0668","","","0.1584","0.1736","","","","","","1.025","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322360","28.734","0.005","16.347","0.003","37.986","0.007","90","","102.35","0.02","90","","17430","6","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C194 H218 B4 N16 Ru2 S6 -","- C194 H218 B4 N16 Ru2 S6 -","- C776 H872 B16 N64 Ru8 S24 -","4","0.5","","Belén Albela; Eberhard Bothe; Oliver Brosch; Katsura Mochizuki; Thomas Weyhermüller; Karl Wieghardt","Redox Chemistry of (1,4,7-Tris(4-tert-butyl-2-mercaptobenzyl)-1,4,7- triazacyclononane)ruthenium(III), [RuIIIL]: Synthesis and Characterization of [RuII2(L-L)](BPh4)4.10CH3CN and [LRuRuRuL](PF6)2.H2O","Inorganic Chemistry","1999","38","","5131","5138","10.1021/ic9906297","","","0.71073","MoKα","","0.0632","0.0458","","0.1047","0.0965","","","","1.109","1.149","1.149","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322361","18.755","0.003","22.278","0.004","21.92","0.004","90","","91.69","0.03","90","","9155","3","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C78 H110 F12 N6 O P2 Ru3 S6 -","- C78 H108 F12 N6 O P2 Ru3 S6 -","- C312 H432 F48 N24 O4 P8 Ru12 S24 -","4","1","","Belén Albela; Eberhard Bothe; Oliver Brosch; Katsura Mochizuki; Thomas Weyhermüller; Karl Wieghardt","Redox Chemistry of (1,4,7-Tris(4-tert-butyl-2-mercaptobenzyl)-1,4,7- triazacyclononane)ruthenium(III), [RuIIIL]: Synthesis and Characterization of [RuII2(L-L)](BPh4)4.10CH3CN and [LRuRuRuL](PF6)2.H2O","Inorganic Chemistry","1999","38","","5131","5138","10.1021/ic9906297","","","0.71073","MoKα","","0.1708","0.0842","","0.2612","0.1999","","","","1.018","1.122","1.122","","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322362","9.8736","0.0002","10.8633","0.0003","23.4208","0.0006","77.326","0.001","80.511","0.001","73.931","0.001","2340.57","0.1","142","2","142","2","","","","","","","synthesis","6","P 1","P 1","1","","(1,4,7,10‒tetrakis((S)‒2‒hydroxy‒3‒phenoxypropyl) ‒1,4,7,10‒tetraazacyclododecane) cadmium(II) diperchlorate","","- C44 H52 Cd Cl2 N4 O16 -","- C44 H52 Cd Cl2 N4 O16 -","- C88 H104 Cd2 Cl4 N8 O32 -","2","2","","Christopher B. Smith; Kia S. Wallwork; Jennifer M. Weeks; Mark A. Buntine; Stephen F. Lincoln; Max R. Taylor; Kevin P. Wainwright","Metal Ion Dependent Molecular Inclusion Chemistry: Inclusion of p-Toluenesulfonate and p-Nitrophenolate within the Structure of Coordinated 1,4,7,10-Tetrakis((S)-2-hydroxy-3-phenoxypropyl)-1,4,7,10-tetraazacyclododecane","Inorganic Chemistry","1999","38","","4986","4992","10.1021/ic990739d","","","0.71073","xray_tube","","0.059","0.054","","0.149","0.143","","","","1.269","1.264","1.264","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4322363","10.64","0.0011","11.907","0.0012","12.174","0.0012","111.96","0.011","91.77","0.009","113.94","0.011","1276.7","0.3","150","2","150","2","","","","","","","","7","P 1","P 1","1","","(1,4,7,10–tetrakis((S)–2–hydroxy–3–phenoxypropyl)–1,4,7,10– tetraazacyclododecane)cadmium(II) perchlorate p–toluenesulfonate","","- C51 H67 Cd Cl N4 O15 S -","- C51 H67 Cd Cl N4 O15 S -","- C51 H67 Cd Cl N4 O15 S -","1","1","","Christopher B. Smith; Kia S. Wallwork; Jennifer M. Weeks; Mark A. Buntine; Stephen F. Lincoln; Max R. Taylor; Kevin P. Wainwright","Metal Ion Dependent Molecular Inclusion Chemistry: Inclusion of p-Toluenesulfonate and p-Nitrophenolate within the Structure of Coordinated 1,4,7,10-Tetrakis((S)-2-hydroxy-3-phenoxypropyl)-1,4,7,10-tetraazacyclododecane","Inorganic Chemistry","1999","38","","4986","4992","10.1021/ic990739d","","","0.71073","xray_tube","","0.029","0.029","","0.038","0.038","","","","1.698","1.696","1.696","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322364","13.544","0.009","14.936","0.01","13.592","0.009","90","","102.75","0.02","90","","2682","3","298","","298","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","lfnh3","(Me~4~N)~2~ [a^2^-B~20~H~16~(NH~3~)~2~]","","- C8 H46 B20 N4 -","- C8 H46 B20 N4 -","- C32 H184 B80 N16 -","4","1","","Fangbiao Li; Kenneth Shelly; Carolyn B. Knobler; M. Frederick Hawthorne","The Synthesis of [Me~4~N]~2~[a^2^-B~20~H~16~(NH~3~)~2~] and trans-B~20~H~16~(NH~3~)~2~ from [Me~3~NH][cis-B~20~H~17~NH~3~] and Their Structural Characterization.","Inorganic Chemistry","1999","38","","4926","4927","10.1021/ic990744h","","","1.5418","CuKα","","0.1766","0.0812","","0.248","0.1937","","","","1.054","1.211","1.211","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322365","6.976","0.003","8.648","0.004","10.6","0.004","75.872","0.01","85.301","0.01","77.729","0.01","605.7","0.4","298","","298","","","","","","","","","5","P -1","-P 1","2","lfnn","trans-B~20~H~16~(NH~3~)~2~","","- C6 H34 B20 N2 O2 -","- C6 H34 B20 N2 O2 -","- C6 H34 B20 N2 O2 -","1","0.5","","Fangbiao Li; Kenneth Shelly; Carolyn B. Knobler; M. Frederick Hawthorne","The Synthesis of [Me~4~N]~2~[a^2^-B~20~H~16~(NH~3~)~2~] and trans-B~20~H~16~(NH~3~)~2~ from [Me~3~NH][cis-B~20~H~17~NH~3~] and Their Structural Characterization.","Inorganic Chemistry","1999","38","","4926","4927","10.1021/ic990744h","","","0.71073","MoKα","","0.1829","0.0642","","0.2063","0.1464","","","","1.005","1.15","1.15","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322366","8.8449","0.0005","11.2219","0.0008","14.466","0.001","96.818","0.007","107.694","0.007","104.52","0.006","1294.32","0.17","293.2","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C21 H31 Cl N6 O4 Pd S2 -","- C21 H31 Cl N6 O4 Pd S2 -","- C42 H62 Cl2 N12 O8 Pd2 S4 -","2","1","","Sudeep Bhattacharyya; Timothy J. R. Weakley; Muktimoy Chaudhury","Palladium(II)-Induced Activation of Carbon-Nitrogen Single Bond of Coordinated N4S Ligand. Characterization of Product with Modified Ligand Structure: Kinetics versus Thermodynamic Considerations","Inorganic Chemistry","1999","38","","5453","5456","10.1021/ic9813720","","","0.71073","MoKα","","","0.029","","","0.038","","","","","2.38","2.38","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322367","19.056","0.003","11.248","0.001","16.188","0.003","90","","90","","90","","3469.8","0.9","294.2","","294","","","","","","","","","7","I b a 2","I 2 -2c","45","","","","- C25 H41 Cl N6 O4 Pd2 S4 -","- C25 H41 Cl N6 O4 Pd2 S4 -","- C100 H164 Cl4 N24 O16 Pd8 S16 -","4","0.5","","Sudeep Bhattacharyya; Timothy J. R. Weakley; Muktimoy Chaudhury","Palladium(II)-Induced Activation of Carbon-Nitrogen Single Bond of Coordinated N4S Ligand. Characterization of Product with Modified Ligand Structure: Kinetics versus Thermodynamic Considerations","Inorganic Chemistry","1999","38","","5453","5456","10.1021/ic9813720","","","0.71073","MoKα","","","0.033","","","0.0377","","","","","1.99","1.99","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322368","9.907","0.002","10.722","0.002","14.162","0.003","81.95","0.03","89.62","0.03","82.69","0.03","1477.3","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H84 K4 O10 Sn2 -","- C10.485 K O2.5 Sn0.5 -","- C41.94 K4 O10 Sn2 -","4","2","","Michael Veith; Charu Mathur; Sanjay Mathur; Volker Huch","Unusual Sandwiching of the Cyclopentadienyl Anion in [K4(C5H5)2M2(OBut)6(CH3OCH2CH2OCH3)2]n (M = Ge, Sn)","Inorganic Chemistry","1999","38","","5461","5463","10.1021/ic9814120","","","0.71073","MoKα","","0.0543","0.046","","","0.1339","0.1396","","","","","","1.044","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322369","8.405","0.003","11.26","0.006","12.265","0.005","67.97","0.04","84.3","0.03","88.5","0.04","1070.6","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H19 Fe N O2 S4 -","- C21 H19 Fe N O2 S4 -","- C42 H38 Fe2 N2 O4 S8 -","2","1","","Dieter Sellmann; Jürgen Utz; Frank W. Heinemann","Transition Metal Complexes with Sulfur Ligands. 136.1 Enforced Trans Coordination of Thiolate Donors in Electron Rich Iron, Ruthenium, and Nickel [M(L)(pyN~2~H~2~S~2~)] and [M(L)(pyS~4~)] Complexes (L = CO, PPh~3~, DMSO) (pyN2H2S22-= 2,6-Bis(2-mercaptophenylamino)dimethylpyridine(2-); pyS4^2-^ = 2,6-Bis(2-mercaptophenylthio)dimethylpyridine(2-))","Inorganic Chemistry","1999","38","","5314","5322","10.1021/ic990169h","","","0.71073","MoKα","","0.0388","0.0268","","0.0686","0.0662","","","","0.923","1.035","1.035","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322370","8.376","0.002","10.649","0.002","10.942","0.002","77.56","0.01","79.19","0.02","81.24","0.02","929.8","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H30 N2 Ni2 S8 -","- C38 H30 N2 Ni2 S8 -","- C38 H30 N2 Ni2 S8 -","1","0.5","","Dieter Sellmann; Jürgen Utz; Frank W. Heinemann","Transition Metal Complexes with Sulfur Ligands. 136.1 Enforced Trans Coordination of Thiolate Donors in Electron Rich Iron, Ruthenium, and Nickel [M(L)(pyN~2~H~2~S~2~)] and [M(L)(pyS~4~)] Complexes (L = CO, PPh~3~, DMSO) (pyN2H2S22-= 2,6-Bis(2-mercaptophenylamino)dimethylpyridine(2-); pyS4^2-^ = 2,6-Bis(2-mercaptophenylthio)dimethylpyridine(2-))","Inorganic Chemistry","1999","38","","5314","5322","10.1021/ic990169h","","","0.71073","MoKα","","0.175","0.0586","","0.1486","0.126","","","","0.685","1.097","1.097","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322371","12.903","0.003","9.603","0.005","14.219","0.003","90","","96.52","0.02","90","","1750.4","1.1","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 Fe N3 S2 -","- C19 H17 Fe N3 S2 -","- C76 H68 Fe4 N12 S8 -","4","1","","Dieter Sellmann; Jürgen Utz; Frank W. Heinemann","Transition Metal Complexes with Sulfur Ligands. 136.1 Enforced Trans Coordination of Thiolate Donors in Electron Rich Iron, Ruthenium, and Nickel [M(L)(pyN~2~H~2~S~2~)] and [M(L)(pyS~4~)] Complexes (L = CO, PPh~3~, DMSO) (pyN2H2S22-= 2,6-Bis(2-mercaptophenylamino)dimethylpyridine(2-); pyS4^2-^ = 2,6-Bis(2-mercaptophenylthio)dimethylpyridine(2-))","Inorganic Chemistry","1999","38","","5314","5322","10.1021/ic990169h","","","0.71073","MoKα","","0.0631","0.0448","","0.1266","0.1235","","","","0.955","1.157","1.157","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322372","10.861","0.002","13.552","0.003","14.438","0.003","111.13","0.01","103.74","0.01","97.82","0.01","1867","0.7","200","2","200","2","","","","","","","","7","P -1","-P 1","2","","","","- C43 H42 N3 O1.5 P Ru S2 -","- C43 H40 N3 O1.5 P Ru S2 -","- C86 H80 N6 O3 P2 Ru2 S4 -","2","1","","Dieter Sellmann; Jürgen Utz; Frank W. Heinemann","Transition Metal Complexes with Sulfur Ligands. 136.1 Enforced Trans Coordination of Thiolate Donors in Electron Rich Iron, Ruthenium, and Nickel [M(L)(pyN~2~H~2~S~2~)] and [M(L)(pyS~4~)] Complexes (L = CO, PPh~3~, DMSO) (pyN2H2S22-= 2,6-Bis(2-mercaptophenylamino)dimethylpyridine(2-); pyS4^2-^ = 2,6-Bis(2-mercaptophenylthio)dimethylpyridine(2-))","Inorganic Chemistry","1999","38","","5314","5322","10.1021/ic990169h","","","0.71073","MoKα","","0.1037","0.056","","0.1281","0.107","","","","1.037","1.075","1.075","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322373","18.529","0.006","33.372","0.006","10.851","0.003","90","","90","","90","","6710","3","200","2","200","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C51 H70 Cl9 I N6 O3 Ru2 S7 -","- C51 H70 Cl9 I N6 O3 Ru2 S7 -","- C204 H280 Cl36 I4 N24 O12 Ru8 S28 -","4","0.5","","Dieter Sellmann; Jürgen Utz; Frank W. Heinemann","Transition Metal Complexes with Sulfur Ligands. 136.1 Enforced Trans Coordination of Thiolate Donors in Electron Rich Iron, Ruthenium, and Nickel [M(L)(pyN~2~H~2~S~2~)] and [M(L)(pyS~4~)] Complexes (L = CO, PPh~3~, DMSO) (pyN2H2S22-= 2,6-Bis(2-mercaptophenylamino)dimethylpyridine(2-); pyS4^2-^ = 2,6-Bis(2-mercaptophenylthio)dimethylpyridine(2-))","Inorganic Chemistry","1999","38","","5314","5322","10.1021/ic990169h","","","0.71073","MoKα","","0.0843","0.067","","0.1902","0.1793","","","","1.273","1.418","1.418","","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322374","10.595","0.001","23.426","0.002","16.846","0.002","90","","92.85","0.01","90","","4176","0.7","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C40 H40 Cl2 I2 N3 P Ru S2 -","- C40 H40 Cl2 I2 N3 P Ru S2 -","- C160 H160 Cl8 I8 N12 P4 Ru4 S8 -","4","1","","Dieter Sellmann; Jürgen Utz; Frank W. Heinemann","Transition Metal Complexes with Sulfur Ligands. 136.1 Enforced Trans Coordination of Thiolate Donors in Electron Rich Iron, Ruthenium, and Nickel [M(L)(pyN~2~H~2~S~2~)] and [M(L)(pyS~4~)] Complexes (L = CO, PPh~3~, DMSO) (pyN2H2S22-= 2,6-Bis(2-mercaptophenylamino)dimethylpyridine(2-); pyS4^2-^ = 2,6-Bis(2-mercaptophenylthio)dimethylpyridine(2-))","Inorganic Chemistry","1999","38","","5314","5322","10.1021/ic990169h","","","0.71073","MoKα","","0.0847","0.0445","","0.1199","0.1038","","","","0.866","0.999","0.999","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322375","10.05","0.002","23.111","0.005","16.234","0.003","90","","97.13","0.03","90","","3741.4","1.3","133","2","133","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C76 H114 Al4 F2 O6 -","- C76 H114 Al4 F2 O6 -","- C152 H228 Al8 F4 O12 -","2","0.5","","Carsten Rennekamp; Helge Wessel; Herbert W. Roesky; Peter Müller; Hans-Georg Schmidt; Mathias Noltemeyer; Isabel Usón; Andrew R. Barron","An Alternative Approach to Al202 Ring Systems by Unexpected Cleavage of Stable Al-F- and Si-O- Bonds","Inorganic Chemistry","1999","38","","5235","5240","10.1021/ic990185e","","","0.71073","MoKα","","0.0895","0.0642","","","0.1227","0.1327","","","","","","1.144","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322376","12.173","0.002","13.319","0.003","20.512","0.004","90","","90","","90","","3325.7","1.1","200","2","200","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","compound 2","","- C26 H44 Al2 F2 O14 -","- C26 H44 Al2 F2 O14 -","- C104 H176 Al8 F8 O56 -","4","1","","Carsten Rennekamp; Helge Wessel; Herbert W. Roesky; Peter Müller; Hans-Georg Schmidt; Mathias Noltemeyer; Isabel Usón; Andrew R. Barron","An Alternative Approach to Al202 Ring Systems by Unexpected Cleavage of Stable Al-F- and Si-O- Bonds","Inorganic Chemistry","1999","38","","5235","5240","10.1021/ic990185e","","","0.71073","MoKα","","0.0839","0.0657","","0.1807","0.1623","","","","1.076","1.104","1.104","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322377","17.09","0.002","10.26","0.002","17.521","0.004","90","","90","","90","","3072.2","1","203","2","203","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","compound 3","","- C22 H54 Al2 O2 Si2 -","- C22 H54 Al2 O2 Si2 -","- C88 H216 Al8 O8 Si8 -","4","0.5","","Carsten Rennekamp; Helge Wessel; Herbert W. Roesky; Peter Müller; Hans-Georg Schmidt; Mathias Noltemeyer; Isabel Usón; Andrew R. Barron","An Alternative Approach to Al202 Ring Systems by Unexpected Cleavage of Stable Al-F- and Si-O- Bonds","Inorganic Chemistry","1999","38","","5235","5240","10.1021/ic990185e","","","0.71073","MoKα","","0.1168","0.0725","","0.1903","0.1388","","","","1.062","1.051","1.051","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322378","21.982","0.003","18.921","0.003","10.4381","0.0015","90","","106.556","0.011","90","","4161.4","1.1","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C38 H28 Cl2 N9 O6 P3 -","- C38 H26 Cl2 N9 O6 P3 -","- C152 H104 Cl8 N36 O24 P12 -","4","0.5","","Ok-Sang Jung; Yong Tae Kim; Young-A Lee; Yun Ju Kim; Hee K. Chae","Trinucleating Bipyridyl Ligands; Synthesis and Structure of Cobalt-Benzoquinone Complex of Cyclotriphosphazenes Bearing Dioxybipyridine Groups","Inorganic Chemistry","1999","38","","5457","5460","10.1021/ic990215d","","","0.71073","MoKα","","0.077","0.0759","","","0.2127","0.2145","","","","","","1.079","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322379","7.0858","0.0005","7.7923","0.0006","13.5874","0.001","93.665","0.001","94.437","0.001","95.724","0.001","742.3","0.09","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H12 O2 S4 W -","- C10 H12 O2 S4 W -","- C20 H24 O4 S8 W2 -","2","1","","Christine A. Goddard; R. H. Holm","Synthesis and Reactivity Aspects of the Bis(dithiolene) Chalcogenide Series [WIVQ(S2C2R2)2]2- (Q = O, S, Se)","Inorganic Chemistry","1999","38","","5389","5398","10.1021/ic9903329","","","0.71073","MoKα","","0.0293","0.026","","0.0595","0.0589","","","","1.022","1.061","1.061","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322380","13.3608","0.0007","11.4546","0.0006","18.6255","0.001","90","","101.73","","90","","2791","0.3","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H20 O2 S4 W -","- C30 H20 O2 S4 W -","- C120 H80 O8 S16 W4 -","4","1","","Christine A. Goddard; R. H. Holm","Synthesis and Reactivity Aspects of the Bis(dithiolene) Chalcogenide Series [WIVQ(S2C2R2)2]2- (Q = O, S, Se)","Inorganic Chemistry","1999","38","","5389","5398","10.1021/ic9903329","","","0.71073","MoKα","","0.0298","0.0261","","0.0653","0.0642","","","","1.073","1.117","1.117","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322381","17.3362","0.0003","17.6679","0.0003","30.9649","0.0002","90","","103.592","0.001","90","","9218.7","0.2","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H64 N2 O1.5 S4 W -","- C46 H64 N2 O1.5 S4 W -","- C368 H512 N16 O12 S32 W8 -","8","2","","Christine A. Goddard; R. H. Holm","Synthesis and Reactivity Aspects of the Bis(dithiolene) Chalcogenide Series [WIVQ(S2C2R2)2]2- (Q = O, S, Se)","Inorganic Chemistry","1999","38","","5389","5398","10.1021/ic9903329","","","0.71073","MoKα","","0.0639","0.0412","","0.1035","0.0973","","","","1.005","1.122","1.122","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322382","17.6352","0.0004","10.9691","0.0002","20.2778","0.0005","90","","90","","90","","3922.58","0.15","213","2","213","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C27 H59 N3 O2 S4 W -","- C27 H59 N3 O2 S4 W -","- C108 H236 N12 O8 S16 W4 -","4","0.5","","Christine A. Goddard; R. H. Holm","Synthesis and Reactivity Aspects of the Bis(dithiolene) Chalcogenide Series [WIVQ(S2C2R2)2]2- (Q = O, S, Se)","Inorganic Chemistry","1999","38","","5389","5398","10.1021/ic9903329","","","0.71073","MoKα","","0.0416","0.0341","","","0.0855","0.09","","","","","","1.044","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322383","20.591","0.004","22.396","0.005","10.5719","0.0015","90","","102.155","0.015","90","","4766","1.6","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C47 H67 N O3 S4 W -","- C47 H67 N O3 S4 W -","- C188 H268 N4 O12 S16 W4 -","4","1","","Christine A. Goddard; R. H. Holm","Synthesis and Reactivity Aspects of the Bis(dithiolene) Chalcogenide Series [WIVQ(S2C2R2)2]2- (Q = O, S, Se)","Inorganic Chemistry","1999","38","","5389","5398","10.1021/ic9903329","","","0.71073","MoKα","","0.0742","0.0446","","0.1059","0.0979","","","","1.042","1.166","1.166","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322384","10.7384","0.0004","19.0581","0.0007","23.7849","0.0008","90","","98.926","0.001","90","","4808.7","0.3","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H68 N2 O S5 W -","- C48 H68 N2 O S5 W -","- C192 H272 N8 O4 S20 W4 -","4","1","","Christine A. Goddard; R. H. Holm","Synthesis and Reactivity Aspects of the Bis(dithiolene) Chalcogenide Series [WIVQ(S2C2R2)2]2- (Q = O, S, Se)","Inorganic Chemistry","1999","38","","5389","5398","10.1021/ic9903329","","","0.71073","MoKα","","0.0845","0.0423","","0.1085","0.0938","","","","1.11","1.244","1.244","","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322385","11.7885","0.0002","15.9465","0.0003","23.7428","0.0005","87.962","0.001","76.601","0.001","79.402","0.001","4267.63","0.14","213","2","213","2","","","","","","","","6","P -1","-P 1","2","","","","- C82 H99 N5 O S10 W2 -","- C82 H99 N5 O S10 W2 -","- C164 H198 N10 O2 S20 W4 -","2","1","","Christine A. Goddard; R. H. Holm","Synthesis and Reactivity Aspects of the Bis(dithiolene) Chalcogenide Series [WIVQ(S2C2R2)2]2- (Q = O, S, Se)","Inorganic Chemistry","1999","38","","5389","5398","10.1021/ic9903329","","","0.71073","MoKα","","0.083","0.0428","","0.1028","0.0936","","","","1.052","1.318","1.318","","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322386","19.58","0.004","23.655","0.006","21.797","0.006","90","","91.964","0.01","90","","10090","4","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H53.5 N1.5 S6 W -","- C56 H53.5 N1.5 S6 W -","- C448 H428 N12 S48 W8 -","8","2","","Christine A. Goddard; R. H. Holm","Synthesis and Reactivity Aspects of the Bis(dithiolene) Chalcogenide Series [WIVQ(S2C2R2)2]2- (Q = O, S, Se)","Inorganic Chemistry","1999","38","","5389","5398","10.1021/ic9903329","","","0.71073","MoKα","","0.0534","0.0289","","","0.0628","0.0722","","","","","","1.012","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322387","19.4108","0.0008","11.3257","0.0005","18.0304","0.0008","90","","106.166","0.001","90","","3807.1","0.3","213","2","213","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C42 H30 S6 W -","- C42 H30 S6 W -","- C168 H120 S24 W4 -","4","0.5","","Christine A. Goddard; R. H. Holm","Synthesis and Reactivity Aspects of the Bis(dithiolene) Chalcogenide Series [WIVQ(S2C2R2)2]2- (Q = O, S, Se)","Inorganic Chemistry","1999","38","","5389","5398","10.1021/ic9903329","","","0.71073","MoKα","","0.0493","0.0314","","0.0614","0.0573","","","","1.013","1.068","1.068","","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322388","20.7102","0.0015","10.8962","0.0012","11.7166","0.0013","90","","102.703","0.007","90","","2579.3","0.5","297","2","297","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C17 H40 Cl2 N2 O2 Si2 Zr -","- C17 H40 Cl2 N2 O2 Si2 Zr -","- C68 H160 Cl8 N8 O8 Si8 Zr4 -","4","0.5","","Lutz H. Gade; Stefan Friedrich; Dominique J. M. Trösch; Ian J. Scowen; Mary McPartlin","Heterodi- and Heterotrinuclear Complexes Containing Highly Polar Metal-Metal Bonds","Inorganic Chemistry","1999","38","","5295","5307","10.1021/ic990350q","","","0.71073","MoKα","","0.0956","0.0475","","0.0993","0.0844","","","","1.007","1.078","1.078","","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322389","10.477","0.002","26.883","0.004","9.996","0.0012","90","","113.113","0.014","90","","2589.4","0.7","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C21 H34 N2 O2 Ru Si2 Zr -","- C21 H24 N2 O2 Ru Si2 Zr -","- C84 H96 N8 O8 Ru4 Si8 Zr4 -","4","1","","Lutz H. Gade; Stefan Friedrich; Dominique J. M. Trösch; Ian J. Scowen; Mary McPartlin","Heterodi- and Heterotrinuclear Complexes Containing Highly Polar Metal-Metal Bonds","Inorganic Chemistry","1999","38","","5295","5307","10.1021/ic990350q","","","1.54178","CuKα","","0.0955","0.0674","","","0.1699","0.1986","","","","","","0.99","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322390","10.8252","0.0009","13.0511","0.0009","23.089","0.002","90","","95.72","0.006","90","","3245.8","0.5","571","2","571","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H37 N3 O4 Ru2 Si2 Zr -","- C25 H27 N3 O4 Ru2 Si2 Zr -","- C100 H108 N12 O16 Ru8 Si8 Zr4 -","4","1","","Lutz H. Gade; Stefan Friedrich; Dominique J. M. Trösch; Ian J. Scowen; Mary McPartlin","Heterodi- and Heterotrinuclear Complexes Containing Highly Polar Metal-Metal Bonds","Inorganic Chemistry","1999","38","","5295","5307","10.1021/ic990350q","","","0.71073","MoKα","","0.0529","0.0335","","","0.0764","0.0848","","","","","","1.037","","","","has coordinates,has disorder","179326","2020-10-21","18:00:00",""
"4322391","22.458","0.002","10.728","0.001","19.843","0.002","90","","90","","90","","4780.8","0.8","100","2","100","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C42 H50 Cu2 F12 N10 O2 P2 -","- C42 H50 Cu2 F12 N10 O2 P2 -","- C168 H200 Cu8 F48 N40 O8 P8 -","4","1","","Enrico Monzani; Giuseppe Battaini; Angelo Perotti; Luigi Casella; Michele Gullotti; Laura Santagostini; Giorgio Nardin; Lucio Randaccio; Silvano Geremia; Piero Zanello; Giuliana Opromolla","Mechanistic, Structural, and Spectroscopic Studies on the Catecholase Activity of a Dinuclear Copper Complex by Dioxygen","Inorganic Chemistry","1999","38","","5359","5369","10.1021/ic990397b","","","0.9","","","0.0919","0.0893","","0.2295","0.2252","","","","1.037","1.056","1.056","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322392","14.134","0.003","16.819","0.004","14.848","0.003","90","","107.85","0.02","90","","3359.8","1.3","130","2","130","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Zn(OEBSMe)","","","- C36 H46 N4 O S Zn -","- C36 H46 N4 O S Zn -","- C144 H184 N16 O4 S4 Zn4 -","4","1","","James A. Johnson; Marilyn M. Olmstead; Alan L. Balch","Reactivity of the Verdoheme Analogues. Opening of the Planar Macrocycle by Amide and Thiolate Nucleophiles To Form Helical Complexes","Inorganic Chemistry","1999","38","","5379","5383","10.1021/ic9904283","","","1.54178","CuKα","","0.1891","0.1016","","","0.2407","0.2866","","","","","","0.979","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322393","9.8828","0.0008","13.846","0.002","14.054","0.002","112.692","0.01","95.451","0.009","105.076","0.01","1671.5","0.4","130","2","130","2","","","","","","","","5","P -1","-P 1","2","Zn(OEBNMe~2~)","","","- C37 H49 N5 O Zn -","- C37 H49 N5 O Zn -","- C74 H98 N10 O2 Zn2 -","2","1","","James A. Johnson; Marilyn M. Olmstead; Alan L. Balch","Reactivity of the Verdoheme Analogues. Opening of the Planar Macrocycle by Amide and Thiolate Nucleophiles To Form Helical Complexes","Inorganic Chemistry","1999","38","","5379","5383","10.1021/ic9904283","","","1.54178","CuKα","","0.1028","0.0763","","","0.2111","0.2296","","","","","","1.045","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322394","12.1416","0.0008","12.889","0.0009","17.3455","0.0013","84.18","0.002","80.976","0.002","64.847","0.002","2424.8","0.3","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C41 H28 Cl F26 O P2 Rh -","- C41 H28 Cl F26 O P2 Rh -","- C82 H56 Cl2 F52 O2 P4 Rh2 -","2","1","","Dale C. Smith; Edwin D. Stevens; Steven P. Nolan","Synthetic, Thermochemical, and Catalytic Studies of Fluorinated Tertiary Phosphine Ligands R2PRf [R = Cy, Ph, iPr; Rf= CH'2CH2(CF2)5CF3] in Rhodium Systems","Inorganic Chemistry","1999","38","","5277","5281","10.1021/ic990430u","","","0.71073","MoKα","","0.192","0.0766","","","0.1875","0.2039","","","","","","0.807","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322395","12.424","0.003","19.497","0.004","16.504","0.004","90","","93.63","0.02","90","","3989.8","1.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C35 H47 N3 O2 Ru Si4 Ti -","- C35 H47 N3 O2 Ru Si4 Ti -","- C140 H188 N12 O8 Ru4 Si16 Ti4 -","4","1","","Lutz H. Gade; Martin Schubart; Bernd Findeis; Sylvie Fabre; Izoldi Bezougli; Matthias Lutz; Ian J. Scowen; Mary McPartlin","Synthesis and Reactivity of Early-Late Heterodinuclear Complexes Stabilized by a Trisilylsilane-Based Tripodal Amido Ligand","Inorganic Chemistry","1999","38","","5282","5294","10.1021/ic990562n","","","0.71073","MoKα","","0.0744","0.0431","","0.1418","0.1042","","","","1.076","1.128","1.128","","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322396","12.426","0.003","14.51","0.003","16.742","0.004","115.406","0.017","96.302","0.013","96.682","0.015","2664.9","1.2","296","2","296","2","","","","","","","","8","P -1","-P 1","2","","","","- C40.75 H55.75 N3 O4 Ru S2 Si4 Zr -","- C40.75 H55.75 N3 O4 Ru S2 Si4 Zr -","- C81.5 H111.5 N6 O8 Ru2 S4 Si8 Zr2 -","2","1","","Lutz H. Gade; Martin Schubart; Bernd Findeis; Sylvie Fabre; Izoldi Bezougli; Matthias Lutz; Ian J. Scowen; Mary McPartlin","Synthesis and Reactivity of Early-Late Heterodinuclear Complexes Stabilized by a Trisilylsilane-Based Tripodal Amido Ligand","Inorganic Chemistry","1999","38","","5282","5294","10.1021/ic990562n","","","0.71073","MoKα","","0.1602","0.0705","","","0.1505","0.1758","","","","","","0.953","","","","has coordinates","179326","2020-10-21","18:00:00",""
"4322397","20.479","0.003","14.92","0.002","19.671","0.003","90","","90.591","0.004","90","","6010.1","1.5","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H20 Cu2 N12 O10.4 -","- C24 H20 Cu2 N12 O10.4 -","- C192 H160 Cu16 N96 O83.2 -","8","1","","Craig J. Matthews; Karen Avery; Zhiqiang Xu; Laurence K. Thompson; Liang Zhao; David O. Miller; Kumar Biradha; Karen Poirier; Michael J. Zaworotko; Claire Wilson; Andrés E. Goeta; Judith A. K. Howard","Tetranuclear Copper(II) and Nickel(II) Cluster Complexes Derived by Self-Assembly from a Series of Tetradentate Diazine Ligands: Structural and Magnetic Studies","Inorganic Chemistry","1999","38","","5266","5276","10.1021/ic990598f","","","0.71073","MoKα","","0.0875","0.065","","","0.1285","0.1365","","","","","","1.536","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322398","14.3573","0.0004","10.891","0.0006","20.536","0.001","90","","96.975","0.004","90","","3187.4","0.3","150","2","150","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C22 H27 Cu2 N14 O12.5 -","- C22 H27 Cu2 N14 O12.5 -","- C88 H108 Cu8 N56 O50 -","4","1","","Craig J. Matthews; Karen Avery; Zhiqiang Xu; Laurence K. Thompson; Liang Zhao; David O. Miller; Kumar Biradha; Karen Poirier; Michael J. Zaworotko; Claire Wilson; Andrés E. Goeta; Judith A. K. Howard","Tetranuclear Copper(II) and Nickel(II) Cluster Complexes Derived by Self-Assembly from a Series of Tetradentate Diazine Ligands: Structural and Magnetic Studies","Inorganic Chemistry","1999","38","","5266","5276","10.1021/ic990598f","","","0.71073","MoKα","","0.0431","0.0326","","","0.0721","0.0784","","","","","","1.065","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322399","12.0509","0.0006","12.7498","0.0006","23.1208","0.0011","93.105","0.001","100.15","0.001","108.505","0.001","3292.9","0.3","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H53 N23.5 Ni4 O24.5 -","- C48 H53 N23.5 Ni4 O24.5 -","- C96 H106 N47 Ni8 O49 -","2","1","","Craig J. Matthews; Karen Avery; Zhiqiang Xu; Laurence K. Thompson; Liang Zhao; David O. Miller; Kumar Biradha; Karen Poirier; Michael J. Zaworotko; Claire Wilson; Andrés E. Goeta; Judith A. K. Howard","Tetranuclear Copper(II) and Nickel(II) Cluster Complexes Derived by Self-Assembly from a Series of Tetradentate Diazine Ligands: Structural and Magnetic Studies","Inorganic Chemistry","1999","38","","5266","5276","10.1021/ic990598f","","","0.71073","MoKα","","0.0871","0.0659","","0.2171","0.1992","","","","1.03","1.086","1.086","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322400","22.646","0.004","25.842","0.005","12.349","0.005","90","","100.34","0.02","90","","7109","3","299.2","","299.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C48 H48 Cl4 Cu4 N20 O28 -","- C48 H38 Cl3.5 Cu4 N20 O27.6 -","- C192 H152 Cl14 Cu16 N80 O110.4 -","4","0.5","","Craig J. Matthews; Karen Avery; Zhiqiang Xu; Laurence K. Thompson; Liang Zhao; David O. Miller; Kumar Biradha; Karen Poirier; Michael J. Zaworotko; Claire Wilson; Andrés E. Goeta; Judith A. K. Howard","Tetranuclear Copper(II) and Nickel(II) Cluster Complexes Derived by Self-Assembly from a Series of Tetradentate Diazine Ligands: Structural and Magnetic Studies","Inorganic Chemistry","1999","38","","5266","5276","10.1021/ic990598f","","","1.5418","CuKα","","0.1108","0.08","","0.086","","0.085","","","4.305","","","4.99","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322401","14.368","0.004","25.469","0.007","18.479","0.005","90","","90","","90","","6762","3","100","2","100","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C44 H54 Cl4 N24 Ni4 O28 -","- C44 H54 Cl4 N24 Ni4 O28 -","- C176 H216 Cl16 N96 Ni16 O112 -","4","0.5","","Craig J. Matthews; Karen Avery; Zhiqiang Xu; Laurence K. Thompson; Liang Zhao; David O. Miller; Kumar Biradha; Karen Poirier; Michael J. Zaworotko; Claire Wilson; Andrés E. Goeta; Judith A. K. Howard","Tetranuclear Copper(II) and Nickel(II) Cluster Complexes Derived by Self-Assembly from a Series of Tetradentate Diazine Ligands: Structural and Magnetic Studies","Inorganic Chemistry","1999","38","","5266","5276","10.1021/ic990598f","","","0.71073","MoKα","","0.0871","0.0449","","","0.1043","0.1194","","","","","","1.022","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322402","18.081","0.01","26.406","0.015","17.191","0.011","93.84","0.03","102.89","0.03","89.03","0.03","7983","8","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C141 H118 Cl10 Mn12 O48 P -","- C145.661 Cl3.16161 Mn12 O47.4 P -","- C291.322 Cl6.32321 Mn24 O94.8 P2 -","2","1","","Sheila M. J. Aubin; Ziming Sun; Luca Pardi; J. Krzystek; Kirsten Folting; Louis-Claude Brunel; Arnold L. Rheingold; George Christou; David N. Hendrickson","Reduced Anionic Mn12 Molecules with Half-Integer Ground States as Single-Molecule Magnets","Inorganic Chemistry","1999","38","","5329","5340","10.1021/ic990613g","","","0.71069","MoKα","","","0.146","","","","0.152","","","","","","3.0493","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322403","13.0342","0.0005","13.0342","0.0005","13.6775","0.0007","90","","90","","120","","2012.36","0.15","223","2","223","2","","","","","","","synthesis","5","P 63/m c m","-P 6c 2","193","","","","- C26 H22 Co2 N12 Sn3 -","- C25.92 Co2 N12 Sn3 -","- C51.84 Co4 N24 Sn6 -","2","0.0833333","","Tianyan Niu; Allan J. Jacobson","Syntheses and Structural Characterizations of the Three-dimensional Polymers [(R2Sn)3{Co(CN)6}2.X] (R = Vinyl, Propyl, Butyl; X = Solvent)","Inorganic Chemistry","1999","38","","5346","5350","10.1021/ic990648g","","","0.71073","MoKα","","0.0205","0.0198","","0.0551","0.0551","","","","1.515","1.517","1.517","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322404","13.7408","0.0005","13.7408","0.0005","13.3631","0.0007","90","","90","","120","","2185.05","0.16","223","2","223","2","","","","","","","","5","P 63/m c m","-P 6c 2","193","","","","- C36 H54 Co2 N12 Sn3 -","- C35.28 Co2 N12 Sn3 -","- C70.56 Co4 N24 Sn6 -","2","0.0833333","","Tianyan Niu; Allan J. Jacobson","Syntheses and Structural Characterizations of the Three-dimensional Polymers [(R2Sn)3{Co(CN)6}2.X] (R = Vinyl, Propyl, Butyl; X = Solvent)","Inorganic Chemistry","1999","38","","5346","5350","10.1021/ic990648g","","","0.71073","MoKα","","0.0531","0.0472","","0.1165","0.1088","","","","1.287","1.297","1.297","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322405","13.4766","0.0005","13.4766","0.0005","13.3615","0.0007","90","","90","","120","","2101.58","0.16","223","2","223","2","","","","","","","synthesis","5","P 63/m c m","-P 6c 2","193","","","","- C30 H42 Co2 N12 Sn3 -","- C29.4 H44.88 Co2 N12 Sn3 -","- C58.8 H89.76 Co4 N24 Sn6 -","2","0.0833333","","Tianyan Niu; Allan J. Jacobson","Syntheses and Structural Characterizations of the Three-dimensional Polymers [(R2Sn)3{Co(CN)6}2.X] (R = Vinyl, Propyl, Butyl; X = Solvent)","Inorganic Chemistry","1999","38","","5346","5350","10.1021/ic990648g","","","0.71073","MoKα","","0.0226","0.019","","0.0605","0.057","","","","1.229","1.233","1.233","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322406","11.7101","0.0002","15.8196","0.0002","24.424","0.0004","90","","92.339","0.001","90","","4520.75","0.12","217","2","217","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H49 B Cl6 P2 Ru -","- C44 H49 B Cl6 P2 Ru -","- C176 H196 B4 Cl24 P8 Ru4 -","4","1","","Paul McQuade; Nigam P. Rath; Lawrence Barton","[BH3.PPh2CH2C6H4CH2PPh2.Ru(p-cym)Cl2]: A New Bifunctional Compound and Prototype of a Linked Borane/Metal Cluster Species","Inorganic Chemistry","1999","38","","5468","5470","10.1021/ic990687s","","","0.71073","MoKα","","0.078","0.0534","","","0.1332","0.1504","","","","","","1.027","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322407","10.7986","0.0002","12.0402","0.0003","19.9108","0.0005","90","","98.259","0.001","90","","2561.9","0.1","295","2","295","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C51 H53 B5 Cl3 O Os P3 -","- C51 H46 B5 Cl3 O Os P3 -","- C102 H92 B10 Cl6 O2 Os2 P6 -","2","1","","Paul McQuade; Kevin Hupp; Jonathan Bould; Hong Fang; Nigam P. Rath; Rhodri Ll. Thomas; Lawrence Barton","Degradation and Modification of Metallaboranes: Reactions of the Hexaborane(10) Analogue nido-(PPh3)2(CO)OsB5H9 with Phosphines and the Crystal and Molecular Structure of [2,2,2-(PPh3)2(CO)-nido-2-OsB4H7-3-BH2.PPh2Me]","Inorganic Chemistry","1999","38","","5415","5424","10.1021/ic990688k","","","0.71073","MoKα","","0.1099","0.0741","","","0.1676","0.1855","","","","","","1.018","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322408","8.3508","0.0002","26.4703","0.0007","15.2778","0.0003","90","","99.816","0.001","90","","3327.69","0.14","158","2","158","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H40 N Ni O2 S8 -","- C26 H40 N Ni O2 S8 -","- C104 H160 N4 Ni4 O8 S32 -","4","1","","Christopher E. Keefer; Suzanne T. Purrington; Robert D. Bereman; Paul D. Boyle","The First Systematic Synthesis of Heterobimetallic Dithiolene-Bridged Complexes. Synthesis and Characterization of Metal Complexes of 4-(1',2'-Ethylenedithiolate)-1,3-dithiole-2-one and Dimeric Metal Complexes of 1,2,3,4-Butadienetetrathiolate","Inorganic Chemistry","1999","38","","5437","5442","10.1021/ic990841a","","","0.71073","MoKα","","0.1201","0.0834","","0.2167","0.1948","","","","1.1","1.189","1.189","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322409","13.0388","0.0004","9.2048","0.0003","16.2384","0.0005","90","","97.289","0.005","90","","1933.18","0.11","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H15 O2 Pt S6 -","- C16 H15 O2 Pt S6 -","- C64 H60 O8 Pt4 S24 -","4","1","","Christopher E. Keefer; Suzanne T. Purrington; Robert D. Bereman; Paul D. Boyle","The First Systematic Synthesis of Heterobimetallic Dithiolene-Bridged Complexes. Synthesis and Characterization of Metal Complexes of 4-(1',2'-Ethylenedithiolate)-1,3-dithiole-2-one and Dimeric Metal Complexes of 1,2,3,4-Butadienetetrathiolate","Inorganic Chemistry","1999","38","","5437","5442","10.1021/ic990841a","","","0.71073","MolybdenumKα","","0.035","0.035","","0.047","0.046","","","","","1.48","1.48","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322410","35.2264","0.0009","11.4548","0.0003","14.3656","0.0004","90","","101.645","0.001","90","","5677.4","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H35 Cl6 N3 O Te3 -","- C16 H27 Cl6 N3 O Te3 -","- C128 H216 Cl48 N24 O8 Te24 -","8","1","","Tristram Chivers; Gary D. Enright; Nicole Sandblom; Gabriele Schatte; Masood Parvez","Synthesis and Reactions of tert-Butylimidotellurium Dihalides: X-ray Structures of [Cl2Te(μ-NtBu)2TeCl2]3 and (tBuO)2Te(μ-NtBu)2Te(OtBu)2","Inorganic Chemistry","1999","38","","5431","5436","10.1021/ic990849k","","","0.71073","MoKα","","0.0396","0.0249","","","0.0567","0.0598","","","","","","0.966","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322411","9.646","0.004","10.899","0.005","9.439","0.003","94.12","0.04","118.89","0.03","65.26","0.03","778.4","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H27 N O2 Te -","- C12 H27 N O2 Te -","- C24 H54 N2 O4 Te2 -","2","1","","Tristram Chivers; Gary D. Enright; Nicole Sandblom; Gabriele Schatte; Masood Parvez","Synthesis and Reactions of tert-Butylimidotellurium Dihalides: X-ray Structures of [Cl2Te(μ-NtBu)2TeCl2]3 and (tBuO)2Te(μ-NtBu)2Te(OtBu)2","Inorganic Chemistry","1999","38","","5431","5436","10.1021/ic990849k","","","0.71069","MoKα","","0.0398","0.0353","","","0.0936","0.0966","","","","","","1.129","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322412","11.3944","0.0009","13.196","0.002","19.528","0.0014","90","","96.191","0.005","90","","2919.1","0.5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H34 N2 O4 Ru2 Si2 Zr -","- C23 H24 N2 O4 Ru2 Si2 Zr -","- C92 H96 N8 O16 Ru8 Si8 Zr4 -","4","1","","Lutz H. Gade; Stefan Friedrich; Dominique J. M. Trösch; Ian J. Scowen; Mary McPartlin","Heterodi- and Heterotrinuclear Complexes Containing Highly Polar Metal-Metal Bonds","Inorganic Chemistry","1999","38","","5295","5307","10.1021/ic990350q","","","1.54178","CuKα","","0.0421","0.0379","","","0.0961","0.0989","","","","","","1.111","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322413","19.903","0.002","10.572","0.004","19.111","0.003","90","","112.939","0.009","90","","3703.2","1.6","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C32 H38 F3 Fe N3 O2 Si4 Ti -","- C32 H38 F3 Fe N3 O2 Si4 Ti -","- C128 H152 F12 Fe4 N12 O8 Si16 Ti4 -","4","1","","Lutz H. Gade; Martin Schubart; Bernd Findeis; Sylvie Fabre; Izoldi Bezougli; Matthias Lutz; Ian J. Scowen; Mary McPartlin","Synthesis and Reactivity of Early-Late Heterodinuclear Complexes Stabilized by a Trisilylsilane-Based Tripodal Amido Ligand","Inorganic Chemistry","1999","38","","5282","5294","10.1021/ic990562n","","","0.71073","MoKα","","0.2591","0.0974","","","0.1248","0.1574","","","","","","0.922","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322414","10.815","0.002","37.894","0.009","20.798","0.004","90","","100.554","0.014","90","","8379","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C37 H50 N4 O2 Ru Si4 Ti -","- C37 H50 N4 O2 Ru Si4 Ti -","- C296 H400 N32 O16 Ru8 Si32 Ti8 -","8","2","","Lutz H. Gade; Martin Schubart; Bernd Findeis; Sylvie Fabre; Izoldi Bezougli; Matthias Lutz; Ian J. Scowen; Mary McPartlin","Synthesis and Reactivity of Early-Late Heterodinuclear Complexes Stabilized by a Trisilylsilane-Based Tripodal Amido Ligand","Inorganic Chemistry","1999","38","","5282","5294","10.1021/ic990562n","","","0.71073","MoKα","","0.123","0.0586","","","0.1212","0.1606","","","","","","1.074","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322415","10.995","0.002","20.83","0.004","19.567","0.004","90","","116.94","0.03","90","","3995","1.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","di-[(N,N'-ethylenebis(salicylideneiminato)nickel(ii)]-tetrahydrofuran-barium (ii)perchlorate","","- C36 H36 Ba Cl2 N4 Ni2 O13 -","- C36 H36 Ba Cl2 N4 Ni2 O13 -","- C144 H144 Ba4 Cl8 N16 Ni8 O52 -","4","1","","Laura Carbonaro; Mauro Isola; Piero La Pegna; Lucio Senatore; Fabio Marchetti","Spectrophotometric Study of the Equilibria between Nickel(II) Schiff-Base Complexes and Alkaline Earth or Nickel(II) Cations in Acetonitrile Solution","Inorganic Chemistry","1999","38","","5519","5525","10.1021/ic990189j","","","0.71073","MoKα","","0.1627","0.0766","","","0.1502","0.1896","","","","","","1.01","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322416","10.302","0.0015","21.818","0.003","17.796","0.004","90","","118.98","0.02","90","","3499.1","1.3","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","di-[(N,N'-ethylenebis(salicylideneiminato)nickel(ii)]-di-aquo-nickel(ii)perc hlorate","","- C32 H32 Cl2 N4 Ni3 O14 -","- C32 H32 Cl2 N4 Ni3 O14 -","- C128 H128 Cl8 N16 Ni12 O56 -","4","0.5","","Laura Carbonaro; Mauro Isola; Piero La Pegna; Lucio Senatore; Fabio Marchetti","Spectrophotometric Study of the Equilibria between Nickel(II) Schiff-Base Complexes and Alkaline Earth or Nickel(II) Cations in Acetonitrile Solution","Inorganic Chemistry","1999","38","","5519","5525","10.1021/ic990189j","","","0.71073","MoKα","","0.1186","0.065","","","0.1396","0.165","","","","","","1.01","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322417","26.804","0.003","10.948","0.001","19.459","0.002","90","","113.13","0.02","90","","5251.2","1.2","294","","294","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C58 H40 Cl4 N12 Ni -","- C58 H40 Cl4 N12 Ni0.5 -","- C232 H160 Cl16 N48 Ni2 -","4","0.5","","Hugues Duval; Véronique Bulach; Jean Fischer; Raymond Weiss","Four-Coordinate, Low-Spin (S= 0) and Six-Coordinate, High-Spin (S= 1) Nickel(II) Complexes of Tetraphenylporphyrins with β-Pyrrole Electron-Withdrawing Substituents: Porphyrin-Core Expansion and Conformation","Inorganic Chemistry","1999","38","","5495","5501","10.1021/ic990231a","","","0.71073","Mo-Kα","","0.127","0.047","","0.189","","0.067","","","3.664","","","1.246","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322418","13.741","0.001","14.029","0.002","15.201","0.002","89.037","0.009","70.829","0.008","67.607","0.008","2539.4","0.6","294","","294","","","","","","","","","6","P -1","-P 1","2","","","","- C53 H30 Br4 Cl5 N8 Ni -","- C57 H30 Br4 Cl5 N8 Ni -","- C114 H60 Br8 Cl10 N16 Ni2 -","2","1","","Hugues Duval; Véronique Bulach; Jean Fischer; Raymond Weiss","Four-Coordinate, Low-Spin (S= 0) and Six-Coordinate, High-Spin (S= 1) Nickel(II) Complexes of Tetraphenylporphyrins with β-Pyrrole Electron-Withdrawing Substituents: Porphyrin-Core Expansion and Conformation","Inorganic Chemistry","1999","38","","5495","5501","10.1021/ic990231a","","","0.71073","Mo-Kα","","0.15","0.048","","0.201","","0.064","","","4.193","","","1.197","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322419","11.9472","0.0009","14.3651","0.0007","19.556","0.001","87.049","0.005","73.181","0.006","70.613","0.005","3026.8","0.3","173","","173","","","","","","","","","6","P -1","-P 1","2","","","","- C63 H40 Br4 Cl5 N10 Ni -","- C67 H40 Br4 Cl5 N10 Ni -","- C134 H80 Br8 Cl10 N20 Ni2 -","2","1","","Hugues Duval; Véronique Bulach; Jean Fischer; Raymond Weiss","Four-Coordinate, Low-Spin (S= 0) and Six-Coordinate, High-Spin (S= 1) Nickel(II) Complexes of Tetraphenylporphyrins with β-Pyrrole Electron-Withdrawing Substituents: Porphyrin-Core Expansion and Conformation","Inorganic Chemistry","1999","38","","5495","5501","10.1021/ic990231a","","","0.71073","Mo-Kα","","0.137","0.036","","0.16","","0.041","","","4.387","","","1.051","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322420","11.108","0.002","8.886","0.002","15.397","0.003","90","","90","","90","","1519.8","0.5","115","2","293","2","","","","","","","","4","P c c a","-P 2a 2ac","54","","","","- C7 H2 Cu6 N8 -","- C3.5 H Cu3 N4 -","- C28 H8 Cu24 N32 -","8","1","","Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta","Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused ""Slinky"", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family","Inorganic Chemistry","1999","38","","5484","5494","10.1021/ic990385q","","","0.71073","MoKα","","0.0304","0.024","","","0.0608","0.0627","","","","","","1.026","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322421","9.1183","0.0005","9.9838","0.0006","12.7545","0.0008","94.206","0.001","90.492","0.001","112.534","0.001","1068.72","0.11","115","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H24 Cu10 N22 -","- C34 H24 Cu10 N22 -","- C34 H24 Cu10 N22 -","1","0.5","","Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta","Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused ""Slinky"", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family","Inorganic Chemistry","1999","38","","5484","5494","10.1021/ic990385q","","","0.71073","MoKα","","0.0544","0.0414","","","0.1028","0.1113","","","","","","1.046","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322422","9.7582","0.0001","17.1622","0.0002","9.901","","90","","106.869","0.001","90","","1586.79","0.03","115","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H20 Cu6 N14 -","- C28 H20 Cu6 N14 -","- C56 H40 Cu12 N28 -","2","0.5","","Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta","Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused ""Slinky"", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family","Inorganic Chemistry","1999","38","","5484","5494","10.1021/ic990385q","","","0.71073","MoKα","","0.0331","0.0265","","","0.0574","0.0594","","","","","","1.058","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322423","8.542","0.002","9.802","0.002","20.439","0.004","82.468","0.005","83.126","0.005","79.832","0.005","1661.7","0.6","115","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H10 Cu3 N7 -","- C16 H10 Cu3 N7 -","- C64 H40 Cu12 N28 -","4","2","","Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta","Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused ""Slinky"", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family","Inorganic Chemistry","1999","38","","5484","5494","10.1021/ic990385q","","","0.71073","MoKα","","0.0522","0.0421","","","0.1052","0.1094","","","","","","1.01","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322424","11.59","0.003","20.555","0.004","16.158","0.003","90","","103.865","0.005","90","","3737.2","1.4","115","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H10 Cu4 N8 -","- C17 H10 Cu4 N8 -","- C136 H80 Cu32 N64 -","8","2","","Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta","Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused ""Slinky"", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family","Inorganic Chemistry","1999","38","","5484","5494","10.1021/ic990385q","","","0.71073","MoKα","","0.0403","0.0327","","","0.0792","0.0824","","","","","","1.015","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322425","7.4655","0.0015","8.952","0.0018","11.116","0.002","90","","92.816","0.005","90","","742","0.2","115","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H8 Cu5 N6 O4 -","- C6 Cu5 N6 O4 -","- C12 Cu10 N12 O8 -","2","0.5","","Douglas J. Chesnut; Anakarin Kusnetzow; Robert Birge; Jon Zubieta","Ligand Influences on Copper Cyanide Solid-State Architecture: Flattened and Fused ""Slinky"", Corrugated Sheet, and Ribbon Motifs in the Copper-Cyanide-Triazolate-Organoamine Family","Inorganic Chemistry","1999","38","","5484","5494","10.1021/ic990385q","","","0.71073","MoKα","","0.0706","0.0442","","","0.0968","0.1067","","","","","","0.983","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322426","15.509","0.006","10.936","0.004","17.491","0.005","90","","96.53","0.03","90","","2947.3","1.8","153.2","","153.2","","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C29 H23 Cl2 Cu F10 N4 O0.5 -","- C29.5 Cl2 Cu F10 N4 O -","- C118 Cl8 Cu4 F40 N16 O4 -","4","1","","Christina Ng; Michal Sabat; Cassandra L. Fraser","Metal Complexes with Cis α Topology from Stereoselective Quadridentate Ligands with Amine, Pyridine, and Quinoline Donor Groups","Inorganic Chemistry","1999","38","","5545","5556","10.1021/ic990475v","","","0.7107","MoKalpha","","","0.0566","","","0.0778","","","","","2.274","2.274","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322427","7.8987","0.0008","14.976","0.002","10.7734","0.0013","90","0.02","96.242","0.011","90","0.013","1266.8","0.3","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C14 H12 O4 S -","- C14 H12 O4 S -","- C56 H48 O16 S4 -","4","1","","Peter W. Roesky; Markus R. Bürgstein","Bridged Aminotroponiminate Complexes of the Lanthanides","Inorganic Chemistry","1999","38","","5629","5632","10.1021/ic990533c","","","0.71073","MoKa","","0.041","0.0392","","0.116","0.1109","","","","1.079","1.051","1.051","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322428","8.506","0.002","8.202","0.002","13.789","0.003","90","","96.14","0.03","90","","956.5","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H13 N O -","- C10 H13 N O -","- C40 H52 N4 O4 -","4","1","","Peter W. Roesky; Markus R. Bürgstein","Bridged Aminotroponiminate Complexes of the Lanthanides","Inorganic Chemistry","1999","38","","5629","5632","10.1021/ic990533c","","","0.71073","MoKa","","0.1097","0.0779","","0.2901","0.2192","","","","1.133","1.097","1.097","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322429","12.714","0.003","32.835","0.007","16.193","0.003","90","","110.62","0.03","90","","6327","3","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C62 H92 Cl2 N8 Nd2 O4 -","- C62 H92 Cl2 N8 Nd2 O4 -","- C248 H368 Cl8 N32 Nd8 O16 -","4","1","","Peter W. Roesky; Markus R. Bürgstein","Bridged Aminotroponiminate Complexes of the Lanthanides","Inorganic Chemistry","1999","38","","5629","5632","10.1021/ic990533c","","","0.71073","MoKa","","0.2459","0.0887","","0.2757","0.1987","","","","0.861","1.149","1.149","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322430","9.4158","0.0003","11.418","0.0004","13.082","0.0003","66.54","0.02","73.77","0.003","84.825","0.004","1238.4","0.2","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C25.5 H36 Cl Er N4 -","- C25.5 H30 Cl Er N4 -","- C51 H60 Cl2 Er2 N8 -","2","1","","Peter W. Roesky; Markus R. Bürgstein","Bridged Aminotroponiminate Complexes of the Lanthanides","Inorganic Chemistry","1999","38","","5629","5632","10.1021/ic990533c","","","0.71073","MoKa","","0.0186","0.0177","","0.0499","0.0489","","","","1.023","1.019","1.019","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322431","9.431","0.002","11.36","0.003","13.083","0.002","66.38","0.03","73.44","0.02","84.68","0.03","1230.6","0.6","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H72 Cl2 N8 Yb2 -","- C51 H60 Cl2 N8 Yb2 -","- C51 H60 Cl2 N8 Yb2 -","1","0.5","","Peter W. Roesky; Markus R. Bürgstein","Bridged Aminotroponiminate Complexes of the Lanthanides","Inorganic Chemistry","1999","38","","5629","5632","10.1021/ic990533c","","","0.71073","MoKα","","0.0252","0.0223","","0.0591","0.0562","","","","1.101","1.084","1.084","","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322432","9.685","0.005","12.176","0.006","13.978","0.007","87.382","0.009","87.358","0.009","68.689","0.009","1533.3","1.3","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H30 N P2 S2 Y -","- C34 H30 N P2 S2 Y -","- C68 H60 N2 P4 S4 Y2 -","2","1","","Christopher G. Pernin; James A. Ibers","Bis(cyclopentadienyl)yttrium Complexes of the Ligand [N(QPPh2)2]- (Q = S, Se): Synthesis, Structure, and NMR Properties of Cp2Y[η3-N(QPPh2)2]","Inorganic Chemistry","1999","38","","5478","5483","10.1021/ic990602n","","","0.71073","MoKα","","0.1154","0.0469","","","0.095","0.1197","","","","","","1.048","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322433","9.745","0.005","12.222","0.006","13.93","0.007","88.024","0.009","87.38","0.009","69.137","0.009","1548.4","1.4","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H30 N P2 Se2 Y -","- C34 H30 N P2 Se2 Y -","- C68 H60 N2 P4 Se4 Y2 -","2","1","","Christopher G. Pernin; James A. Ibers","Bis(cyclopentadienyl)yttrium Complexes of the Ligand [N(QPPh2)2]- (Q = S, Se): Synthesis, Structure, and NMR Properties of Cp2Y[η3-N(QPPh2)2]","Inorganic Chemistry","1999","38","","5478","5483","10.1021/ic990602n","","","0.71073","MoKα","","0.0926","0.0563","","","0.1209","0.1274","","","","","","1.158","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322434","18.557","0.0012","15.7307","0.001","28.0629","0.0018","90","","107.381","0.001","90","","7817.9","0.9","203","2","203","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C110 H240 Cl2 Li20 N16 O28 S8 -","- C110 H240 Cl2 Li20 N16 O28 S8 -","- C220 H480 Cl4 Li40 N32 O56 S16 -","2","0.5","","Justin K. Brask; Tristram Chivers; Glenn P. A. Yap","Template Effects of Lithium Salts on the Crystallization of Diazasulfates: X-ray Structures of {THF.Li2[O2S(NtBu)2]}8.2LiOH.2LiCl and {(THF.Li)2[O2S(NtBu)2].(THF)LiCl}2","Inorganic Chemistry","1999","38","","5588","5592","10.1021/ic990632q","","","0.71073","MoKα","","0.0819","0.0554","","","0.1575","0.1718","","","","","","1.07","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322435","11.583","0.003","17.126","0.005","13.891","0.004","90","","94.613","0.004","90","","2746.6","1.3","203","2","203","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C40 H84 Cl2 Li6 N4 O10 S2 -","- C40 H84 Cl2 Li6 N4 O10 S2 -","- C80 H168 Cl4 Li12 N8 O20 S4 -","2","0.5","","Justin K. Brask; Tristram Chivers; Glenn P. A. Yap","Template Effects of Lithium Salts on the Crystallization of Diazasulfates: X-ray Structures of {THF.Li2[O2S(NtBu)2]}8.2LiOH.2LiCl and {(THF.Li)2[O2S(NtBu)2].(THF)LiCl}2","Inorganic Chemistry","1999","38","","5588","5592","10.1021/ic990632q","","","0.71073","MoKα","","0.151","0.0586","","","0.1077","0.117","","","","","","1.078","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322436","23.0997","0.0002","23.0997","0.0002","23.0997","0.0002","90","","90","","90","","12325.9","0.18","203","2","203","2","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","","","- C114 H108 Br15 Cu8 P6 -","- C114 H108 Br15 Cu8 P6 -","- C456 H432 Br60 Cu32 P24 -","4","0.166667","","Graham A. Bowmaker; Peter D. W. Boyd; Clifton E. F. Rickard; Marcia L. Scudder; Ian G. Dance","The [Cu8Br15]6- Ion, A Crystal-Stabilized High-Symmetry Mixed-Valence Copper Complex with a Linear Halogen Bridge","Inorganic Chemistry","1999","38","","5476","5477","10.1021/ic990754i","","","0.71073","MoKα","","0.0801","0.0679","","","0.2194","0.2304","","","","","","1.088","","","","has coordinates","273129","2022-02-23","10:11:35",""
"4322437","10.974","0.003","8.575","0.005","14.898","0.005","90","","91.33","0.03","90","","1401.6","1","170.2","","170.2","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C11 H22 Li N O2 S -","- C11 H22 Li N O2 S -","- C44 H88 Li4 N4 O8 S4 -","4","1","","Tristram Chivers; Andrew Downard; Masood Parvez","Steric and Solvation Effects on the Aggregation of Lithium Thioamidates: Single-Strand Polymers with (LiS)n and (LiNCS)n Backbones","Inorganic Chemistry","1999","38","","5565","5570","10.1021/ic990759f","","","0.7107","MoKα","","0.0527","0.0527","","0.0433","0.0433","","","","1.776","1.776","1.776","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322438","9.129","0.002","11.099","0.002","12.537","0.002","90","","94.14","0.02","90","","1267","0.4","170.2","","170.2","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C10 H20 Li N O S -","- C10 H20 Li N O S -","- C40 H80 Li4 N4 O4 S4 -","4","1","","Tristram Chivers; Andrew Downard; Masood Parvez","Steric and Solvation Effects on the Aggregation of Lithium Thioamidates: Single-Strand Polymers with (LiS)n and (LiNCS)n Backbones","Inorganic Chemistry","1999","38","","5565","5570","10.1021/ic990759f","","","0.7107","MoKα","","0.0487","0.0487","","0.0475","0.0475","","","","1.873","1.873","1.873","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322439","24.693","0.008","19.464","0.004","18.592","0.004","90","","115.76","0.02","90","","8048","4","296.2","","296.2","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C46 H92 Cl4 N5 O2 Re6 S8 -","- C46 H10 Cl4 N6 O2 Re6 S8 -","- C184 H40 Cl16 N24 O8 Re24 S32 -","4","0.5","","Takashi Yoshimura; Keisuke Umakoshi; Yoichi Sasaki; A. Geoffrey Sykes","Synthesis, Structures, and Redox Properties of Octa(μ3-sulfido)hexarhenium(III) Complexes Having Terminal Pyridine Ligands","Inorganic Chemistry","1999","38","","5557","5564","10.1021/ic9907922","","","0.71073","MoKα","","0.0517","0.0517","","","0.0774","0.0774","","","","","","1.055","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322440","19.304","0.003","17.894","0.007","18.773","0.004","90","","90","","90","","6485","3","296.2","","296.2","","","","","","","","","6","C m c a","-C 2ac 2","64","","","","- C44 H80 Cl4 N6 Re6 S8 -","- C44.6 H8 Cl4 N6 Re6 S8 -","- C178.4 H32 Cl16 N24 Re24 S32 -","4","","","Takashi Yoshimura; Keisuke Umakoshi; Yoichi Sasaki; A. Geoffrey Sykes","Synthesis, Structures, and Redox Properties of Octa(μ3-sulfido)hexarhenium(III) Complexes Having Terminal Pyridine Ligands","Inorganic Chemistry","1999","38","","5557","5564","10.1021/ic9907922","","","0.71073","MoKα","","0.0431","0.0431","","","0.0509","0.0509","","","","","","1.047","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322441","16.156","0.005","19.76","0.005","18.895","0.004","90","","108.94","0.02","90","","5706","3","296.2","","296.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H51 Cl3 N4 Re6 S8 -","- C31 H15 Cl3 N4 Re6 S8 -","- C124 H60 Cl12 N16 Re24 S32 -","4","1","","Takashi Yoshimura; Keisuke Umakoshi; Yoichi Sasaki; A. Geoffrey Sykes","Synthesis, Structures, and Redox Properties of Octa(μ3-sulfido)hexarhenium(III) Complexes Having Terminal Pyridine Ligands","Inorganic Chemistry","1999","38","","5557","5564","10.1021/ic9907922","","","0.7107","MoKα","","0.055","0.055","","","0.0735","0.0735","","","","","","1.617","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322442","20.524","0.005","13.794","0.004","16.399","0.004","90","","109.72","0.02","90","","4370","2","296.2","","296.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H46 Cl4 N3 Re6 S8 -","- C26 H10 Cl4 N3 Re6 S8 -","- C104 H40 Cl16 N12 Re24 S32 -","4","0.5","","Takashi Yoshimura; Keisuke Umakoshi; Yoichi Sasaki; A. Geoffrey Sykes","Synthesis, Structures, and Redox Properties of Octa(μ3-sulfido)hexarhenium(III) Complexes Having Terminal Pyridine Ligands","Inorganic Chemistry","1999","38","","5557","5564","10.1021/ic9907922","","","0.7107","MoKα","","0.0885","0.0885","","","0.1342","0.1342","","","","","","1.261","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322443","16.0682","0.0004","16.0682","0.0004","18.719","0.0006","90","","90","","90","","4833","0.2","193","2","193","2","","","","","","","","6","P -4 2 c","P -4 2c","112","","","","- C64 H88 Cl3 Gd N16 O24 -","- C64 H84 Cl3 Gd N16 O24 -","- C128 H168 Cl6 Gd2 N32 O48 -","2","0.25","","Christophe Lescop; Dominique Luneau; Elie Belorizky; Pascal Fries; Maurice Guillot; Paul Rey","Unprecedented Antiferromagnetic Metal-Ligand Interactions in Gadolinium-Nitroxide Derivatives","Inorganic Chemistry","1999","38","","5472","5473","10.1021/ic990996i","","","0.71073","MoKα","","0.1082","0.0732","","0.2218","0.2051","","","","1.427","1.582","1.582","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322444","15.262","0.003","15.262","0.003","15.255","0.005","90","","90","","90","","3553.3","1.5","291","","291","","","","","","","","","6","I -4","I -4","82","","","","- C64 H68 Fe4 O8 P2 S8 -","- C64 H68 Fe4 O8 P2 S8 -","- C128 H136 Fe8 O16 P4 S16 -","2","0.25","","Jack Silver; George R. Fern; John R. Miller; Catherine A. McCammon; David J. Evans; G. Jeffery Leigh","Effects of Temperature and Pressure on the Mössbauer Spectra of Models for the [4Fe-4S]^2+^ Clusters of Iron-Sulfur Proteins and the Structure of [PPh~4~]~2~[Fe~4~S~4~(SCH~2~CO~2~C~2~H~5~)~4~]","Inorganic Chemistry","1999","38","","4256","4261","10.1021/ic980157g","","","0.71073","Mo-Kα","","0.05","0.05","","","0.057","","","","","1.422","1.422","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322445","35.6184","0.0002","35.6184","0.0002","13.5217","0.0001","90","","90","","120","","14856.3","0.16","158","2","158","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C55 H74 O8 S2 V2 -","- C55 H74 O8 S2 V2 -","- C495 H666 O72 S18 V18 -","9","0.5","","Charles R. Cornman; Katherine M. Geiser-Bush; Jeff W. Kampf","Vanadium(V) Complexes of 2,2'-Thiobis(4-methyl-6-tert-butylphenol) (H2mbp2S) and 2,2'-Sulfinylbis(4-methyl-6-tert-butylphenol) (H2mbp2SO)","Inorganic Chemistry","1999","38","","4303","4308","10.1021/ic9900253","","","0.71073","MoKα","","0.1332","0.0996","","0.2638","0.2359","","","","1.15","1.244","1.244","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322446","13.2894","0.0002","12.9652","0.0002","16.3639","0.0002","90","","102.43","0.001","90","","2753.41","0.07","158","2","158","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H35 N2 O4 S V -","- C26 H35 N2 O4 S V -","- C104 H140 N8 O16 S4 V4 -","4","1","","Charles R. Cornman; Katherine M. Geiser-Bush; Jeff W. Kampf","Vanadium(V) Complexes of 2,2'-Thiobis(4-methyl-6-tert-butylphenol) (H2mbp2S) and 2,2'-Sulfinylbis(4-methyl-6-tert-butylphenol) (H2mbp2SO)","Inorganic Chemistry","1999","38","","4303","4308","10.1021/ic9900253","","","0.71073","MoKα","","0.0811","0.0536","","0.1105","0.0996","","","","1.1","1.161","1.161","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322447","9.1567","0.0005","13.9314","0.0008","19.7196","0.0011","79.146","0.001","86.584","0.001","82.757","0.001","2449.2","0.2","158","2","158","2","","","","","","","","5","P -1","-P 1","2","","","","- C50 H70 O7 S2 V -","- C50 H70 O7 S2 V -","- C100 H140 O14 S4 V2 -","2","1","","Charles R. Cornman; Katherine M. Geiser-Bush; Jeff W. Kampf","Vanadium(V) Complexes of 2,2'-Thiobis(4-methyl-6-tert-butylphenol) (H2mbp2S) and 2,2'-Sulfinylbis(4-methyl-6-tert-butylphenol) (H2mbp2SO)","Inorganic Chemistry","1999","38","","4303","4308","10.1021/ic9900253","","","0.71073","MoKα","","0.2769","0.1448","","0.3687","0.3081","","","","1.068","1.385","1.385","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322448","22.196","0.0004","22.551","0.0004","11.394","0.0001","90","","90","","90","","5703.18","0.15","200.2","","200.2","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C57 H60 Cl4 P6 Pd2 -","- C57 H60 Cl4 P6 Pd2 -","- C228 H240 Cl16 P24 Pd8 -","4","1","","Tsutomu Mizuta; Shizuka Aoki; Koji Nakayama; Katsuhiko Miyoshi","A Sterically Enforced Bent Form of an Edge-Sharing Dipalladium(II) Complex Attained by a Linked-Bisphosphido Bridge","Inorganic Chemistry","1999","38","","4361","4364","10.1021/ic990032r","","","0.7107","MoKα","","","0.0343","","","0.0392","","","","","3.964","3.964","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322449","12.37","0.0002","24.23","0.0002","45.186","0.0006","90","","92.492","0.001","90","","13530.6","0.3","200.2","","200.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C67.5 H65 Cl5 P6 Pd2 -","- C67.375 H64 Cl4.75 P6 Pd2 -","- C539 H512 Cl38 P48 Pd16 -","8","2","","Tsutomu Mizuta; Shizuka Aoki; Koji Nakayama; Katsuhiko Miyoshi","A Sterically Enforced Bent Form of an Edge-Sharing Dipalladium(II) Complex Attained by a Linked-Bisphosphido Bridge","Inorganic Chemistry","1999","38","","4361","4364","10.1021/ic990032r","","","0.7107","MoKα","","","0.0642","","","0.0681","","","","","0.373","0.373","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322450","8.873","0.002","17.394","0.006","21.778","0.003","90","","90","","90","","3361.2","1.5","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C24 H28 Cl8 Nb2 P4 -","- C24 H28 Cl8 Nb2 P4 -","- C96 H112 Cl32 Nb8 P16 -","4","0.5","","Joseph T. Scheper; Kumudini C. Jayaratne; Louise M. Liable-Sands; Glenn P. A. Yap; Arnold L. Rheingold; Charles H. Winter","Synthesis, Structure, and Chemical Vapor Deposition Studies of Molecular Precursors to NbP Films","Inorganic Chemistry","1999","38","","4354","4360","10.1021/ic990198s","","","0.71073","MoKα","","0.0441","0.0284","","0.0621","0.0602","","","","0.835","0.989","0.989","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322451","18.905","0.004","13.732","0.003","17.101","0.003","90","","110.29","0.03","90","","4164","1.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H40 F18 Mo N2 S6 -","- C28 H40 F18 Mo N2 S6 -","- C112 H160 F72 Mo4 N8 S24 -","4","0.5","","Kun Wang; Jonathan M. McConnachie; Edward I. Stiefel","Syntheses of Metal Dithiolene Complexes from Thiometalates by Induced Internal Redox Reactions","Inorganic Chemistry","1999","38","","4334","4341","10.1021/ic990204k","","","0.71073","MoKα","","0.0688","0.0454","","0.1256","0.1098","","","","1.092","1.125","1.125","","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322452","18.933","0.004","13.728","0.003","17.096","0.003","90","","110.26","0.03","90","","4168.5","1.7","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H40 F18 N2 S6 W -","- C28 H40 F18 N2 S6 W -","- C112 H160 F72 N8 S24 W4 -","4","0.5","","Kun Wang; Jonathan M. McConnachie; Edward I. Stiefel","Syntheses of Metal Dithiolene Complexes from Thiometalates by Induced Internal Redox Reactions","Inorganic Chemistry","1999","38","","4334","4341","10.1021/ic990204k","","","0.71073","MoKα","","0.0424","0.0312","","0.0743","0.0691","","","","1.037","1.047","1.047","","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322453","12.2","0.002","18.63","0.004","15.463","0.003","90","","91.02","0.03","90","","3514","1.2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H40 F12 N2 O S4 W -","- C24 H40 F12 N2 O S4 W -","- C96 H160 F48 N8 O4 S16 W4 -","4","1","","Kun Wang; Jonathan M. McConnachie; Edward I. Stiefel","Syntheses of Metal Dithiolene Complexes from Thiometalates by Induced Internal Redox Reactions","Inorganic Chemistry","1999","38","","4334","4341","10.1021/ic990204k","","","0.71073","MoKα","","0.0757","0.0456","","0.1067","0.093","","","","1.09","1.127","1.127","","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322454","9.6795","0.0014","9.6795","0.0014","13.951","0.003","90","","90","","120","","1132","0.3","293","2","293","2","","","","","","","","4","P 63/m","-P 6c","176","","","","- C12 F18 Mo S6 -","- C8 F12 Mo0.666667 S4 -","- C24 F36 Mo2 S12 -","3","0.25","","Kun Wang; Jonathan M. McConnachie; Edward I. Stiefel","Syntheses of Metal Dithiolene Complexes from Thiometalates by Induced Internal Redox Reactions","Inorganic Chemistry","1999","38","","4334","4341","10.1021/ic990204k","","","0.71073","MoKα","","0.1062","0.1036","","0.2854","0.2836","","","","1.144","1.177","1.177","","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322455","10.9939","0.0005","9.9171","0.0004","14.826","0.0008","90","","94.721","0.003","90","","1610.96","0.13","193","","193","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Lithium Tetrahydridoborate 3 Pyridine","","- C15 H19 B Li N3 -","- C15 H19 B Li N3 -","- C60 H76 B4 Li4 N12 -","4","1","","Hans-Hermann Giese; Tassilo Habereder; Heinrich Nöth; Werner Ponikwar; Steffen Thomas; Marcus Warchhold","Metal Tetrahydridoborates and Tetrahydridoborato Metalates. 23.1 Amine Solvates of Lithium and Sodium Tetrahydridoborate","Inorganic Chemistry","1999","38","","4188","4196","10.1021/ic990205c","","","0.71073","MoKα","","0.0955","0.0519","","","0.1066","0.1266","","","","","","1.103","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322456","10.1206","0.0014","12.417","0.002","13.462","0.003","83.189","0.002","86.068","0.003","69.166","0.004","1569.3","0.5","193","","193","","","","","","","","","5","P -1","-P 1","2","","Tris(p-benzylpyridine) Lithium Tetrahydridoborate","","- C36 H37 B Li N3 -","- C36 H37 B Li N3 -","- C72 H74 B2 Li2 N6 -","2","1","","Hans-Hermann Giese; Tassilo Habereder; Heinrich Nöth; Werner Ponikwar; Steffen Thomas; Marcus Warchhold","Metal Tetrahydridoborates and Tetrahydridoborato Metalates. 23.1 Amine Solvates of Lithium and Sodium Tetrahydridoborate","Inorganic Chemistry","1999","38","","4188","4196","10.1021/ic990205c","","","0.71073","MoKα","","0.3024","0.0689","","","0.1285","0.1836","","","","","","0.834","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322457","28.527","0.003","10.8575","0.001","11.3185","0.001","90","","90","","90","","3505.7","0.6","193","","193","","","","","","","","","5","F d d 2","F 2 -2d","43","","Lithium tetrahydrdioborate-2-Collidine","","- C16 H26 B Li N2 -","- C16 H26 B Li N2 -","- C128 H208 B8 Li8 N16 -","8","0.5","","Hans-Hermann Giese; Tassilo Habereder; Heinrich Nöth; Werner Ponikwar; Steffen Thomas; Marcus Warchhold","Metal Tetrahydridoborates and Tetrahydridoborato Metalates. 23.1 Amine Solvates of Lithium and Sodium Tetrahydridoborate","Inorganic Chemistry","1999","38","","4188","4196","10.1021/ic990205c","","","0.71073","MoKα","","0.0676","0.0502","","","0.1102","0.1211","","","","","","1.165","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322458","14.683","0.012","11.83","0.007","16.96","0.008","90","","90","","90","","2946","3","223","","223","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","LiBH4*PMDTA","","- C9 H27 B Li N3 -","- C9 H27 B Li N3 -","- C72 H216 B8 Li8 N24 -","8","2","","Hans-Hermann Giese; Tassilo Habereder; Heinrich Nöth; Werner Ponikwar; Steffen Thomas; Marcus Warchhold","Metal Tetrahydridoborates and Tetrahydridoborato Metalates. 23.1 Amine Solvates of Lithium and Sodium Tetrahydridoborate","Inorganic Chemistry","1999","38","","4188","4196","10.1021/ic990205c","","","0.71073","MoKα","","0.1896","0.0855","","0.2948","0.203","","","","1.023","1.107","1.107","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322459","7.591","0.003","15.325","0.006","8.719","0.004","90","","99.8","0.02","90","","999.5","0.7","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C6 H19 B Li N3 -","- C6 H19 B Li N3 -","- C24 H76 B4 Li4 N12 -","4","1","","Hans-Hermann Giese; Tassilo Habereder; Heinrich Nöth; Werner Ponikwar; Steffen Thomas; Marcus Warchhold","Metal Tetrahydridoborates and Tetrahydridoborato Metalates. 23.1 Amine Solvates of Lithium and Sodium Tetrahydridoborate","Inorganic Chemistry","1999","38","","4188","4196","10.1021/ic990205c","","","0.71073","MoKα","","0.0508","0.0416","","0.1014","0.0937","","","","1.164","1.181","1.181","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322460","9.993","0.002","10.008","0.003","14.472","0.004","90","","93.55","0.02","90","","1444.6","0.7","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H27 B N3 Na -","- C9 H27 B N3 Na -","- C36 H108 B4 N12 Na4 -","4","1","","Hans-Hermann Giese; Tassilo Habereder; Heinrich Nöth; Werner Ponikwar; Steffen Thomas; Marcus Warchhold","Metal Tetrahydridoborates and Tetrahydridoborato Metalates. 23.1 Amine Solvates of Lithium and Sodium Tetrahydridoborate","Inorganic Chemistry","1999","38","","4188","4196","10.1021/ic990205c","","","0.71073","MoKα","","0.1048","0.0736","","0.1872","0.1747","","","","1.64","1.866","1.866","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322461","13.859","0.005","13.859","0.005","13.859","0.005","90","","90","","90","","2661.9","1.7","183","3","183","3","","","","","","","","5","I -4 3 m","I -4 2 3","217","","","","- C9 H28 B N3 Na -","- C9 H22 B N3 Na -","- C72 H176 B8 N24 Na8 -","8","0.166667","","Hans-Hermann Giese; Tassilo Habereder; Heinrich Nöth; Werner Ponikwar; Steffen Thomas; Marcus Warchhold","Metal Tetrahydridoborates and Tetrahydridoborato Metalates. 23.1 Amine Solvates of Lithium and Sodium Tetrahydridoborate","Inorganic Chemistry","1999","38","","4188","4196","10.1021/ic990205c","","","0.71073","MoKα","","0.0916","0.0871","","","0.2268","0.2305","","","","","","1.169","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322462","22.919","0.004","17.184","0.003","21.307","0.006","90","","113.79","0.02","90","","7679","3","243","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Cesium 18-crown-6 (2,4,6-tri-t-butylbenzene)phosphide","","- C33.5 H58 Cs O6 P -","- C33.5 H57 Cs O6 P -","- C268 H456 Cs8 O48 P8 -","8","2","","Gerd W. Rabe; Louise M. Liable-Sands; Christopher D. Incarvito; Kin-Chung Lam; Arnold L. Rheingold","Highly Restricted Dimensionality in Cesium Aryl Phosphides","Inorganic Chemistry","1999","38","","4342","4346","10.1021/ic9902119","","","0.71073","MoKα","","0.091","0.0489","","0.1129","0.1048","","","","1.088","1.414","1.414","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322463","13.8223","0.0002","14.6926","0.0002","18.6259","0.0002","90","","90","","90","","3782.65","0.09","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C36 H50 Cs O6 P -","- C36 H50 Cs O6 P -","- C144 H200 Cs4 O24 P4 -","4","1","","Gerd W. Rabe; Louise M. Liable-Sands; Christopher D. Incarvito; Kin-Chung Lam; Arnold L. Rheingold","Highly Restricted Dimensionality in Cesium Aryl Phosphides","Inorganic Chemistry","1999","38","","4342","4346","10.1021/ic9902119","","","0.71073","MoKα","","0.0478","0.0397","","","0.1006","0.1063","","","","","","1.697","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322464","20.1567","0.0004","25.8617","0.0005","17.3173","0.0004","90","","90","","90","","9027.3","0.3","173","2","173","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","","","","- C48 H50 Cs D12 O6 P -","- C48 H50 Cs D6 O6 P -","- C384 H400 Cs8 D48 O48 P8 -","8","1","","Gerd W. Rabe; Louise M. Liable-Sands; Christopher D. Incarvito; Kin-Chung Lam; Arnold L. Rheingold","Highly Restricted Dimensionality in Cesium Aryl Phosphides","Inorganic Chemistry","1999","38","","4342","4346","10.1021/ic9902119","","","0.71073","MoKα","","0.1482","0.0934","","","0.2185","0.2596","","","","","","1.593","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322465","11.2885","0.0002","11.6675","0.0002","14.5247","0.0002","66.5752","0.0003","71.1301","0.0007","88.0975","0.0008","1650.97","0.05","198","2","198","2","","","","","","","","5","P -1","-P 1","2","","","","- C67 H84 Cs2 O6 P2 -","- C67 H76 Cs2 O6 P2 -","- C67 H76 Cs2 O6 P2 -","1","0.5","","Gerd W. Rabe; Louise M. Liable-Sands; Christopher D. Incarvito; Kin-Chung Lam; Arnold L. Rheingold","Highly Restricted Dimensionality in Cesium Aryl Phosphides","Inorganic Chemistry","1999","38","","4342","4346","10.1021/ic9902119","","","0.71073","MoKα","","0.0534","0.0429","","0.1235","0.1058","","","","1.128","1.182","1.182","","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322466","9.419","0.001","9.584","0.001","12.652","0.001","89.03","0.01","82.41","0.01","72.75","0.01","1080.89","0.19","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C17 H20 B Cl2 N6 O2 Re -","- C17 H20 B Cl2 N6 O2 Re -","- C34 H40 B2 Cl4 N12 O4 Re2 -","2","1","","K. Rajender Reddy; Ângela Domingos; António Paulo; Isabel Santos","Rhenium(V) Dioxo Complexes with Dihydrobis(pyrazolyl)borates: Synthesis and Reactivity toward Electrophilic Substrates","Inorganic Chemistry","1999","38","","4278","4282","10.1021/ic990229j","","","0.71073","MoKα","","0.0476","0.0313","","0.0798","0.0674","","","","1.169","1.153","1.153","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322467","10.785","0.002","17.68","0.002","11.971","0.002","90","","98.67","0.01","90","","2256.5","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C15 H25 B2 N8 O2 Re Si -","- C15 H25 B2 N8 O2 Re Si -","- C60 H100 B8 N32 O8 Re4 Si4 -","4","1","","K. Rajender Reddy; Ângela Domingos; António Paulo; Isabel Santos","Rhenium(V) Dioxo Complexes with Dihydrobis(pyrazolyl)borates: Synthesis and Reactivity toward Electrophilic Substrates","Inorganic Chemistry","1999","38","","4278","4282","10.1021/ic990229j","","","0.71073","MoKα","","0.0366","0.0257","","0.0679","0.0577","","","","0.961","0.898","0.898","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322468","13.063","0.001","14.108","0.002","11.486","0.001","93.77","0.03","102.168","0.01","74.073","0.01","1989.7","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H39 Cl6 Cu N4 O Sb -","- C36 H39 Cl6 Cu N4 O Sb -","- C72 H78 Cl12 Cu2 N8 O2 Sb2 -","2","1","","Teresa J. Neal; Seong-Joo Kang; Charles E. Schulz; W. Robert Scheidt","Molecular Structures and Magnetochemistry of Two (β-Oxooctaethylchlorinato)copper(II) Derivatives: [Cu(oxoOEC)] and [Cu(oxoOEC.)]SbCl6","Inorganic Chemistry","1999","38","","4294","4302","10.1021/ic9903026","","","0.71073","MoKα","","0.048","0.0412","","0.1072","0.1027","","","","1.09","1.108","1.108","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322469","6.562","0.002","14.401","0.005","17.439","0.004","90","","90.45","0.02","90","","1647.9","0.9","295","2","295","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[Cu(I)(TMMEA)]ClO4","","- C9 H21 Cl Cu N O4 S3 -","- C9 H21 Cl Cu N O4 S3 -","- C36 H84 Cl4 Cu4 N4 O16 S12 -","4","1","","Edna A. Ambundo; Marie-Veronique Deydier; Andrew J. Grall; Natalia Aguera-Vega; Luke T. Dressel; Thomas H. Cooper; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Influence of Coordination Geometry upon Copper(II/I) Redox Potentials. Physical Parameters for Twelve Copper Tripodal Ligand Complexes","Inorganic Chemistry","1999","38","","4233","4242","10.1021/ic990334t","","","0.71073","MoKα","","0.17","0.0762","","0.1392","0.1153","","","","0.876","1.166","1.166","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322470","11.03","0.002","25.611","0.004","14.287","0.002","90","","95.056","0.015","90","","4020.2","1.1","295","2","295","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","[Cu(I)(TEMEA)]ClO4","","- C12 H27 Cl Cu N O4 S3 -","- C12 H27 Cl Cu N O4 S3 -","- C96 H216 Cl8 Cu8 N8 O32 S24 -","8","2","","Edna A. Ambundo; Marie-Veronique Deydier; Andrew J. Grall; Natalia Aguera-Vega; Luke T. Dressel; Thomas H. Cooper; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Influence of Coordination Geometry upon Copper(II/I) Redox Potentials. Physical Parameters for Twelve Copper Tripodal Ligand Complexes","Inorganic Chemistry","1999","38","","4233","4242","10.1021/ic990334t","","","0.71073","MoKα","","0.1572","0.0643","","0.134","0.1071","","","","0.916","1.17","1.17","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322471","10.3609","0.001","10.3609","0.001","16.384","0.002","90","","90","","120","","1523.2","0.3","295","2","295","2","","","","","","","","7","R 3 :H","R 3","146","","[Cu(II)(TEMEA)Cl]ClO4","","- C12 H27 Cl2 Cu N O4 S3 -","- C12 H27 Cl2 Cu N O4.01 S3 -","- C36 H81 Cl6 Cu3 N3 O12.03 S9 -","3","0.333333","","Edna A. Ambundo; Marie-Veronique Deydier; Andrew J. Grall; Natalia Aguera-Vega; Luke T. Dressel; Thomas H. Cooper; Mary Jane Heeg; L. A. Ochrymowycz; D. B. Rorabacher","Influence of Coordination Geometry upon Copper(II/I) Redox Potentials. Physical Parameters for Twelve Copper Tripodal Ligand Complexes","Inorganic Chemistry","1999","38","","4233","4242","10.1021/ic990334t","","","0.71073","MoKα","","0.0593","0.0493","","0.1185","0.1106","","","","1.059","1.077","1.077","","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322472","7.212","0.005","5.452","0.003","10.696","0.003","90","","90","","90","","420.6","0.4","288.2","","288.2","","","","","","","","","3","P m n a","-P 2ac 2","53","","","","- C4 Cu N3 -","- C6 Cu0.25 N5 -","- C12 Cu0.5 N10 -","2","0.25","","H. Hoshino; K. Iida; T. Kawamoto; T. Mori","Structural and Magnetic Properties of Cu[C(CN)3]2 and Mn[C(CN)3]2","Inorganic Chemistry","1999","38","","4229","4232","10.1021/ic990336d","","","0.7107","MoKα","","","0.092","","","","0.114","","","","","","3.09","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322473","7.742","0.005","5.411","0.006","10.561","0.006","90","","90","","90","","442.4","0.6","288.2","","288.2","","","","","","","","","3","P m n a","-P 2ac 2","53","","","","- C8 Mn N6 -","- C6 Mn0.25 N5 -","- C12 Mn0.5 N10 -","2","0.25","","H. Hoshino; K. Iida; T. Kawamoto; T. Mori","Structural and Magnetic Properties of Cu[C(CN)3]2 and Mn[C(CN)3]2","Inorganic Chemistry","1999","38","","4229","4232","10.1021/ic990336d","","","0.7107","MoKα","","","0.065","","","","0.083","","","","","","0.6","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322474","15.211","0.002","8.5113","0.0009","20.548","0.003","90","","90","","90","","2660.3","0.6","295","2","295","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C10 H18 O S4 -","- C10 H18 O S4 -","- C80 H144 O8 S32 -","8","1","","Ksenia Krylova; Chandrika P. Kulatilleke; Mary Jane Heeg; Cynthia A. Salhi; L. A. Ochrymowycz; D. B. Rorabacher","A Structural Strategy for Generating Rapid Electron-Transfer Kinetics in Copper(II/I) Systems","Inorganic Chemistry","1999","38","","4322","4328","10.1021/ic990365o","","","1.54178","CuKα","","0.0534","0.0474","","0.1435","0.1297","","","","0.932","0.969","0.969","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322475","12.5917","0.0002","13.002","0.0003","14.9285","0.0003","68.356","0.001","84.298","0.001","61.129","0.001","1980.05","0.07","295","2","295","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H42 Cl2 Cu2 N2 O10 S8 -","- C24 H42 Cl2 Cu2 N2 O10 S8 -","- C48 H84 Cl4 Cu4 N4 O20 S16 -","2","1","","Ksenia Krylova; Chandrika P. Kulatilleke; Mary Jane Heeg; Cynthia A. Salhi; L. A. Ochrymowycz; D. B. Rorabacher","A Structural Strategy for Generating Rapid Electron-Transfer Kinetics in Copper(II/I) Systems","Inorganic Chemistry","1999","38","","4322","4328","10.1021/ic990365o","","","0.71073","MoKα","","0.083","0.0654","","0.1985","0.1832","","","","1.062","1.149","1.149","","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322476","15.774","0.002","8.485","0.005","16.508","0.009","90","","112.11","0.06","90","","2047","1.9","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H22 Cl2 Cu O11 S4 -","- C10 H22 Cl2 Cu O11 S4 -","- C40 H88 Cl8 Cu4 O44 S16 -","4","1","","Ksenia Krylova; Chandrika P. Kulatilleke; Mary Jane Heeg; Cynthia A. Salhi; L. A. Ochrymowycz; D. B. Rorabacher","A Structural Strategy for Generating Rapid Electron-Transfer Kinetics in Copper(II/I) Systems","Inorganic Chemistry","1999","38","","4322","4328","10.1021/ic990365o","","","0.71073","MoKα","","0.0896","0.0523","","0.1112","0.0998","","","","1.001","1.155","1.155","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322477","12.2487","0.0003","39.9307","0.0011","12.4761","0.0003","90","","116.542","0.001","90","","5458.9","0.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H52 Mo12 N4 O41.5 Si -","- C16 H39 Mo12 N4 O41.5 Si -","- C64 H156 Mo48 N16 O166 Si4 -","4","1","","Anne Dolbecq; Emmanuel Cadot; Dirk Eisner; Francis Sécheresse","Hydrothermal Syntheses: A Route to the Stepwise Condensation of Reduced Keggin Polyanions. From Reduced β-[HmSiMo12O40]n- Monomers to Bicapped Dimerized [Si2Mo28O84(H2O)2]6- Anions","Inorganic Chemistry","1999","38","","4217","4223","10.1021/ic990420t","","","0.71073","MoKα","","0.0826","0.0676","","0.1471","0.1397","","","","1.17","1.223","1.223","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322478","12.793","0.0002","21.6171","0.0002","19.7222","0.0002","90","","96.017","0.001","90","","5424.08","0.11","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H54 Mo12 N4 O42 Si -","- C16 H36 Mo12 N4 O42 Si -","- C64 H144 Mo48 N16 O168 Si4 -","4","1","","Anne Dolbecq; Emmanuel Cadot; Dirk Eisner; Francis Sécheresse","Hydrothermal Syntheses: A Route to the Stepwise Condensation of Reduced Keggin Polyanions. From Reduced β-[HmSiMo12O40]n- Monomers to Bicapped Dimerized [Si2Mo28O84(H2O)2]6- Anions","Inorganic Chemistry","1999","38","","4217","4223","10.1021/ic990420t","","","0.71073","MoKα","","0.069","0.0512","","0.1328","0.1233","","","","1.095","1.144","1.144","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322479","12.7763","0.0005","20.2277","0.0008","20.9784","0.0009","90","","98.037","0.001","90","","5368.3","0.4","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H48 Mo12 N3 O43.5 Si -","- C12 H36 Mo12 N3 O43.5 Si -","- C48 H144 Mo48 N12 O174 Si4 -","4","1","","Anne Dolbecq; Emmanuel Cadot; Dirk Eisner; Francis Sécheresse","Hydrothermal Syntheses: A Route to the Stepwise Condensation of Reduced Keggin Polyanions. From Reduced β-[HmSiMo12O40]n- Monomers to Bicapped Dimerized [Si2Mo28O84(H2O)2]6- Anions","Inorganic Chemistry","1999","38","","4217","4223","10.1021/ic990420t","","","0.71073","MoKα","","0.0698","0.0499","","0.1364","0.1243","","","","1.061","1.102","1.102","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322480","12.0502","0.0004","11.75","0.0004","19.8001","0.0005","90","","100.525","0.001","90","","2756.33","0.15","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H48 Mo14 N4 O44 Si -","- C16 H48 Mo14 N4 O44 Si -","- C32 H96 Mo28 N8 O88 Si2 -","2","0.5","","Anne Dolbecq; Emmanuel Cadot; Dirk Eisner; Francis Sécheresse","Hydrothermal Syntheses: A Route to the Stepwise Condensation of Reduced Keggin Polyanions. From Reduced β-[HmSiMo12O40]n- Monomers to Bicapped Dimerized [Si2Mo28O84(H2O)2]6- Anions","Inorganic Chemistry","1999","38","","4217","4223","10.1021/ic990420t","","","0.71073","MoKα","","0.1234","0.0711","","0.2208","0.1852","","","","1.046","1.16","1.16","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322481","19.3591","0.0002","13.1119","0.0002","21.1265","0.0002","90","","101.124","0.001","90","","5261.88","0.11","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H40 Mo14 N3 O44 Si -","- C12 H24 Mo14 N3 O44 Si -","- C48 H96 Mo56 N12 O176 Si4 -","4","1","","Anne Dolbecq; Emmanuel Cadot; Dirk Eisner; Francis Sécheresse","Hydrothermal Syntheses: A Route to the Stepwise Condensation of Reduced Keggin Polyanions. From Reduced β-[HmSiMo12O40]n- Monomers to Bicapped Dimerized [Si2Mo28O84(H2O)2]6- Anions","Inorganic Chemistry","1999","38","","4217","4223","10.1021/ic990420t","","","0.71073","MoKα","","0.0946","0.054","","0.146","0.1211","","","","1.099","1.128","1.128","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322482","14.96","0.007","10.187","0.004","17.91","0.008","90","","93.36","0.01","90","","2725","2","298","","298","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25.1 H30.6 N O2.7 P Re S2 -","- C25.1 H27 N O2.7 P Re S2 -","- C100.4 H108 N4 O10.8 P4 Re4 S8 -","4","1","","Berthold Nock; Theodosia Maina; Francesco Tisato; Minas Papadopoulos; Catherine P. Raptopoulou; Aris Terzis; Efstratios Chiotellis","Novel Six-Coordinate Oxorhenium ""3 + 2"" Mixed-Ligand Complexes Carrying the SNS/PO Donor Atom Set: Synthesis and Characterization","Inorganic Chemistry","1999","38","","4197","4202","10.1021/ic9905796","","","0.71073","MoKα","","0.0485","0.0335","","0.0951","0.0855","","","","1.104","1.115","1.115","","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322483","16.14","0.01","10.384","0.007","15.66","0.01","100.11","0.02","102.71","0.02","100.89","0.02","2449","3","298","","298","","","","","","","","","7","P -1","-P 1","2","","","","- C24.5 H29 N O2.5 P Re S2 -","- C49 H54 N2 O5 P2 Re2 S4 -","- C98 H108 N4 O10 P4 Re4 S8 -","2","1","","Berthold Nock; Theodosia Maina; Francesco Tisato; Minas Papadopoulos; Catherine P. Raptopoulou; Aris Terzis; Efstratios Chiotellis","Novel Six-Coordinate Oxorhenium ""3 + 2"" Mixed-Ligand Complexes Carrying the SNS/PO Donor Atom Set: Synthesis and Characterization","Inorganic Chemistry","1999","38","","4197","4202","10.1021/ic9905796","","","0.71073","MoKα","","0.0525","0.0389","","0.1011","0.0901","","","","1.138","1.138","1.138","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322484","9.013","0.003","29.03","0.01","10.186","0.004","90","","93.69","0.01","90","","2659.6","1.6","298","","298","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C26 H31 N O2 P Re S3 -","- C26 H31 N O2 P Re S3 -","- C104 H124 N4 O8 P4 Re4 S12 -","4","1","","Berthold Nock; Theodosia Maina; Francesco Tisato; Minas Papadopoulos; Catherine P. Raptopoulou; Aris Terzis; Efstratios Chiotellis","Novel Six-Coordinate Oxorhenium ""3 + 2"" Mixed-Ligand Complexes Carrying the SNS/PO Donor Atom Set: Synthesis and Characterization","Inorganic Chemistry","1999","38","","4197","4202","10.1021/ic9905796","","","0.71073","MoKα","","0.0501","0.0449","","0.1257","0.1196","","","","1.102","1.114","1.114","","","","","has coordinates","179327","2020-10-21","18:00:00",""
"4322485","12.306","0.006","18.276","0.008","19","0.006","90","","96.61","0.04","90","","4245","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H70 I Li3 N4 O2 -","- C34 H70 I Li3 N4 O2 -","- C136 H280 I4 Li12 N16 O8 -","4","1","","Tristram Chivers; Andrew Downard; Masood Parvez","Entrapment of Lithium Salts by the Lithium Amidinate Li[(nBu)C(NtBu)2]","Inorganic Chemistry","1999","38","","4347","4353","10.1021/ic990757v","","","0.71069","MoKα","","0.1718","0.0529","","","0.1418","0.2009","","","","","","1.024","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322486","15.163","0.005","15.746","0.003","17.024","0.006","90","","109.32","0.02","90","","3836","2","170","","170","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H62 Br Li3 N4 O -","- C30 H62 Br Li3 N4 O -","- C120 H248 Br4 Li12 N16 O4 -","4","1","","Tristram Chivers; Andrew Downard; Masood Parvez","Entrapment of Lithium Salts by the Lithium Amidinate Li[(nBu)C(NtBu)2]","Inorganic Chemistry","1999","38","","4347","4353","10.1021/ic990757v","","","0.7107","MoKα","","0.0475","0.0475","","0.0452","0.0452","","","","1.626","1.626","1.626","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322487","13.514","0.005","11.619","0.006","24.02","0.008","90","","99.78","0.04","90","","3717","3","170","","170","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H62 Cl Li3 N4 O -","- C30 H62 Cl Li3 N4 O -","- C120 H248 Cl4 Li12 N16 O4 -","4","1","","Tristram Chivers; Andrew Downard; Masood Parvez","Entrapment of Lithium Salts by the Lithium Amidinate Li[(nBu)C(NtBu)2]","Inorganic Chemistry","1999","38","","4347","4353","10.1021/ic990757v","","","0.7107","MoKα","","0.0611","0.0611","","0.0706","0.0706","","","","3.036","3.036","3.036","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322488","13.142","0.004","13.239","0.004","11.425","0.002","94.3","0.02","99.4","0.02","64.32","0.02","1767.4","0.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H63 Li3 N4 O2 -","- C30 H63 Li3 N4 O2 -","- C60 H126 Li6 N8 O4 -","2","1","","Tristram Chivers; Andrew Downard; Masood Parvez","Entrapment of Lithium Salts by the Lithium Amidinate Li[(nBu)C(NtBu)2]","Inorganic Chemistry","1999","38","","4347","4353","10.1021/ic990757v","","","0.71069","MoKα","","0.2753","0.0671","","","0.1837","0.2711","","","","","","0.981","","","","has coordinates,has disorder","301838","2025-08-20","22:17:37",""
"4322489","12.4723","0.0015","19.554","0.002","12.1846","0.0012","90","","107.484","0.009","90","","2834.3","0.5","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C19 H34 Cl2 Cu2 N4 O11 -","- C19 H34 Cl2 Cu2 N4 O11 -","- C76 H136 Cl8 Cu8 N16 O44 -","4","1","","Anbanandam Asokan; Periakaruppan T. Manoharan","1H NMR Studies on Strongly Antiferromagnetically Coupled Dicopper(II) Systems","Inorganic Chemistry","1999","38","","5642","5654","10.1021/ic9803356","","","1.54184","CuKα","","0.0623","0.0591","","0.1682","0.1595","","","","1.001","0.992","0.992","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322490","12.458","0.002","10.876","0.001","15.817","0.002","90","","116.36","0.01","90","","1920.3","0.5","293","2","293","2","","","","","","","synthesized by the authors, see text","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 Ru3 S3 -","- C18 H20 Ru3 S3 -","- C72 H80 Ru12 S12 -","4","1","","Alan Shaver; Mohammad El-Khateeb; Anne-Marie Lebuis","C-S Bond Cleavage in CpRu(PPh3)2SCH2CHCH2 To Give the Trimer (CpRu)3(μ3-S)2(μ-SCH2CHCH2)","Inorganic Chemistry","1999","38","","5913","5915","10.1021/ic981433u","","","1.54056","CuKα","","0.0862","0.0584","","0.1839","","0.1678","","","1.057","","","1.114","","","","has coordinates,has disorder","179327","2020-10-21","18:00:00",""
"4322491","7.8145","0.0018","24.201","0.006","7.9925","0.0014","90","","117.991","0.016","90","","1334.7","0.5","293","","293","","","","","","","","","7","P 1 21 1","P 2yb","4","","O-ethylcysteinato(hydrotris(3,5-dimethyl-1-pyrazolyl)borato)nickel(II)","","- C21 H36 B N7 Ni O3 S -","- C23 H31 B N7 Ni O3 S -","- C46 H62 B2 N14 Ni2 O6 S2 -","2","1","","Patrick J. Desrochers; Russell W. Cutts; Phillip K. Rice; Melissa L. Golden; James B. Graham; Tosha M. Barclay; A. W. Cordes","Characteristics of Five-Coordinate Nickel-Cysteine Centers","Inorganic Chemistry","1999","38","","5690","5694","10.1021/ic990059a","","","0.7107","MolybdenumKα","","0.064","0.063","","0.067","0.067","","","","","1.06","1.06","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322492","10.543","0.002","11.934","0.004","16.884","0.003","90","","94.08","0.02","90","","2119","0.9","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 Ag2 Cl2 O8 -","- C21 H15 Ag2 Cl2 O8 -","- C84 H60 Ag8 Cl8 O32 -","4","1","","Gui Ling Ning; Megumu Munakata; Liang Ping Wu; Masahiko Maekawa; Yusaku Suenaga; Takayoshi Kuroda-Sowa; Kunihisa Sugimoto","Mobility of Silver(I) Ions around the Propeller Ligand, Hexaphenylbenzene (HPB), in Silver(I) π-Complexes","Inorganic Chemistry","1999","38","","5668","5673","10.1021/ic990143q","","","0.7107","MoKα","","0.0555","0.0555","","","0.0523","0.0523","","","","","","1.602","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322493","18.2","0.004","16.831","0.007","16.244","0.003","90","","110.96","0.02","90","","4647","2","296.2","","296.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C25.5 H19 Ag F3 O3 S -","- C25.5 H15 Ag F3 O3 S -","- C204 H120 Ag8 F24 O24 S8 -","8","1","","Gui Ling Ning; Megumu Munakata; Liang Ping Wu; Masahiko Maekawa; Yusaku Suenaga; Takayoshi Kuroda-Sowa; Kunihisa Sugimoto","Mobility of Silver(I) Ions around the Propeller Ligand, Hexaphenylbenzene (HPB), in Silver(I) π-Complexes","Inorganic Chemistry","1999","38","","5668","5673","10.1021/ic990143q","","","0.7107","MoKα","","0.0565","0.0565","","","0.0673","0.0673","","","","","","2.39","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322494","11.321","0.003","12.511","0.004","16.357","0.003","90","","99.98","0.02","90","","2281.7","1","296.2","","296.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H23 Ag Cl O5 -","- C25 H15 Ag Cl O5 -","- C100 H60 Ag4 Cl4 O20 -","4","1","","Gui Ling Ning; Megumu Munakata; Liang Ping Wu; Masahiko Maekawa; Yusaku Suenaga; Takayoshi Kuroda-Sowa; Kunihisa Sugimoto","Mobility of Silver(I) Ions around the Propeller Ligand, Hexaphenylbenzene (HPB), in Silver(I) π-Complexes","Inorganic Chemistry","1999","38","","5668","5673","10.1021/ic990143q","","","0.7107","MoKα","","0.0504","0.0504","","","0.0555","0.0555","","","","","","1.438","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322495","10.4971","0.0001","15.5281","0.0002","16.393","0.0002","90","","101.506","0.001","90","","2618.36","0.05","223","2","223","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C26 H24 N2 O6 P2 Pt -","- C26 H24 N2 O6 P2 Pt -","- C104 H96 N8 O24 P8 Pt4 -","4","1","","Malcolm J. Arendse; Gordon K. Anderson; Nigam P. Rath","Synthesis and Characterization of Platinum(II) Complexes of l-Ascorbic Acid. Crystal Structure of Ascorbato-C2,O5-ethylenediamineplatinum(II) Dihydrate","Inorganic Chemistry","1999","38","","5864","5869","10.1021/ic990152z","","","0.71073","MoKα","","0.0581","0.0391","","","0.0632","0.069","","","","","","1.032","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322496","11.469","0.002","13.933","0.002","16.778","0.003","90","","90","","90","","2681.1","0.8","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","μ~4~oxo-hexaμ~2~chloro tetrakisimidazole tetracopper(II) methanol = solvate","","- C9.83 H19.32 Cl Cu4 N6 O1.83 -","- C12.83 H19.32 Cl6 Cu4 N8 O1.83 -","- C51.32 H77.28 Cl24 Cu16 N32 O7.32 -","4","1","","Ana María Atria; Andrés Vega; Martín Contreras; Jorge Valenzuela; Evgenia Spodine","Magnetostructural Characterization of μ4-Oxohexa-μ2-chlorotetrakis(imidazole)copper(II)","Inorganic Chemistry","1999","38","","5681","5685","10.1021/ic990389v","","","0.71073","MoKα","","0.0458","0.0322","","","0.0695","0.0734","","","","","","0.933","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322497","37.951","0.004","8.047","0.004","20.882","0.005","90","","93.72","0.01","90","","6364","4","296.2","","","","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C74 H58 Ag3 Cl3 O12 -","- C74 H42 Ag3 Cl3 O12 -","- C296 H168 Ag12 Cl12 O48 -","4","1","","Megumu Munakata; Liang Ping Wu; Kunihisa Sugimoto; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Naoto Maeno; Motoshi Fujita","Silver(I) Complex Assemblies with Nonplanar Aromatic Compounds","Inorganic Chemistry","1999","38","","5674","5680","10.1021/ic990391m","","","0.7107","MoKα","","","0.0542","","","","0.067","","","","","","1.994","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322498","12.317","0.004","7.961","0.001","24.741","0.001","90","","100.015","0.001","90","","2389","0.8","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H21 Ag Cl O4 -","- C30 H16 Ag Cl O4 -","- C120 H64 Ag4 Cl4 O16 -","4","1","","Megumu Munakata; Liang Ping Wu; Kunihisa Sugimoto; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Naoto Maeno; Motoshi Fujita","Silver(I) Complex Assemblies with Nonplanar Aromatic Compounds","Inorganic Chemistry","1999","38","","5674","5680","10.1021/ic990391m","","","0.7107","MoKα","","","0.056","","","","0.1555","","","","","","1.812","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322499","8.759","0.006","8.7586","","39.967","0.008","90","","90","","90","","3066","2","296.2","","","","","","","","","","","5","P 41 21 2","P 4abw 2nw","92","","","","- C32 H26 Ag2 Cl2 O10 -","- C32 H12 Ag2 Cl2 O10 -","- C128 H48 Ag8 Cl8 O40 -","4","0.5","","Megumu Munakata; Liang Ping Wu; Kunihisa Sugimoto; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Naoto Maeno; Motoshi Fujita","Silver(I) Complex Assemblies with Nonplanar Aromatic Compounds","Inorganic Chemistry","1999","38","","5674","5680","10.1021/ic990391m","","","0.7107","MoKα","","","0.0622","","","","0.1771","","","","","","1.189","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322500","9.847","0.004","9.054","0.003","10.662","0.003","90","","106.72","0.02","90","","910.4","0.5","296.2","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H8 Ag Cl O4 -","- C7 H8 Ag Cl O4 -","- C28 H32 Ag4 Cl4 O16 -","4","1","","Megumu Munakata; Liang Ping Wu; Kunihisa Sugimoto; Takayoshi Kuroda-Sowa; Masahiko Maekawa; Yusaku Suenaga; Naoto Maeno; Motoshi Fujita","Silver(I) Complex Assemblies with Nonplanar Aromatic Compounds","Inorganic Chemistry","1999","38","","5674","5680","10.1021/ic990391m","","","0.7107","MoKα","","","0.0433","","","","0.0549","","","","","","1.804","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322501","11.3256","0.001","20.735","0.003","13.5741","0.0015","90","","91.086","0.008","90","","3187.1","0.6","291","2","291","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C72 H68 Fe Na3 O10 -","- C72 H66 Fe Na3 O10 -","- C144 H132 Fe2 Na6 O20 -","2","1","","Ronald J. Cross; Louis J. Farrugia; Duncan R. McArthur; Robert D. Peacock; Douglas S. C. Taylor","Syntheses, Crystal Structures, and CD Spectra of Simple Heterobimetallic Transition Metal Binaphtholates","Inorganic Chemistry","1999","38","","5698","5702","10.1021/ic990414x","","","0.71073","MoKα","","0.1007","0.0505","","","0.1095","0.1243","","","","","","0.942","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322502","14.8971","0.0015","14.8971","0.0015","19.2849","0.0019","90","","90","","120","","3706.4","0.6","291","2","291","2","","","","","","","","5","P 63 2 2","P 6c 2c","182","","","","- C84 H84 Fe Li3 O12 -","- C84 H84 Fe Li3 O12 -","- C168 H168 Fe2 Li6 O24 -","2","0.166667","","Ronald J. Cross; Louis J. Farrugia; Duncan R. McArthur; Robert D. Peacock; Douglas S. C. Taylor","Syntheses, Crystal Structures, and CD Spectra of Simple Heterobimetallic Transition Metal Binaphtholates","Inorganic Chemistry","1999","38","","5698","5702","10.1021/ic990414x","","","0.71073","MoKα","","0.1331","0.0843","","","0.219","0.254","","","","","","0.928","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322503","14.85","0.004","14.85","0.004","19.052","0.007","90","","90","","120","","3638.5","1.9","564","2","291","2","","","","","","","","5","P 63 2 2","P 6c 2c","182","","","","- C76.8 H69.6 Cr Li3 O10.2 -","- C76.8 H36 Cr Li3 O10.2 -","- C153.6 H72 Cr2 Li6 O20.4 -","2","0.166667","","Ronald J. Cross; Louis J. Farrugia; Duncan R. McArthur; Robert D. Peacock; Douglas S. C. Taylor","Syntheses, Crystal Structures, and CD Spectra of Simple Heterobimetallic Transition Metal Binaphtholates","Inorganic Chemistry","1999","38","","5698","5702","10.1021/ic990414x","","","0.71073","MoKα","","0.1297","0.0768","","","0.2012","0.2279","","","","","","0.94","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322504","9.7116","0.0019","19.833","0.004","11.616","0.002","90","","111.89","0.03","90","","2076","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 Ce N3 O8 -","- C18 H16 Ce N3 O8 -","- C72 H64 Ce4 N12 O32 -","4","1","","Ling Ma; Owen R. Evans; Bruce M. Foxman; Wenbin Lin","Luminescent Lanthanide Coordination Polymers","Inorganic Chemistry","1999","38","","5837","5840","10.1021/ic990429v","","","0.71073","MoKα","","0.0509","0.0257","","","0.0627","0.0711","","","","","","1.041","","","","has coordinates,has disorder","179328","2020-10-21","18:00:00",""
"4322505","20.253","0.004","11.584","0.002","9.839","0.002","90","","115.64","0.03","90","","2081","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H16 N3 O8 Tb -","- C18 H12 N3 O8 Tb -","- C72 H48 N12 O32 Tb4 -","4","0.5","","Ling Ma; Owen R. Evans; Bruce M. Foxman; Wenbin Lin","Luminescent Lanthanide Coordination Polymers","Inorganic Chemistry","1999","38","","5837","5840","10.1021/ic990429v","","","0.71073","MoKα","","0.0691","0.0426","","","0.103","0.1122","","","","","","1.065","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322506","17.348","0.003","5.7755","0.001","11.269","0.003","90","","104.33","0.02","90","","1093.9","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Na2 O12 Te4 W -","- Na2 O12 Te4 W -","- Na8 O48 Te16 W4 -","4","0.5","","Vidyavathy; K. Vidyasagar","Syntheses and Characterization of Novel Three-Dimensional Tellurites, Na2MTe4O12 (M = W, Mo), with Intersecting Tunnels","Inorganic Chemistry","1999","38","","5809","5813","10.1021/ic990547i","","","0.71073","MoKα","","0.0319","0.0305","","0.0904","0.0891","","","","1.202","1.215","1.215","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322507","17.341","0.004","5.8262","0.0011","11.268","0.002","90","","104.38","0.02","90","","1102.8","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Mo Na2 O12 Te4 -","- Mo Na2 O12 Te4 -","- Mo4 Na8 O48 Te16 -","4","0.5","","Vidyavathy; K. Vidyasagar","Syntheses and Characterization of Novel Three-Dimensional Tellurites, Na2MTe4O12 (M = W, Mo), with Intersecting Tunnels","Inorganic Chemistry","1999","38","","5809","5813","10.1021/ic990547i","","","0.71073","MoKα","","0.0297","0.0288","","0.0799","0.0789","","","","1.202","1.21","1.21","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322508","9.5478","0.0006","11.954","0.0007","10.1501","0.0006","90","","97.808","0.001","90","","1147.74","0.12","213","2","213","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C16 H34 Cl Ga N4 P2 -","- C16 H34 Cl Ga N4 P2 -","- C32 H68 Cl2 Ga2 N8 P4 -","2","0.5","","Ingo Schranz; Daniel F. Moser; Lothar Stahl; Richard J. Staples","Ring Opening of Dilithio Bis(amido)cyclodiphosphazanes As a Route to 1,3-Diaza-2λ2-phosphaallyl Gallium Complexes","Inorganic Chemistry","1999","38","","5814","5819","10.1021/ic990553e","","","0.71073","MoKα","","0.0591","0.0364","","","0.0781","0.0871","","","","","","1.025","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322509","19.0514","0.0002","17.5082","0.0001","9.6695","0.0001","90","","90","","90","","3225.32","0.05","213","2","213","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C24 H52 Ga N6 P3 -","- C24 H52 Ga N6 P3 -","- C96 H208 Ga4 N24 P12 -","4","0.5","","Ingo Schranz; Daniel F. Moser; Lothar Stahl; Richard J. Staples","Ring Opening of Dilithio Bis(amido)cyclodiphosphazanes As a Route to 1,3-Diaza-2λ2-phosphaallyl Gallium Complexes","Inorganic Chemistry","1999","38","","5814","5819","10.1021/ic990553e","","","0.71073","MoKα","","0.0609","0.0501","","","0.1309","0.1395","","","","","","1.107","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322510","14.491","0.004","15.312","0.004","12.959","0.003","91.38","0.02","109.56","0.02","65.41","0.02","2441.4","1.2","213","","213","","","","","","","","","9","P -1","-P 1","2","","[Fe2Cu2(CN)4(bpy)6](PF6)4","","- C65 H48 Cl3 Cu2 F24 Fe2 N16 O2 P4 -","- C66 H48 Cl6 Cu2 F24 Fe2 N16 O2 P4 -","- C66 H48 Cl6 Cu2 F24 Fe2 N16 O2 P4 -","1","0.5","","Hiroki Oshio; Osamu Tamada; Hironori Onodera; Tasuku Ito; Tadaaki Ikoma; Shozo Tero-Kubota","Cyanide-Bridged Iron-Copper Molecular Squares with Doublet and Quintet Spin Ground States","Inorganic Chemistry","1999","38","","5686","5689","10.1021/ic990617l","","","0.71073","MoKα","","0.1591","0.0857","","0.3101","0.2296","","","","1.04","1.104","1.104","","","","","has coordinates,has disorder","179328","2020-10-21","18:00:00",""
"4322511","14.472","0.009","15.31","0.006","12.523","0.005","102.58","0.03","107.19","0.04","75.08","0.04","2531","2","213","","213","","","","","","","","","8","P -1","-P 1","2","","[Fe2Cu2(CN)4(bpy)6](PF6)6","","- C70 H66 Cl6 Cu2 F36 Fe2 N20 P6 -","- C74 H48 Cl6 Cu2 F36 Fe2 N20 P6 -","- C74 H48 Cl6 Cu2 F36 Fe2 N20 P6 -","1","0.5","","Hiroki Oshio; Osamu Tamada; Hironori Onodera; Tasuku Ito; Tadaaki Ikoma; Shozo Tero-Kubota","Cyanide-Bridged Iron-Copper Molecular Squares with Doublet and Quintet Spin Ground States","Inorganic Chemistry","1999","38","","5686","5689","10.1021/ic990617l","","","0.71073","MoKα","","0.094","0.0541","","0.1659","0.1368","","","","1.019","1.079","1.079","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322512","14.413","0.004","16.157","0.004","18.478","0.005","90","","96.77","0.03","90","","4273","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Mn(2-Benzoylpyridine)(N3)2]3n","","","- C12 H9 Mn N7 O -","- C12 H9 Mn N7 O -","- C144 H108 Mn12 N84 O12 -","12","3","","Morsy A. M. Abu-Youssef; Albert Escuer; Dante Gatteschi; Mohamed A. S. Goher; Franz A. Mautner; Ramon Vicente","Synthesis, Structural Characterization, Magnetic Behavior, and Single Crystal EPR Spectra of Three New One-Dimensional Manganese Azido Systems with FM, Alternating FM-AF, and AF Coupling","Inorganic Chemistry","1999","38","","5716","5723","10.1021/ic990656x","","","0.71069","MoKα","","0.0873","0.0669","","0.163","0.1501","","","","1.14","1.196","1.196","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322513","13.552","0.006","7.73","0.003","16.554","0.006","90","","101.69","0.03","90","","1698.2","1.2","295","2","295","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","[Mn(3,5-dimethylpyridine)2(N3)2]n","","","- C14 H18 Mn N8 -","- C14 H18 Mn N8 -","- C56 H72 Mn4 N32 -","4","1","","Morsy A. M. Abu-Youssef; Albert Escuer; Dante Gatteschi; Mohamed A. S. Goher; Franz A. Mautner; Ramon Vicente","Synthesis, Structural Characterization, Magnetic Behavior, and Single Crystal EPR Spectra of Three New One-Dimensional Manganese Azido Systems with FM, Alternating FM-AF, and AF Coupling","Inorganic Chemistry","1999","38","","5716","5723","10.1021/ic990656x","","","0.71069","MoKα","","0.0967","0.0617","","0.1374","0.1225","","","","1.077","1.172","1.172","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322514","14.179","0.005","9.698","0.004","34.351","0.012","90","","97.81","0.03","90","","4680","3","295","2","295","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[Mn(3-Benzoyl-pyridine)2(N3)2]n","","","- C24 H18 Mn N8 O2 -","- C24 H18 Mn N8 O2 -","- C192 H144 Mn8 N64 O16 -","8","1","","Morsy A. M. Abu-Youssef; Albert Escuer; Dante Gatteschi; Mohamed A. S. Goher; Franz A. Mautner; Ramon Vicente","Synthesis, Structural Characterization, Magnetic Behavior, and Single Crystal EPR Spectra of Three New One-Dimensional Manganese Azido Systems with FM, Alternating FM-AF, and AF Coupling","Inorganic Chemistry","1999","38","","5716","5723","10.1021/ic990656x","","","0.71069","MoKα","","0.1086","0.0555","","0.1071","0.0928","","","","1.045","1.158","1.158","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"4322515","33.284","0.007","14.956","0.003","17.381","0.004","90","","90","","90","","8652","3","203","2","203","2","","","","","","","","8","P b c n","-P 2n 2ab","60","","","","- C31 H66 Cl4 Li N3 O3 Si2 Zr -","- C31 H66 Cl4 Li N3 O3 Si2 Zr -","- C248 H528 Cl32 Li8 N24 O24 Si16 Zr8 -","8","1","","Wood; Glenn P. A. Yap; Darrin S. Richeson","N-Substituted Guanidinate Anions as Ancillary Ligands in Group 4 Chemistry. Syntheses and Characterization of M{RNC[N(SiMe3)2]NR}2Cl2, [M{CyNC[N(SiMe3)2]NCy}Cl3]- (M = Zr, Hf; R =iPr, Cy), and Zr{CyNC[N(SiMe3)2]NCy}(CH2Ph)3","Inorganic Chemistry","1999","38","","5788","5794","10.1021/ic990668i","","","0.71073","MoKα","","0.0946","0.0802","","","0.2408","0.2532","","","","","","1.016","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322516","12.5453","0.0017","17.701","0.002","18.012","0.002","90","","90","","90","","3999.8","0.8","203","2","203","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C26 H64 Cl2 N6 Si4 Zr -","- C26 H64 Cl2 N6 Si4 Zr -","- C104 H256 Cl8 N24 Si16 Zr4 -","4","0.5","","Wood; Glenn P. A. Yap; Darrin S. Richeson","N-Substituted Guanidinate Anions as Ancillary Ligands in Group 4 Chemistry. Syntheses and Characterization of M{RNC[N(SiMe3)2]NR}2Cl2, [M{CyNC[N(SiMe3)2]NCy}Cl3]- (M = Zr, Hf; R =iPr, Cy), and Zr{CyNC[N(SiMe3)2]NCy}(CH2Ph)3","Inorganic Chemistry","1999","38","","5788","5794","10.1021/ic990668i","","","0.71073","MoKα","","0.1532","0.0654","","","0.1686","0.1978","","","","","","1.041","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322517","10.483","0.001","18.889","0.002","20.459","0.003","90","","102.431","0.002","90","","3956.2","0.8","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H61 N3 Si2 Zr -","- C40 H61 N3 Si2 Zr -","- C160 H244 N12 Si8 Zr4 -","4","1","","Wood; Glenn P. A. Yap; Darrin S. Richeson","N-Substituted Guanidinate Anions as Ancillary Ligands in Group 4 Chemistry. Syntheses and Characterization of M{RNC[N(SiMe3)2]NR}2Cl2, [M{CyNC[N(SiMe3)2]NCy}Cl3]- (M = Zr, Hf; R =iPr, Cy), and Zr{CyNC[N(SiMe3)2]NCy}(CH2Ph)3","Inorganic Chemistry","1999","38","","5788","5794","10.1021/ic990668i","","","0.71073","MoKα","","0.0878","0.0473","","","0.0918","0.1003","","","","","","1.027","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322518","11.8513","0.0005","16.9887","0.0007","14.7834","0.0006","90","","95.853","0.001","90","","2960.9","0.2","198","2","198","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 O15 Pt Re3 -","- C18 H25 O15 Pt Re3 -","- C72 H100 O60 Pt4 Re12 -","4","1","","Udo Brand; Chris A. Wright; John R. Shapley","Synthesis and Characterization of {Re(CO)3}4-n{PtMe3}n(OH)4, (n= 1-3). A Set of Heterobimetallic Hydroxy Cubane Complexes","Inorganic Chemistry","1999","38","","5910","5912","10.1021/ic9906914","","","0.71073","MoKα","","0.0397","0.0319","","0.0697","0.0648","","","","1.045","1.059","1.059","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322519","9.222","0.002","10.177","0.002","27.976","0.006","90","","90","","90","","2625.6","1","198","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H41 O8 Pt3 Re -","- C16 H41 O8 Pt3 Re -","- C64 H164 O32 Pt12 Re4 -","4","1","","Udo Brand; Chris A. Wright; John R. Shapley","Synthesis and Characterization of {Re(CO)3}4-n{PtMe3}n(OH)4, (n= 1-3). A Set of Heterobimetallic Hydroxy Cubane Complexes","Inorganic Chemistry","1999","38","","5910","5912","10.1021/ic9906914","","","0.71073","MoKα","","0.0579","0.051","","0.1198","0.1186","","","","1.103","1.197","1.197","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322520","14.881","0.003","15.5199","0.0012","15.845","0.002","90","","92.837","0.012","90","","3654.9","0.9","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H31 B2 N18 O4 Tb -","- C31 H31 B2 N18 O4 Tb -","- C124 H124 B8 N72 O16 Tb4 -","4","1","","Nicola Armaroli; Gianluca Accorsi; Francesco Barigelletti; Samantha M. Couchman; James S. Fleming; Nicholas C. Harden; John C. Jeffery; Karen L. V. Mann; Jon A. McCleverty; Leigh H. Rees; Sarah R. Starling; Michael D. Ward","Structural and Photophysical Properties of Mononuclear and Dinuclear Lanthanide(III) Complexes of Multidentate Podand Ligands Based on Poly(pyrazolyl)borates","Inorganic Chemistry","1999","38","","5769","5776","10.1021/ic990708i","","","0.71073","MoKα","","0.0609","0.0372","","0.0823","0.0739","","","","1.046","1.091","1.091","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322521","14.926","0.002","15.465","0.002","15.878","0.002","90","","92.698","0.011","90","","3661.1","0.8","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H31 B2 Gd N18 O4 -","- C31 H31 B2 Gd N18 O4 -","- C124 H124 B8 Gd4 N72 O16 -","4","1","","Nicola Armaroli; Gianluca Accorsi; Francesco Barigelletti; Samantha M. Couchman; James S. Fleming; Nicholas C. Harden; John C. Jeffery; Karen L. V. Mann; Jon A. McCleverty; Leigh H. Rees; Sarah R. Starling; Michael D. Ward","Structural and Photophysical Properties of Mononuclear and Dinuclear Lanthanide(III) Complexes of Multidentate Podand Ligands Based on Poly(pyrazolyl)borates","Inorganic Chemistry","1999","38","","5769","5776","10.1021/ic990708i","","","0.71073","MoKα","","0.0452","0.0299","","0.0727","0.0677","","","","1.03","1.087","1.087","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322522","10.02","0.003","13.036","0.003","14.74","0.003","70.114","0.014","71.55","0.02","79.66","0.02","1711.9","0.8","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H32 B Eu N11 O7.5 -","- C31 H27 B Eu N11 O7.5 -","- C62 H54 B2 Eu2 N22 O15 -","2","1","","Nicola Armaroli; Gianluca Accorsi; Francesco Barigelletti; Samantha M. Couchman; James S. Fleming; Nicholas C. Harden; John C. Jeffery; Karen L. V. Mann; Jon A. McCleverty; Leigh H. Rees; Sarah R. Starling; Michael D. Ward","Structural and Photophysical Properties of Mononuclear and Dinuclear Lanthanide(III) Complexes of Multidentate Podand Ligands Based on Poly(pyrazolyl)borates","Inorganic Chemistry","1999","38","","5769","5776","10.1021/ic990708i","","","0.71073","MoKα","","0.0989","0.0513","","0.133","0.096","","","","0.956","0.86","0.86","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322523","18.813","0.002","15.241","0.002","27.322","0.002","90","","90","","90","","7834","1.4","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C63 H71 B2 La2 N27 O17 -","- C63 H64 B2 La2 N27 O17 -","- C252 H256 B8 La8 N108 O68 -","4","0.5","","Nicola Armaroli; Gianluca Accorsi; Francesco Barigelletti; Samantha M. Couchman; James S. Fleming; Nicholas C. Harden; John C. Jeffery; Karen L. V. Mann; Jon A. McCleverty; Leigh H. Rees; Sarah R. Starling; Michael D. Ward","Structural and Photophysical Properties of Mononuclear and Dinuclear Lanthanide(III) Complexes of Multidentate Podand Ligands Based on Poly(pyrazolyl)borates","Inorganic Chemistry","1999","38","","5769","5776","10.1021/ic990708i","","","0.71073","MoKα","","0.0456","0.0323","","0.1004","0.093","","","","1.072","1.12","1.12","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322524","16.622","0.006","16.622","0.004","24.19","0.05","90","","90","","90","","6683","14","173","2","173","2","","","","","","","","6","P 42/n :2","-P 4bc","86","","","","- C55.2 H52.8 B2 Gd2 N24.4 O14.4 -","- C55.2 H52.8 B2 Gd2 N24.4 O14.4 -","- C220.8 H211.2 B8 Gd8 N97.6 O57.6 -","4","0.5","","Nicola Armaroli; Gianluca Accorsi; Francesco Barigelletti; Samantha M. Couchman; James S. Fleming; Nicholas C. Harden; John C. Jeffery; Karen L. V. Mann; Jon A. McCleverty; Leigh H. Rees; Sarah R. Starling; Michael D. Ward","Structural and Photophysical Properties of Mononuclear and Dinuclear Lanthanide(III) Complexes of Multidentate Podand Ligands Based on Poly(pyrazolyl)borates","Inorganic Chemistry","1999","38","","5769","5776","10.1021/ic990708i","","","0.71073","MoKα","","0.1883","0.1072","","0.2559","0.2016","","","","1.139","1.363","1.363","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322525","19.8952","0.0011","19.8952","0.0011","54.545","0.007","90","","90","","90","","21590","3","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C28 H54 Fe N2 O26 Sr -","- C28 H26 Fe N2 O26 Sr -","- C448 H416 Fe16 N32 O416 Sr16 -","16","1","","O. Danny Fox; N. Kent Dalley; Roger G. Harrison","Structure and Small Molecule Binding of a Tetranuclear Iron(II) Resorc[4]arene-Based Cage Complex","Inorganic Chemistry","1999","38","","5860","5863","10.1021/ic990834m","","","0.71073","MoKα","","0.2099","0.0953","","0.3541","0.2399","","","","1.055","1.22","1.22","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322526","19.822","0.004","19.822","0.004","54.339","0.02","90","","90","","90","","21350","10","293","2","293","2","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C112 H188.43 Br Fe4.6 N8 O90.2 Sr3.4 -","- C112 H104 Br Fe4.6 N8 O90.2 Sr3.4 -","- C448 H416 Br4 Fe18.4 N32 O360.8 Sr13.6 -","4","0.25","","O. Danny Fox; N. Kent Dalley; Roger G. Harrison","Structure and Small Molecule Binding of a Tetranuclear Iron(II) Resorc[4]arene-Based Cage Complex","Inorganic Chemistry","1999","38","","5860","5863","10.1021/ic990834m","","","0.71073","MoKα","","0.2145","0.1011","","0.3705","0.2487","","","","1.04","1.199","1.199","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322527","4.956","0.004","5.733","0.004","6.394","0.004","104.57","0.05","109.32","0.06","107.16","0.06","151","0.2","110","","110","","","","","","","","?","3","P -1","-P 1","2","","","","- C4 F6 Hg -","- C4 F6 Hg -","- C4 F6 Hg -","1","0.5","","Kulbinder K. Banger; Alan K. Brisdon; Paul T. Brain; Simon Parsons; David W. H. Rankin; Heather E. Robertson; Bruce A. Smart; Michael Bühl","Experimental and Theoretical Studies of Bis(perfluorovinyl)mercury, Hg(CF=CF2)2: Synthesis, Characterization, and Structure in the Gaseous and Crystalline Phases","Inorganic Chemistry","1999","38","","5894","5900","10.1021/ic991018h","","","0.71073","MoKα","","","0.0241","","","0.0261","","","","","1.122","1.122","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322528","18.272","0.004","9.102","0.002","17.2","0.003","90","","98.15","0.03","90","","2831.7","1","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H40 N4 O2 Zr -","- C28 H40 N4 O2 Zr -","- C112 H160 N16 O8 Zr4 -","4","1","","Lena Kakaliou; Scanlon; Baixin Qian; Sung W. Baek; Milton R. Smith; Douglas H. Motry","Five- and Six-Coordinate Group 4 Compounds Stabilized by β-Ketiminate and Diketiminate Ligands: Syntheses and Comparisons between Solid-State and Solution Structures","Inorganic Chemistry","1999","38","","5964","5977","10.1021/ic981364j","","","0.71073","MoKα","","0.15","0.0771","","0.1958","0.1613","","","","0.987","1.078","1.078","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322529","15.26","0.003","16.724","0.003","27.774","0.006","90","","90.46","0.03","90","","7088","2","133","2","133","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H46 Cl4 N2 O3 Ti -","- C32 H46 Cl4 N2 O3 Ti -","- C256 H368 Cl32 N16 O24 Ti8 -","8","1","","Lena Kakaliou; Scanlon; Baixin Qian; Sung W. Baek; Milton R. Smith; Douglas H. Motry","Five- and Six-Coordinate Group 4 Compounds Stabilized by β-Ketiminate and Diketiminate Ligands: Syntheses and Comparisons between Solid-State and Solution Structures","Inorganic Chemistry","1999","38","","5964","5977","10.1021/ic981364j","","","0.71073","MoKα","","0.1636","0.0788","","0.1313","0.1083","","","","1.052","1.205","1.205","","","","","has coordinates,has disorder","179328","2020-10-21","18:00:00",""
"4322530","8.6972","0.0001","10.5162","0.0001","15.5363","0.0001","102.53","","93.59","","102.519","0.001","1345.16","0.02","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H39 N5 Ti -","- C25 H39 N5 Ti -","- C50 H78 N10 Ti2 -","2","1","","Lena Kakaliou; Scanlon; Baixin Qian; Sung W. Baek; Milton R. Smith; Douglas H. Motry","Five- and Six-Coordinate Group 4 Compounds Stabilized by β-Ketiminate and Diketiminate Ligands: Syntheses and Comparisons between Solid-State and Solution Structures","Inorganic Chemistry","1999","38","","5964","5977","10.1021/ic981364j","","","0.71073","MoKα","","0.0538","0.0431","","0.1534","0.146","","","","1.161","1.213","1.213","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322531","8.669","0.002","10.385","0.002","15.874","0.003","102.19","0.03","92.92","0.03","101.28","0.03","1363.5","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H39 N5 Zr -","- C25 H39 N5 Zr -","- C50 H78 N10 Zr2 -","2","1","","Lena Kakaliou; Scanlon; Baixin Qian; Sung W. Baek; Milton R. Smith; Douglas H. Motry","Five- and Six-Coordinate Group 4 Compounds Stabilized by β-Ketiminate and Diketiminate Ligands: Syntheses and Comparisons between Solid-State and Solution Structures","Inorganic Chemistry","1999","38","","5964","5977","10.1021/ic981364j","","","0.71073","MoKα","","0.0969","0.0575","","0.1527","0.1382","","","","0.3","0.549","0.549","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322532","12.3106","0.0001","16.8085","0.0003","17.556","0.0003","87.003","0.001","76.07","","77.997","0.001","3448.8","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C33 H53 Cl N4 Zr -","- C33 H53 Cl N4 Zr -","- C132 H212 Cl4 N16 Zr4 -","4","2","","Lena Kakaliou; Scanlon; Baixin Qian; Sung W. Baek; Milton R. Smith; Douglas H. Motry","Five- and Six-Coordinate Group 4 Compounds Stabilized by β-Ketiminate and Diketiminate Ligands: Syntheses and Comparisons between Solid-State and Solution Structures","Inorganic Chemistry","1999","38","","5964","5977","10.1021/ic981364j","","","0.71073","MoKα","","0.0696","0.0424","","0.1314","0.1138","","","","0.836","0.852","0.852","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322533","11.5548","0.0002","20.0716","0.0003","21.5875","0.0001","90","","90","","90","","5006.64","0.12","132","2","132","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H28 Cl2 N2 O2 Ti -","- C24 H28 Cl2 N2 O2 Ti -","- C192 H224 Cl16 N16 O16 Ti8 -","8","1","","Lena Kakaliou; Scanlon; Baixin Qian; Sung W. Baek; Milton R. Smith; Douglas H. Motry","Five- and Six-Coordinate Group 4 Compounds Stabilized by β-Ketiminate and Diketiminate Ligands: Syntheses and Comparisons between Solid-State and Solution Structures","Inorganic Chemistry","1999","38","","5964","5977","10.1021/ic981364j","","","0.71073","MoKα","","0.1141","0.0634","","0.1086","0.0958","","","","1.094","1.181","1.181","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322534","8.616","0.0001","8.616","0.0001","28.5731","0.0001","90","","90","","120","","1836.96","0.03","131","2","131","2","","","","","","","","6","P 31 2 1","P 31 2""","152","","","","- C24 H28 Cl2 N2 O2 Zr -","- C24 H28 Cl2 N2 O2 Zr -","- C72 H84 Cl6 N6 O6 Zr3 -","3","0.5","","Lena Kakaliou; Scanlon; Baixin Qian; Sung W. Baek; Milton R. Smith; Douglas H. Motry","Five- and Six-Coordinate Group 4 Compounds Stabilized by β-Ketiminate and Diketiminate Ligands: Syntheses and Comparisons between Solid-State and Solution Structures","Inorganic Chemistry","1999","38","","5964","5977","10.1021/ic981364j","","","0.71073","MoKα","","0.0177","0.0172","","0.0447","0.0446","","","","1.168","1.173","1.173","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322535","8.1662","0.0001","14.8386","0.0002","14.9441","0.0002","67.1821","0.0007","83.7061","0.0007","77.7641","0.0007","1630.46","0.04","132","2","132","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H38 Cl4 N2 O2 Ti -","- C29 H38 Cl4 N2 O2 Ti -","- C58 H76 Cl8 N4 O4 Ti2 -","2","1","","Lena Kakaliou; Scanlon; Baixin Qian; Sung W. Baek; Milton R. Smith; Douglas H. Motry","Five- and Six-Coordinate Group 4 Compounds Stabilized by β-Ketiminate and Diketiminate Ligands: Syntheses and Comparisons between Solid-State and Solution Structures","Inorganic Chemistry","1999","38","","5964","5977","10.1021/ic981364j","","","0.71069","MoKα","","0.0394","0.0308","","0.0891","0.0863","","","","1.057","1.126","1.126","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322536","7.2859","0.0015","13.154","0.003","15.253","0.003","103.25","0.03","99.96","0.03","94.58","0.03","1390.5","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C26 H29 Cl3 N2 Ti -","- C26 H29 Cl3 N2 Ti -","- C52 H58 Cl6 N4 Ti2 -","2","1","","Lena Kakaliou; Scanlon; Baixin Qian; Sung W. Baek; Milton R. Smith; Douglas H. Motry","Five- and Six-Coordinate Group 4 Compounds Stabilized by β-Ketiminate and Diketiminate Ligands: Syntheses and Comparisons between Solid-State and Solution Structures","Inorganic Chemistry","1999","38","","5964","5977","10.1021/ic981364j","","","0.71073","MoKα","","0.1284","0.0804","","0.2045","0.1898","","","","0.849","1.153","1.153","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322537","9.179","0.002","22.868","0.005","16.813","0.003","90","","98.77","0.03","90","","3487.9","1.3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C38 H42 Cl2 N4 Zr -","- C38 H42 Cl2 N4 Zr -","- C152 H168 Cl8 N16 Zr4 -","4","1","","Lena Kakaliou; Scanlon; Baixin Qian; Sung W. Baek; Milton R. Smith; Douglas H. Motry","Five- and Six-Coordinate Group 4 Compounds Stabilized by β-Ketiminate and Diketiminate Ligands: Syntheses and Comparisons between Solid-State and Solution Structures","Inorganic Chemistry","1999","38","","5964","5977","10.1021/ic981364j","","","0.71073","MoKα","","0.0571","0.0348","","0.077","0.0706","","","","1.019","1.083","1.083","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322538","14.054","0.003","21.842","0.004","9.856","0.002","90","","90","","90","","3025.5","1","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C29 H41 Cl3 N2 Zr -","- C29 H41 Cl3 N2 Zr -","- C116 H164 Cl12 N8 Zr4 -","4","0.5","","Lena Kakaliou; Scanlon; Baixin Qian; Sung W. Baek; Milton R. Smith; Douglas H. Motry","Five- and Six-Coordinate Group 4 Compounds Stabilized by β-Ketiminate and Diketiminate Ligands: Syntheses and Comparisons between Solid-State and Solution Structures","Inorganic Chemistry","1999","38","","5964","5977","10.1021/ic981364j","","","0.71073","MoKα","","0.0493","0.0345","","0.1144","0.1032","","","","0.859","0.863","0.863","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322539","6.7912","0.0006","7.0801","0.0008","8.863","0.001","82.64","0.01","74.43","0.01","71.91","0.01","389.76","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","lanthanum(III) hypophosphite","","","- H6 La O6 P3 -","- H6 La O6 P3 -","- H12 La2 O12 P6 -","2","1","","Peter A. Tanner; Michele D. Faucher; Thomas C. W. Mak","Synthesis, Structure, and Spectroscopy of Rare Earth Hypophosphites. 1. Anhydrous and Monohydrated Lanthanide Hypophosphites","Inorganic Chemistry","1999","38","","6008","6023","10.1021/ic990187z","","","0.71073","MoKα","","0.0231","0.0218","","","0.0563","0.0567","","","","","","1.196","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322540","7.229","0.001","7.983","0.001","8.934","0.002","110.57","0.02","98.26","0.01","104.35","0.01","452.26","0.16","293","2","293","2","","","","","","","","5","P -1","-P 1","2","lanthanum(III) hypophosphite hydrate","","","- C0 H8 La O7 P3 -","- H8 La O7 P3 -","- H16 La2 O14 P6 -","2","1","","Peter A. Tanner; Michele D. Faucher; Thomas C. W. Mak","Synthesis, Structure, and Spectroscopy of Rare Earth Hypophosphites. 1. Anhydrous and Monohydrated Lanthanide Hypophosphites","Inorganic Chemistry","1999","38","","6008","6023","10.1021/ic990187z","","","0.71073","MoKα","","0.0293","0.0262","","","0.0672","0.0683","","","","","","1.075","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322541","7.158","0.001","7.235","0.001","17.532","0.004","90","","90","","90","","907.9","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- H7 O8 P3 U -","- O8 P3 U -","- O32 P12 U4 -","4","1","","Peter A. Tanner; Thomas C. W. Mak","Synthesis, Structure, and Spectroscopy of Rare Earth Hypophosphites. 2. Uranyl Hypophosphite Monohydrate and Uranyl Hypophosphite-Hypophosphorous Acid (1/1)","Inorganic Chemistry","1999","38","","6024","6031","10.1021/ic990188r","","","0.71073","MoKα","","0.3207","0.0737","","0.1907","0.1409","","","","1.001","1.382","1.382","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322542","7.686","0.002","9.275","0.002","11.027","0.002","90","","92.33","0.03","90","","785.4","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- H6 O7 P2 U -","- O7 P2 U -","- O28 P8 U4 -","4","1","","Peter A. Tanner; Thomas C. W. Mak","Synthesis, Structure, and Spectroscopy of Rare Earth Hypophosphites. 2. Uranyl Hypophosphite Monohydrate and Uranyl Hypophosphite-Hypophosphorous Acid (1/1)","Inorganic Chemistry","1999","38","","6024","6031","10.1021/ic990188r","","","0.71073","MoKα","","0.3352","0.0679","","","0.1388","0.2033","","","","","","0.856","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322543","14.281","0.003","5.658","0.001","12.006","0.002","90","","122.26","0.03","90","","820.4","0.4","293","2","293","2","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- H6 O6 P3 Yb -","- H6 O6 P3 Yb -","- H24 O24 P12 Yb4 -","4","0.5","","Peter A. Tanner; Thomas C. W. Mak","Synthesis, Structure, and Spectroscopy of Rare Earth Hypophosphites. 2. Uranyl Hypophosphite Monohydrate and Uranyl Hypophosphite-Hypophosphorous Acid (1/1)","Inorganic Chemistry","1999","38","","6024","6031","10.1021/ic990188r","","","0.71073","MoKα","","0.0584","0.035","","","0.0943","0.1076","","","","","","1.039","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322544","8.067","0.005","10.199","0.007","16.806","0.011","96.87","0.05","101.83","0.05","91.4","0.05","1341.9","1.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H19 Cl Cu N5 O8 P -","- C27 H19 Cl Cu N5 O8 P -","- C54 H38 Cl2 Cu2 N10 O16 P2 -","2","1","","Paul E. Jurek; Arthur E. Martell","Molecular Recognition of Activated and Unactivated Phosphate Diesters","Inorganic Chemistry","1999","38","","6003","6007","10.1021/ic990578d","","","0.71073","MoKα","","0.0638","0.0509","","","0.1301","0.1402","","","","","","1.034","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322545","11.3146","0.0018","7.6932","0.0012","28.445","0.01","90","","99.322","0.003","90","","2443.3","1","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H21 Cl Cu N3 O4 P -","- C27 H21 Cl Cu N3 O4 P -","- C108 H84 Cl4 Cu4 N12 O16 P4 -","4","1","","Paul E. Jurek; Arthur E. Martell","Molecular Recognition of Activated and Unactivated Phosphate Diesters","Inorganic Chemistry","1999","38","","6003","6007","10.1021/ic990578d","","","0.71069","MoKα","","0.084","0.0765","","","0.1411","0.1443","","","","","","1.354","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322546","7.503","0.002","15.477","0.002","9.142","0.001","90","","113.6","0.02","90","","972.8","0.3","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Ca2 Fe H4 O13 P3 -","- Ca2 Fe H4 O13 P3 -","- Ca8 Fe4 H16 O52 P12 -","4","0.5","","X. Tang; A. Jones; A. Lachgar; B. J. Gross; J. L. Yarger","Synthesis, Crystal Structure, NMR Studies, and Thermal Stability of Mixed Iron-Indium Phosphates with Quasi-One-Dimensional Frameworks","Inorganic Chemistry","1999","38","","6032","6038","10.1021/ic9905906","","","0.71073","MoKα","","0.0375","0.0268","","","0.0653","0.07","","","","","","1.087","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322547","7.548","0.002","15.67","0.003","9.241","0.002","90","","113.62","0.03","90","","1001.4","0.5","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Ca2 Fe0.5 H4 In0.5 O13 P3 -","- Ca2 Fe0.537 H4 In0.463 O13 P3 -","- Ca8 Fe2.148 H16 In1.852 O52 P12 -","4","0.5","","X. Tang; A. Jones; A. Lachgar; B. J. Gross; J. L. Yarger","Synthesis, Crystal Structure, NMR Studies, and Thermal Stability of Mixed Iron-Indium Phosphates with Quasi-One-Dimensional Frameworks","Inorganic Chemistry","1999","38","","6032","6038","10.1021/ic9905906","","","0.71073","MoKα","","0.0393","0.0295","","","0.0675","0.0706","","","","","","1.08","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322548","8.4288","0.0002","20.8982","0.0002","12.5855","0.0002","90","","99.7998","0.0009","90","","2184.55","0.07","173","2","173","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C11 H24 Cu F6 N2 P S3 Si -","- C11 H24 Cu F6 N2 P S3 Si -","- C44 H96 Cu4 F24 N8 P4 S12 Si4 -","4","1","","Hing W. Yim; Linh M. Tran; Eric E. Pullen; Daniel Rabinovich; Louise M. Liable-Sands; Thomas E. Concolino; Arnold L. Rheingold","One-Dimensional Copper(I) Coordination Polymers Based on a Tridentate Thioether Ligand","Inorganic Chemistry","1999","38","","6234","6239","10.1021/ic990642r","","","0.71073","MoKα","","0.0874","0.0785","","","0.2619","0.2684","","","","","","2.12","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322549","16.3025","0.0001","8.1492","0.0001","23.6934","0.0001","90","","104.475","0.001","90","","3047.8","0.05","218","2","218","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H36 Br3 Cu3 S6 Si2 -","- C14 H36 Br3 Cu3 S6 Si2 -","- C56 H144 Br12 Cu12 S24 Si8 -","4","1","","Hing W. Yim; Linh M. Tran; Eric E. Pullen; Daniel Rabinovich; Louise M. Liable-Sands; Thomas E. Concolino; Arnold L. Rheingold","One-Dimensional Copper(I) Coordination Polymers Based on a Tridentate Thioether Ligand","Inorganic Chemistry","1999","38","","6234","6239","10.1021/ic990642r","","","0.71073","MoKα","","0.0464","0.0336","","0.0871","0.0712","","","","0.97","1.041","1.041","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322550","21.182","0.002","9.035","0.002","16.431","0.002","90","","121.637","0.01","90","","2677.2","0.8","293","2","293","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C10 H21 N3 Ni0.5 O5 -","- C10 H21 N3 Ni0.5 O5 -","- C80 H168 N24 Ni4 O40 -","8","2","","Hye Jin Choi; Myunghyun Paik Suh","Synthesis, Crystal Structure, and Properties of a 3-D Network Assembled by Nickel(II) Macrocyclic Complex and Terephthalato Bridge","Inorganic Chemistry","1999","38","","6309","6312","10.1021/ic990664d","","","0.71073","MoKα","","0.1819","0.0486","","0.1599","0.1045","","","","0.883","1.227","1.227","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322551","14.142","0.007","10.721","0.007","16.973","0.01","90","","93.01","0.04","90","","2570","3","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C25 H19 Cl2 Mn N8 O2 -","- C25 H19 Cl2 Mn N8 O2 -","- C100 H76 Cl8 Mn4 N32 O8 -","4","0.5","","Sanjib Ganguly; Soma Karmakar; Chandan Kumar Pal; Animesh Chakravorty","Regiospecific Oximato Coordination at the Oxygen Site: Ligand Design and Low-Spin MnII and FeII/III Species","Inorganic Chemistry","1999","38","","5984","5987","10.1021/ic9907011","","","0.71073","MoKα","","0.0821","0.0547","","0.1442","0.1251","","","","1.045","1.074","1.074","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322552","14.254","0.006","10.742","0.006","16.719","0.008","90","","92.35","0.04","90","","2558","2","293","2","293","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C25 H19 Cl2 Fe N8 O2 -","- C25 H19 Cl2 Fe N8 O2 -","- C100 H76 Cl8 Fe4 N32 O8 -","4","0.5","","Sanjib Ganguly; Soma Karmakar; Chandan Kumar Pal; Animesh Chakravorty","Regiospecific Oximato Coordination at the Oxygen Site: Ligand Design and Low-Spin MnII and FeII/III Species","Inorganic Chemistry","1999","38","","5984","5987","10.1021/ic9907011","","","0.71073","MoKα","","0.209","0.0821","","0.2608","0.1633","","","","1.042","1.162","1.162","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322553","20.742","0.003","21.152","0.006","20.474","0.003","90","","94.801","0.01","90","","8951","3","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C88 H136 N8 Na2 O8 Pr2 -","- C88 H136 N8 Na2 O8 Pr2 -","- C352 H544 N32 Na8 O32 Pr8 -","4","0.5","","Elisa Campazzi; Euro Solari; Rosario Scopelliti; Carlo Floriani","Cyclopentadienyl Behavior of Pyrrolyl Anions within the meso-Octaethylporphyrinogen-Binding Lanthanides: Carbon-Hydrogen and Metal-Carbon Bond Rearrangements","Inorganic Chemistry","1999","38","","6240","6245","10.1021/ic990742x","","","0.7107","MoKα","","0.0406","0.034","","","0.095","0.0997","","","","","","1.082","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322554","12.426","0.003","16.322","0.003","22.572","0.005","90","","94.05","0.03","90","","4566.6","1.7","143","2","143","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H72 Gd N4 Na O3 -","- C48 H72 Gd N4 Na O3 -","- C192 H288 Gd4 N16 Na4 O12 -","4","1","","Elisa Campazzi; Euro Solari; Rosario Scopelliti; Carlo Floriani","Cyclopentadienyl Behavior of Pyrrolyl Anions within the meso-Octaethylporphyrinogen-Binding Lanthanides: Carbon-Hydrogen and Metal-Carbon Bond Rearrangements","Inorganic Chemistry","1999","38","","6240","6245","10.1021/ic990742x","","","0.7107","MoKα","","0.2011","0.0747","","","0.1627","0.2187","","","","","","0.906","","","","has coordinates,has disorder","179328","2020-10-21","18:00:00",""
"4322555","12.556","0.003","24.187","0.004","18.759","0.003","90","","99.61","0.03","90","","5617","1.9","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C96 H156 N8 Na2 O12 Sm2 -","- C96 H96 N8 Na2 O12 Sm2 -","- C192 H192 N16 Na4 O24 Sm4 -","2","0.5","","Elisa Campazzi; Euro Solari; Rosario Scopelliti; Carlo Floriani","Cyclopentadienyl Behavior of Pyrrolyl Anions within the meso-Octaethylporphyrinogen-Binding Lanthanides: Carbon-Hydrogen and Metal-Carbon Bond Rearrangements","Inorganic Chemistry","1999","38","","6240","6245","10.1021/ic990742x","","","0.7107","MoKα","","0.0939","0.064","","","0.194","0.2127","","","","","","1.063","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322556","16.236","0.002","13.46","0.002","21.626","0.006","90","","108.11","0.02","90","","4491.9","1.6","143","2","143","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C92 H140 N8 Na2 Nd2 O10 -","- C92 H140 N8 Na2 Nd2 O10 -","- C184 H280 N16 Na4 Nd4 O20 -","2","0.5","","Elisa Campazzi; Euro Solari; Rosario Scopelliti; Carlo Floriani","Cyclopentadienyl Behavior of Pyrrolyl Anions within the meso-Octaethylporphyrinogen-Binding Lanthanides: Carbon-Hydrogen and Metal-Carbon Bond Rearrangements","Inorganic Chemistry","1999","38","","6240","6245","10.1021/ic990742x","","","0.7107","MoKα","","0.0482","0.0407","","","0.1173","0.1304","","","","","","1.113","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322557","11.726","0.003","13.46","0.002","14.693","0.005","77.86","0.03","72.47","0.03","67.738","0.01","2034.3","1","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C80 H112 N8 Na2 O2 Pr2 -","- C80 H112 N8 Na2 O2 Pr2 -","- C80 H112 N8 Na2 O2 Pr2 -","1","0.5","","Elisa Campazzi; Euro Solari; Rosario Scopelliti; Carlo Floriani","Cyclopentadienyl Behavior of Pyrrolyl Anions within the meso-Octaethylporphyrinogen-Binding Lanthanides: Carbon-Hydrogen and Metal-Carbon Bond Rearrangements","Inorganic Chemistry","1999","38","","6240","6245","10.1021/ic990742x","","","0.7107","MoKα","","0.0475","0.0434","","","0.1231","0.1402","","","","","","1.144","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322558","15.539","0.002","15.539","0.002","21.149","0.004","90","","90","","120","","4422.5","1.2","296","2","296","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C54 H68 Cu3 N12 O13 -","- C54 H66 Cu3 N12 O13 -","- C162 H198 Cu9 N36 O39 -","3","0.166667","","Hong-Ke Liu; Wei-Yin Sun; Wen-Xia Tang; Tetsuo Yamamoto; Norikazu Ueyama","Self-Assembly of the First Copper(II) Infinite 2D Network with Large Cavities Formed between the Two Adjacent Layers","Inorganic Chemistry","1999","38","","6313","6316","10.1021/ic9907563","","","0.71073","MoKα","","0.1225","0.0446","","0.1576","0.1238","","","","1.043","1.111","1.111","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322559","9.087","0.006","11.637","0.007","14.37","0.008","65.54","0.03","82.32","0.05","84.18","0.06","1369","1.5","294","","294","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H30 O5 S8 -","- C20 H30 O5 S8 -","- C40 H60 O10 S16 -","2","1","","Franck Le Derf; Miloud Mazari; Nicolas Mercier; Eric Levillain; Pascal Richomme; Jan Becher; Javier Garín; Jesus Orduna; Alain Gorgues; Marc Sallé","Electroregulated Metal-Binding with a Crown Ether Tetrathiafulvalene Derivative: Toward Electrochemically Addressed Metal Cation Sponges","Inorganic Chemistry","1999","38","","6096","6100","10.1021/ic9907617","","","0.71073","Mo-Kα","","0.143","0.056","","0.138","0.077","","","","3.031","1.702","1.702","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322560","45.66","0.01","8.897","0.005","23.124","0.008","90","","105.54","0.04","90","","9050","7","294","","294","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C24 H37 Ba F6 N O13 S10 -","- C24 H29 Ba F6 N O13 S10 -","- C192 H232 Ba8 F48 N8 O104 S80 -","8","1","","Franck Le Derf; Miloud Mazari; Nicolas Mercier; Eric Levillain; Pascal Richomme; Jan Becher; Javier Garín; Jesus Orduna; Alain Gorgues; Marc Sallé","Electroregulated Metal-Binding with a Crown Ether Tetrathiafulvalene Derivative: Toward Electrochemically Addressed Metal Cation Sponges","Inorganic Chemistry","1999","38","","6096","6100","10.1021/ic9907617","","","0.71073","Mo-Kα","","0.252","0.103","","0.684","0.118","","","","","0.91","0.91","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322561","13.4049","0.0005","13.7043","0.0007","18.5026","0.0006","90","","106.351","0.004","90","","3261.5","0.2","183","2","183","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C33 H31 Eu O14 -","- C33 H24 Eu O14 -","- C132 H96 Eu4 O56 -","4","1","","Bert D. Alleyne; Lincoln A. Hall; Ishenkumba A. Kahwa; Andrew J. P. White; David J. Williams","Comparative Study of the Luminescence Properties of the Europium(III) Complexes of the Squarate, Phenylsquarate, and (Diphenylamino)squarate Ligands","Inorganic Chemistry","1999","38","","6278","6284","10.1021/ic9907664","","","1.54178","CuKα","","0.0886","0.056","","0.244","0.1511","","","","1.109","1.083","1.083","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322562","9.2189","0.0006","9.8147","0.0007","19.086","0.0008","78.472","0.004","82.386","0.007","88.34","0.003","1677.15","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H64 Eu2 N6 O30 -","- C64 H64 Eu2 N6 O30 -","- C64 H64 Eu2 N6 O30 -","1","0.5","","Bert D. Alleyne; Lincoln A. Hall; Ishenkumba A. Kahwa; Andrew J. P. White; David J. Williams","Comparative Study of the Luminescence Properties of the Europium(III) Complexes of the Squarate, Phenylsquarate, and (Diphenylamino)squarate Ligands","Inorganic Chemistry","1999","38","","6278","6284","10.1021/ic9907664","","","0.71073","MoKα","","0.0896","0.0472","","0.1042","0.095","","","","0.928","1.062","1.062","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322563","9.2009","0.0003","9.7464","0.0011","19.0556","0.0006","78.049","0.006","82.33","0.003","88.012","0.005","1656.8","0.2","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H64 Eu2 N6 O30 -","- C64 H64 Eu2 N6 O30 -","- C64 H64 Eu2 N6 O30 -","1","0.5","","Bert D. Alleyne; Lincoln A. Hall; Ishenkumba A. Kahwa; Andrew J. P. White; David J. Williams","Comparative Study of the Luminescence Properties of the Europium(III) Complexes of the Squarate, Phenylsquarate, and (Diphenylamino)squarate Ligands","Inorganic Chemistry","1999","38","","6278","6284","10.1021/ic9907664","","","1.54178","CuKα","","0.0635","0.0549","","0.149","0.1414","","","","1.046","1.059","1.059","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322564","9.1891","0.0004","9.6966","0.0004","19.024","0.0008","77.63","0.003","82.293","0.003","87.787","0.003","1640.7","0.12","96","2","96","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H64 Eu2 N6 O30 -","- C64 H64 Eu2 N6 O30 -","- C64 H64 Eu2 N6 O30 -","1","0.5","","Bert D. Alleyne; Lincoln A. Hall; Ishenkumba A. Kahwa; Andrew J. P. White; David J. Williams","Comparative Study of the Luminescence Properties of the Europium(III) Complexes of the Squarate, Phenylsquarate, and (Diphenylamino)squarate Ligands","Inorganic Chemistry","1999","38","","6278","6284","10.1021/ic9907664","","","0.71073","MoKα","","0.0582","0.043","","0.1091","0.1025","","","","1","1.043","1.043","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322565","8.4785","0.0004","9.3595","0.0005","13.8306","0.0006","87.332","0.001","85.929","0.001","68.733","0.001","1019.94","0.09","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C48 H50 Mg O5 S2 -","- C48 H50 Mg O5 S2 -","- C48 H50 Mg O5 S2 -","1","0.5","","Scott Chadwick; Ulrich Englich; Karin Ruhlandt-Senge","Formation of Separated versus Contact Ion Triplets in Magnesium Thiolates. Synthesis and Characterization of [Mg(15-crown-5)(SCPh3)2] and [Mg(15-crown-5)(THF)2][S-2,4,6-tBu3C6H2)]2","Inorganic Chemistry","1999","38","","6289","6293","10.1021/ic990814k","","","0.71073","MoKα","","0.1023","0.0743","","0.1777","0.1621","","","","1.033","1.092","1.092","","","","","has coordinates,has disorder","295979","2024-11-17","21:40:15",""
"4322566","13.6755","0.0002","12.8045","0.0006","32.7127","0.0012","90","","97.87","","90","","5674.3","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54 H94 Mg O7 S2 -","- C54 H94 Mg O7 S2 -","- C216 H376 Mg4 O28 S8 -","4","1","","Scott Chadwick; Ulrich Englich; Karin Ruhlandt-Senge","Formation of Separated versus Contact Ion Triplets in Magnesium Thiolates. Synthesis and Characterization of [Mg(15-crown-5)(SCPh3)2] and [Mg(15-crown-5)(THF)2][S-2,4,6-tBu3C6H2)]2","Inorganic Chemistry","1999","38","","6289","6293","10.1021/ic990814k","","","0.71073","MoKα","","0.2005","0.0909","","0.1774","0.1397","","","","1","1.174","1.174","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322567","14.2099","0.0007","13.8261","0.0007","18.9295","0.0009","90","","90","","90","","3719","0.3","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H13 N3 O3 S W -","- C20 H13 N3 O3 S W -","- C160 H104 N24 O24 S8 W8 -","8","1","","Kenneth B. Capps; Andreas Bauer; Khalil A. Abboud; Carl D. Hoff","Reaction of .NO Thiolate and Thiol Complexes: Elimination of PhSNO from W(phen)(CO)2(SPh)2, CO from W(phen)(CO)2((-S)2Arene), and HNO from W(phen)(CO)3(RSH)","Inorganic Chemistry","1999","38","","6212","6217","10.1021/ic990830h","","","0.71073","MoKα","","0.0227","0.0164","","","0.0358","0.0381","","","","","","1.056","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322568","9.5899","0.0004","16.7921","0.0008","15.5309","0.0007","90","","100.359","0.001","90","","2460.25","0.19","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H22 N4 O3 S2 W -","- C23 H22 N4 O3 S2 W -","- C92 H88 N16 O12 S8 W4 -","4","1","","Kenneth B. Capps; Andreas Bauer; Khalil A. Abboud; Carl D. Hoff","Reaction of .NO Thiolate and Thiol Complexes: Elimination of PhSNO from W(phen)(CO)2(SPh)2, CO from W(phen)(CO)2((-S)2Arene), and HNO from W(phen)(CO)3(RSH)","Inorganic Chemistry","1999","38","","6212","6217","10.1021/ic990830h","","","0.71073","MoKα","","0.0577","0.0358","","","0.0755","0.0845","","","","","","1.041","","","","has coordinates","201982","2020-10-21","18:00:00",""
"4322569","6.4955","0.0008","7.7692","0.0009","7.4665","0.0009","90","","95.045","0.002","90","","375.34","0.08","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- Cu La S Te -","- Cu La S Te -","- Cu4 La4 S4 Te4 -","4","1","","Fu Qiang Huang; James A. Ibers","Syntheses, Structures, and Theoretical Study of LaCuSTe and SmCuSTe","Inorganic Chemistry","1999","38","","5978","5983","10.1021/ic990835e","","","0.71073","MoKα","","0.0265","0.0252","","","0.0679","0.0686","","","","","","1.335","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322570","7.5195","0.0008","12.637","0.0014","7.5287","0.0008","90","","90","","90","","715.41","0.13","153","2","153","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- Cu2 S2 Sm2 Te2 -","- Cu2 S2 Sm2 Te2 -","- Cu8 S8 Sm8 Te8 -","4","0.5","","Fu Qiang Huang; James A. Ibers","Syntheses, Structures, and Theoretical Study of LaCuSTe and SmCuSTe","Inorganic Chemistry","1999","38","","5978","5983","10.1021/ic990835e","","","0.71073","MoKα","","0.0233","0.023","","","0.0682","0.0684","","","","","","1.425","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322571","8.654","0.001","9.5","0.001","22.997","0.001","90","","97.99","0.01","90","","1872.3","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H17 Cl2 N5 O Zn -","- C17 H17 Cl2 N5 O Zn -","- C68 H68 Cl8 N20 O4 Zn4 -","4","1","","Antonia Neels; Helen Stoeckli-Evans","Trinuclear Zinc(II) Complexes and Polymeric Cadmium(II) Complexes with the Ligand 2,5-Bis(2-pyridyl)pyrazine: Synthesis, Spectral Analysis, and Single-Crystal and Powder X-ray Analyses","Inorganic Chemistry","1999","38","","6164","6170","10.1021/ic990843v","","","0.71073","MoKα","","0.0925","0.0575","","","0.1177","0.1372","","","","","","1.105","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322572","12.238","0.004","12.986","0.003","15.47","0.004","75.65","0.01","77.01","0.02","65.98","0.01","2154.1","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H40 N8 O13 Zn3 -","- C40 H38 N8 O13 Zn3 -","- C80 H76 N16 O26 Zn6 -","2","1","","Antonia Neels; Helen Stoeckli-Evans","Trinuclear Zinc(II) Complexes and Polymeric Cadmium(II) Complexes with the Ligand 2,5-Bis(2-pyridyl)pyrazine: Synthesis, Spectral Analysis, and Single-Crystal and Powder X-ray Analyses","Inorganic Chemistry","1999","38","","6164","6170","10.1021/ic990843v","","","0.71073","MoKα","","0.1385","0.0698","","","0.1152","0.1427","","","","","","1.055","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322573","26.3115","0.0012","26.3115","0.0012","26.3115","0.0012","90","","90","","90","","18215.3","1.4","293","2","293","2","","","","","","","","6","I a -3 d","-I 4bd 2c 3","230","","","","- C42 H32.5 Cl6 N12 O1.25 Zn3 -","- C42 H30 Cl6 N12 O1.25 Zn3 -","- C672 H480 Cl96 N192 O20 Zn48 -","16","0.166667","","Antonia Neels; Helen Stoeckli-Evans","Trinuclear Zinc(II) Complexes and Polymeric Cadmium(II) Complexes with the Ligand 2,5-Bis(2-pyridyl)pyrazine: Synthesis, Spectral Analysis, and Single-Crystal and Powder X-ray Analyses","Inorganic Chemistry","1999","38","","6164","6170","10.1021/ic990843v","","","0.71073","MoKα","","0.0806","0.0385","","","0.0762","0.083","","","","","","0.78","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4322574","9.045","0.001","10.438","0.001","12.719","0.001","100.48","0.01","95.05","0.01","95.86","0.01","1167.6","0.2","213","2","213","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H26 Cd N4 O9 -","- C18 H26 Cd N4 O9 -","- C36 H52 Cd2 N8 O18 -","2","1","","Antonia Neels; Helen Stoeckli-Evans","Trinuclear Zinc(II) Complexes and Polymeric Cadmium(II) Complexes with the Ligand 2,5-Bis(2-pyridyl)pyrazine: Synthesis, Spectral Analysis, and Single-Crystal and Powder X-ray Analyses","Inorganic Chemistry","1999","38","","6164","6170","10.1021/ic990843v","","","0.71073","MoKα","","0.0352","0.0294","","0.0744","0.0717","","","","1.028","1.053","1.053","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322575","11.66018","0.00026","11.98703","0.00025","12.1453","0.00029","90","","103.349","0.0018","90","","1651.7","0.07","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Cd N6 O6 -","- C14 H10 Cd N6 O6 -","- C56 H40 Cd4 N24 O24 -","4","0.5","","Antonia Neels; Helen Stoeckli-Evans","Trinuclear Zinc(II) Complexes and Polymeric Cadmium(II) Complexes with the Ligand 2,5-Bis(2-pyridyl)pyrazine: Synthesis, Spectral Analysis, and Single-Crystal and Powder X-ray Analyses","Inorganic Chemistry","1999","38","","6164","6170","10.1021/ic990843v","powder diffraction","","","","","","","","","","","","","4.57","","","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322576","10.27","0.002","15.014","0.003","39.908","0.008","90","","96.23","0.03","90","","6117","2","173","0.1","173","0.1","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C21 H48 B2 F8 Fe O P4 -","- C21 H48 B2 F8 Fe O P4 -","- C168 H384 B16 F64 Fe8 O8 P32 -","8","4","","Shaun E. Landau; Robert H. Morris; Alan J. Lough","Acidic Dicationic Iron(II) Dihydrogen Complexes and Compounds Related by H2 Substitution","Inorganic Chemistry","1999","38","","6060","6068","10.1021/ic990876a","","","0.71073","MoKα","","0.0716","0.0608","","","0.1485","0.156","","","","","","1.063","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322577","21.5801","0.0005","10.3554","0.0002","20.1249","0.0005","90","","118.318","0.001","90","","3959.12","0.16","200","0.1","200","0.1","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C23 H52 F6 Fe O9 P4 S2 -","- C23 H48 F6 Fe O9 P4 S2 -","- C92 H192 F24 Fe4 O36 P16 S8 -","4","1","","Shaun E. Landau; Robert H. Morris; Alan J. Lough","Acidic Dicationic Iron(II) Dihydrogen Complexes and Compounds Related by H2 Substitution","Inorganic Chemistry","1999","38","","6060","6068","10.1021/ic990876a","","","0.71073","MoKα","","0.0599","0.0566","","0.1682","0.164","","","","1.033","1.045","1.045","","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322578","16.6339","0.0006","14.706","0.0005","19.0563","0.0006","90","","94.328","0.002","90","","4648.2","0.3","100","0.1","100","0.1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C58 H124 Ag2 F18 Fe2 O22 P10 S6 -","- C58 H124 Ag2 F18 Fe2 O22 P10 S6 -","- C116 H248 Ag4 F36 Fe4 O44 P20 S12 -","2","0.5","","Shaun E. Landau; Robert H. Morris; Alan J. Lough","Acidic Dicationic Iron(II) Dihydrogen Complexes and Compounds Related by H2 Substitution","Inorganic Chemistry","1999","38","","6060","6068","10.1021/ic990876a","","","0.71073","MoKα","","0.048","0.0361","","","0.0925","0.1013","","","","","","1.052","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322579","6.5997","0.0003","16.4115","0.0009","8.2463","0.0003","90","","100.432","0.003","90","","878.4","0.07","100","0.1","100","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H26 B2 F8 P2 -","- C10 H26 B2 F8 P2 -","- C20 H52 B4 F16 P4 -","2","0.5","","Shaun E. Landau; Robert H. Morris; Alan J. Lough","Acidic Dicationic Iron(II) Dihydrogen Complexes and Compounds Related by H2 Substitution","Inorganic Chemistry","1999","38","","6060","6068","10.1021/ic990876a","","","0.71073","MoKα","","0.0525","0.0354","","","0.0911","0.0964","","","","","","1.06","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322580","19.007","0.0004","8.7536","0.0002","25.3958","0.0005","90","","92.035","0.001","90","","4222.68","0.16","223","2","223","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C44 H48 B2 N8 Ni O8 -","- C44 H48 B2 N8 Ni O8 -","- C176 H192 B8 N32 Ni4 O32 -","4","0.5","","Arnold L. Rheingold; Brian S. Haggerty; Louise M. Liable-Sands; Swiatoslaw Trofimenko","N,O-Polydentate Scorpionate Ligands","Inorganic Chemistry","1999","38","","6306","6308","10.1021/ic990881e","","","0.71073","MoKα","","0.0477","0.0371","","0.1374","0.1031","","","","1.896","1.961","1.961","","","","","has coordinates","301838","2025-08-20","22:17:37",""
"4322581","6.1206","0.0004","11.1242","0.0004","13.6222","0.0006","90","","93.675","0.003","90","","925.58","0.08","298","","298","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C12 H12 Cl6 Cu2 Zr -","- C12 H12 Cl6 Cu2 Zr -","- C24 H24 Cl12 Cu4 Zr2 -","2","0.5","","Andrew M. Dattelbaum; James D. Martin","Benzene-Copper(I) Coordination in a Bimetallic Chain Complex","Inorganic Chemistry","1999","38","","6200","6205","10.1021/ic991064h","","","0.71073","MolybdenumKα","","0.045","0.044","","0.054","0.053","","","","","1.56","1.56","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4322582","11.86","0.002","18.345","0.002","13.176","0.002","90","","107.925","0.006","90","","2727.6","0.7","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H23 Au3 N6 O2 S3 -","- C19 H23 Au3 N6 O2 S3 -","- C76 H92 Au12 N24 O8 S12 -","4","1","","William J. Hunks; Michael C. Jennings; Richard J. Puddephatt","Gold Complexes of Trithiocyanuric Acid: A Two-Dimensional Polymer Assembled through Gold(I)...Gold(I) Interactions","Inorganic Chemistry","1999","38","","5930","5931","10.1021/ic991085b","","","0.71073","MoKα","","0.1022","0.0461","","","0.08","0.0921","","","","","","0.941","","","","has coordinates","179328","2020-10-21","18:00:00",""
"4322583","29.2589","0.0015","29.2589","0.0015","14.2131","0.0009","90","","90","","120","","10537.4","1","292","2","292","2","","","","","","","","7","P -3","-P 3","147","","","","- C65 H65 Au3 N3 O2 P3 S3 -","- C65 H65 Au3 N3 O2 P3 S3 -","- C390 H390 Au18 N18 O12 P18 S18 -","6","1","","William J. Hunks; Michael C. Jennings; Richard J. Puddephatt","Gold Complexes of Trithiocyanuric Acid: A Two-Dimensional Polymer Assembled through Gold(I)...Gold(I) Interactions","Inorganic Chemistry","1999","38","","5930","5931","10.1021/ic991085b","","","0.71073","MoKα","","0.2088","0.0887","","","0.1584","0.2013","","","","","","1.029","","","","has coordinates,has disorder","179328","2020-10-21","18:00:00",""
"4327652","11.746","0.004","12.462","0.003","17.851","0.006","73.54","0.02","75.06","0.03","88.11","0.03","2418.9","1.4","293","","","","","","","","","","","9","P -1","-P 1","2","","","","- C19 H38 Cl3 Mo3 N O8.9 P3 S9.1 Sb -","- C19 H28 Cl3 Mo3 N O8 P3 S9 Sb Y -","- C38 H56 Cl6 Mo6 N2 O16 P6 S18 Sb2 Y2 -","2","1","","Shao-Fang Lu; Jian-Quan Huang; Xiao-Ying Huang; Qiang-Jin Wu; Rong-Min Yu","Synthesis, Crystal Structure, and Spectroscopic Characterization of a Series of Cubane-like Mo-Sb Clusters Containing a [Mo3SbOS3]7+ Core","Inorganic Chemistry","1999","38","","3801","3805","10.1021/ic971464+","","","0.71073","MoKα","","","0.055","","","0.065","","","","","1.57","1.57","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327653","12.758","0.014","17.859","0.013","11.882","0.004","75.05","0.04","88.15","0.07","73.24","0.07","2502","4","293","","","","","","","","","","","9","P -1","-P 1","2","","","","- C22 H38 Br3 Mo3 N O10 P3 S9 Sb -","- C22 H38 Br3 Mo3 N O10 P3 S9 Sb -","- C44 H76 Br6 Mo6 N2 O20 P6 S18 Sb2 -","2","1","","Shao-Fang Lu; Jian-Quan Huang; Xiao-Ying Huang; Qiang-Jin Wu; Rong-Min Yu","Synthesis, Crystal Structure, and Spectroscopic Characterization of a Series of Cubane-like Mo-Sb Clusters Containing a [Mo3SbOS3]7+ Core","Inorganic Chemistry","1999","38","","3801","3805","10.1021/ic971464+","","","0.71069","MoKα","","","0.086","","","0.099","","","","","1.65","1.65","","","","","has coordinates","190289","2020-10-21","18:00:00",""
"4327654","11.727","0.005","12.951","0.003","17.957","0.004","73.52","0.03","76.22","0.03","89","0.03","2536.3","1.5","293","","","","","","","","","","","9","P -1","-P 1","2","","","","- C22 H44 I3 Mo3 N O10 P3 S9 Sb -","- C22.1667 H38 I3 Mo3 N O9.875 P3 S9 Sb -","- C44.3334 H76 I6 Mo6 N2 O19.75 P6 S18 Sb2 -","2","1","","Shao-Fang Lu; Jian-Quan Huang; Xiao-Ying Huang; Qiang-Jin Wu; Rong-Min Yu","Synthesis, Crystal Structure, and Spectroscopic Characterization of a Series of Cubane-like Mo-Sb Clusters Containing a [Mo3SbOS3]7+ Core","Inorganic Chemistry","1999","38","","3801","3805","10.1021/ic971464+","","","0.71073","MoKα","","","0.053","","","0.065","","","","","1.44","1.44","","","","","has coordinates","190289","2020-10-21","18:00:00",""
"4327655","13.261","0.004","13.529","0.004","12.535","0.008","101.54","0.03","105.13","0.04","93.2","0.02","2113.1","1.7","293","","","","","","","","","","","9","P -1","-P 1","2","","","","- C18 H33.5 Br3 Mo3 N O9.5 P2 S7 Sb -","- C18 H31 Br3 Mo3 N O9.5 P2 S7 Sb -","- C36 H62 Br6 Mo6 N2 O19 P4 S14 Sb2 -","2","1","","Shao-Fang Lu; Jian-Quan Huang; Xiao-Ying Huang; Qiang-Jin Wu; Rong-Min Yu","Synthesis, Crystal Structure, and Spectroscopic Characterization of a Series of Cubane-like Mo-Sb Clusters Containing a [Mo3SbOS3]7+ Core","Inorganic Chemistry","1999","38","","3801","3805","10.1021/ic971464+","","","0.71069","MoKα","","","0.06","","","0.076","","","","","1.65","1.65","","","","","has coordinates","190289","2020-10-21","18:00:00",""
"4327656","10.74","0.002","18.912","0.004","17.163","0.004","90","","90","","90","","3486.1","1.3","294","1","294","1","","","","","","","crystallized from acetone-toluene","7","P n m a","-P 2ac 2n","62","","","","- C24 H28 Br N6 O7 S4 V2 -","- C29 H24 Br2 N8 O8 S4 V2 -","- C116 H96 Br8 N32 O32 S16 V8 -","4","0.5","","Subodh Kanti Dutta; Satyabrata Samanta; Sujit Baran Kumar; Oc Hee Han; Pannee Burckel; A. Alan Pinkerton; Muktimoy Chaudhury","Mixed-Oxidation Divanadium(IV,V) Compound with Ligand Asymmetry: Electronic and Molecular Structure in Solution and in the Solid State","Inorganic Chemistry","1999","38","","1982","1988","10.1021/ic980743+","","","0.71073","Mo-Kα","","0.118","0.065","","","0.087","","","","","2.81","2.81","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4327657","13.412","0.001","24.019","0.002","23.685","0.002","90","","93.2","0.01","90","","7618.1","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C70 H85 Cl3 Eu N16 O12.5 -","- C70 H64 Cl3 Eu N16 O12.5 -","- C280 H256 Cl12 Eu4 N64 O50 -","4","1","","Cheng-Yong Su; Bei-Sheng Kang; Han-Qin Liu; Qi-Guang Wang; Zhong-Ning Chen; Zhong-Ling Lu; Ye-Xiang Tong; Thomas C. W. Mak","Luminescent Lanthanide Complexes with Encapsulating Polybenzimidazole Tripodal Ligands","Inorganic Chemistry","1999","38","","1374","1375","10.1021/ic980899+","","","0.71073","MoKα","","0.1539","0.06","","0.218","0.1693","","","","0.978","1.181","1.181","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4327658","12.819","0.001","21.056","0.002","22.638","0.002","90","","90","","90","","6110.4","0.9","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C56 H58 Cl3 Eu N15 O12.5 -","- C56 H57 Cl3 Eu N15 O12.5 -","- C224 H228 Cl12 Eu4 N60 O50 -","4","1","","Cheng-Yong Su; Bei-Sheng Kang; Han-Qin Liu; Qi-Guang Wang; Zhong-Ning Chen; Zhong-Ling Lu; Ye-Xiang Tong; Thomas C. W. Mak","Luminescent Lanthanide Complexes with Encapsulating Polybenzimidazole Tripodal Ligands","Inorganic Chemistry","1999","38","","1374","1375","10.1021/ic980899+","","","0.71073","MoKα","","0.0956","0.0884","","0.2508","0.234","","","","1.071","1.086","1.086","","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4327659","16.627","0.003","13.161","0.002","14.045","0.002","90","","95.82","0.01","90","","3057.6","0.8","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C33 H39 N7 -","- C33 H32 N7 -","- C132 H128 N28 -","4","1","","Cheng-Yong Su; Bei-Sheng Kang; Han-Qin Liu; Qi-Guang Wang; Zhong-Ning Chen; Zhong-Ling Lu; Ye-Xiang Tong; Thomas C. W. Mak","Luminescent Lanthanide Complexes with Encapsulating Polybenzimidazole Tripodal Ligands","Inorganic Chemistry","1999","38","","1374","1375","10.1021/ic980899+","","","0.71073","MoKα","","0.1021","0.0883","","0.2791","0.2602","","","","1.131","1.157","1.157","","","","","has coordinates,has disorder","179379","2020-10-21","18:00:00",""
"4327660","24.3131","0.0003","21.54","0.0001","19.8936","0.0003","90","","90","","90","","10418.4","0.2","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- Cs2 Ni4 O48 P W9 -","- Cs2 Ni4 O48 P W9 -","- Cs16 Ni32 O384 P8 W72 -","8","1","","Ulrich Kortz; André Tézé; Gilbert Hervé","A Cubane-Substituted Polyoxoanion: Structure and Magnetic Properties of Cs2[H2PW9Ni4O34(OH)3(H2O)6].5H2O","Inorganic Chemistry","1999","38","","2038","2042","10.1021/ic981138+","","","0.71073","MoKα","","0.1319","0.0804","","0.2108","0.1699","","","","1.132","1.133","1.133","","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327661","17.514","0.005","9.666","0.006","16.368","0.003","90","","90.49","0.02","90","","2771","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","porphyrin","","","- C28 H38 Cl Fe N4 -","- C32 H36 Cl Fe N4 -","- C128 H144 Cl4 Fe4 N16 -","4","0.5","","Takahisa Ikeue; Yoshiki Ohgo; Akira Uchida; Mikio Nakamura; Hiroshi Fujii; Masataka Yokoyama","High-Spin (meso-Tetraalkylporphyrinato)iron(III) Complexes As Studied by X-ray Crystallography, EPR, and Dynamic NMR Spectroscopies","Inorganic Chemistry","1999","38","","1276","1281","10.1021/ic981184+","","","0.71069","MoKα","","0.0732","0.047","","0.1397","0.1239","","","","1.093","1.118","1.118","","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327662","9.247","0.003","17.956","0.009","19.869","0.009","90","","90","","90","","3299","2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","Chloro[2-(diphenylphosphino)ethanethiolato-P,S]-triphenylphospinepalladium(II)","","- C33 H31 Cl3 P2 Pd S -","- C33 H31 Cl3 P2 Pd S -","- C132 H124 Cl12 P8 Pd4 S4 -","4","1","","Nuria Brugat; Alfonso Polo; Ángel Álvarez-Larena; J. Francesc Piniella; Julio Real","Palladium Phosphinothiolato Complexes. Syntheses and Crystal Structures of Mononuclear [PdCl(SC2H4PPh2)PPh3] and Binuclear [Pd2Cl2(μ-SC3H6PPh2)2] and Their Performance in Catalytic Carbonylation","Inorganic Chemistry","1999","38","","4829","4837","10.1021/ic981224+","","","0.71069","MoKα","","0.0701","0.0435","","0.1023","0.0985","","","","0.934","1.082","1.082","","","","","has coordinates,has disorder","179379","2020-10-21","18:00:00",""
"4327663","12.701","0.003","12.04","0.004","22.495","0.002","90","","97.36","0.01","90","","3411.6","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Dichlorobis{μ-[3-(diphenylphosphino)propanethiolato]-P,μ-S}-dipalladium(II)","","- C31 H34 Cl4 P2 Pd2 S2 -","- C31 H34 Cl4 P2 Pd2 S2 -","- C124 H136 Cl16 P8 Pd8 S8 -","4","1","","Nuria Brugat; Alfonso Polo; Ángel Álvarez-Larena; J. Francesc Piniella; Julio Real","Palladium Phosphinothiolato Complexes. Syntheses and Crystal Structures of Mononuclear [PdCl(SC2H4PPh2)PPh3] and Binuclear [Pd2Cl2(μ-SC3H6PPh2)2] and Their Performance in Catalytic Carbonylation","Inorganic Chemistry","1999","38","","4829","4837","10.1021/ic981224+","","","0.71069","MoKα","","0.0329","0.0274","","","0.0729","0.0743","","","","","","1.085","","","","has coordinates,has disorder","179379","2020-10-21","18:00:00",""
"4327664","24.7386","0.0003","11.3363","0.0001","10.3987","0.0001","90","","90","","90","","2916.26","0.05","180","2","180","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C30 H30 Ag2 N4 O4 -","- C30 H30 Ag2 N4 O4 -","- C120 H120 Ag8 N16 O16 -","4","1","","Stephen J. Archibald; Nathaniel W. Alcock; Daryle H. Busch; David R. Whitcomb","Synthesis and Characterization of Functionalized N,N'-Diphenylformamidinate Silver(I) Dimers: Solid-State Structures and Solution Properties","Inorganic Chemistry","1999","38","","5571","5578","10.1021/ic981270+","","","0.71073","MoKα","","0.0667","0.0488","","0.0909","0.0825","","","","1.165","1.152","1.152","","","","","has coordinates,has disorder","301838","2025-08-20","22:17:44",""
"4327665","8.0228","0.0001","14.4933","0.0003","13.3917","0.0002","90","","106.724","0.001","90","","1491.28","0.04","180","2","180","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H30 Ag2 N4 S4 -","- C30 H30 Ag2 N4 S4 -","- C60 H60 Ag4 N8 S8 -","2","1","","Stephen J. Archibald; Nathaniel W. Alcock; Daryle H. Busch; David R. Whitcomb","Synthesis and Characterization of Functionalized N,N'-Diphenylformamidinate Silver(I) Dimers: Solid-State Structures and Solution Properties","Inorganic Chemistry","1999","38","","5571","5578","10.1021/ic981270+","","","0.71073","MoKα","","0.053","0.0341","","0.0613","0.056","","","","0.922","0.961","0.961","","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327666","6.788","0.001","12.799","0.001","16.999","0.002","90","","90","","90","","1476.9","0.3","296","","296","","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C8 H18 Cl Co N2 O5 S2 -","- C8 H16 Cl Co N2 O5 S2 -","- C32 H64 Cl4 Co4 N8 O20 S8 -","4","1","","Toshiaki Yonemura; Kimi Shibuya; Tomoharu Ama; Hiroshi Kawaguchi; Ken-ichi Okamoto; Jinsai Hidaka; Takaji Yasui","Three-Membered -SCoCH2 Chelate Ring Complex Formed by Photodecarboxylation Reaction of Optically Active trans(O)-[Co(edtda)(en)]Cl (edtda = Ethylenedithiodiacetate)","Inorganic Chemistry","1999","38","","3244","3247","10.1021/ic981391+","","","0.7107","MoKα","","","0.035","","","0.05","","","","","","","","","","","has coordinates","198748","2020-10-21","18:00:00",""
"4327667","12.401","0.001","14.782","0.001","15.16","0.001","90","","90","","90","","2779","0.3","296","","296","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C7 H16 Cl Co N2 O6 S2 -","- C7 H16 Cl Co N2 O6 S2 -","- C56 H128 Cl8 Co8 N16 O48 S16 -","8","1","","Toshiaki Yonemura; Kimi Shibuya; Tomoharu Ama; Hiroshi Kawaguchi; Ken-ichi Okamoto; Jinsai Hidaka; Takaji Yasui","Three-Membered -SCoCH2 Chelate Ring Complex Formed by Photodecarboxylation Reaction of Optically Active trans(O)-[Co(edtda)(en)]Cl (edtda = Ethylenedithiodiacetate)","Inorganic Chemistry","1999","38","","3244","3247","10.1021/ic981391+","","","0.7107","MoKα","","","0.049","","","0.065","","","","","","","","","","","has coordinates","198748","2020-10-21","18:00:00",""
"4327668","12.147","0.003","20.32","0.004","26.646","0.005","90","","90","","90","","6577","2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H30 N2 O3 -","- C21 H30 N2 O3 -","- C252 H360 N24 O36 -","12","3","","Oliver Brosch; Thomas Weyhermüller; Nils Metzler-Nolte","Synthesis of Alkynyl Amino Acids and Peptides and Their Palladium-Catalyzed Coupling to Ferrocene","Inorganic Chemistry","1999","38","","5308","5313","10.1021/ic990256+","","","0.71073","MoKα","","0.0887","0.0598","","0.1391","0.1281","","","","0.933","1.042","1.042","","","","","has coordinates","301838","2025-08-20","22:17:44",""
"4327669","12.113","0.005","12.579","0.006","8.238","0.003","90.09","0.04","96.93","0.03","110.6","0.03","1165.1","0.9","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H24 N14 O8 Pt -","- C12 H24 N14 O8 Pt -","- C24 H48 N28 O16 Pt2 -","2","1","","Jussi Viljanen; Karel D. Klika; Reijo Sillanpää; Jorma Arpalahti","Intramolecular Migration of Coordinated Platinum(II) from the N7 Site to the Exocyclic Amino Group in 9-Methyladenine","Inorganic Chemistry","1999","38","","4924","4925","10.1021/ic990498+","","","0.71069","MoKα","","0.0817","0.0388","","","0.0715","0.0812","","","","","","1.029","","","","has coordinates","301838","2025-08-20","22:17:44",""
"4327670","14.7789","0.0009","15.9222","0.0008","20.4073","0.0012","101.155","0.003","99.379","0.003","105.285","0.004","4427","0.5","203","","203","","","","","","","","","9","P -1","-P 1","2","","","","- C81 H74 Cl F3 N4 O4 P4 Re2 S -","- C80 H74 Cl N4 O P4 Re2 -","- C160 H148 Cl2 N8 O2 P8 Re4 -","2","1","","Yan Ding; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 19.1 Studies of the Reactions of Five Structural Isomers of Re2Cl2(μ-dppm)2(CO)(CNXyl)3 That Lead to the Dirhenium(I) Complexes [Re2(μ-Cl)(μ-CO)(μ-dppm)2(CNXyl)4]O3SCF3 and [Re2Cl(μ-dppm)2(CO)(CNXyl)3(NCCH3)]O3SCF3","Inorganic Chemistry","1999","38","","5165","5170","10.1021/ic990538+","","","0.71073","Mo-Kα","","","0.062","","","","0.169","","","","","","1.061","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4327671","15.5808","0.0011","21.7521","0.0018","13.5611","0.0011","90","","113.336","0.006","90","","4220.1","0.6","295","","295","","","","","","","","","9","C 1 2/m 1","-C 2y","12","","","","- C88 H80 Cl F3 N4 O4 P4 Re2 S -","- C88 H80 Cl2 N4 O2 P4 Re2 -","- C176 H160 Cl4 N8 O4 P8 Re4 -","2","0.25","","Yan Ding; Phillip E. Fanwick; Richard A. Walton","Reactions of the Dirhenium(II) Complexes Re2X4(μ-dppm)2 (X = Cl, Br; dppm = Ph2PCH2PPh2) with Isocyanides. 19.1 Studies of the Reactions of Five Structural Isomers of Re2Cl2(μ-dppm)2(CO)(CNXyl)3 That Lead to the Dirhenium(I) Complexes [Re2(μ-Cl)(μ-CO)(μ-dppm)2(CNXyl)4]O3SCF3 and [Re2Cl(μ-dppm)2(CO)(CNXyl)3(NCCH3)]O3SCF3","Inorganic Chemistry","1999","38","","5165","5170","10.1021/ic990538+","","","0.71073","MO-Kα","","","0.062","","","","0.154","","","","","","1.054","","","","has coordinates","179379","2020-10-21","18:00:00",""
"4331388","12.5994","","7.498","","14.2648","","90","","96.625","","90","","1338.6","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","K2 (Ag As3 Se6)","","- Ag As3 K2 Se6 -","- Ag As3 K2 Se6 -","- Ag4 As12 K8 Se24 -","4","1","","Wachhold, M.; Kanatzidis, M.G.","Condensation of pyramidal [As Se3](3-) anions for the construction of polymeric networks: solventothermal synthesis of K3 Ag As2 Se5 .0.25(Me O H), K2 Ag As3 Se6 and Rb2 Ag As3 Se6","Inorganic Chemistry","1999","38","","3863","3870","10.1021/ic990274r","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4331389","12.717","","7.7329","","14.368","","90","","95.745","","90","","1405.84","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Rb2 (Ag As3 Se6)","","- Ag As3 Rb2 Se6 -","- Ag As3 Rb2 Se6 -","- Ag4 As12 Rb8 Se24 -","4","1","","Wachhold, M.; Kanatzidis, M.G.","Condensation of pyramidal [As Se3](3-) anions for the construction of polymeric networks: solventothermal synthesis of K3 Ag As2 Se5 .0.25(Me O H), K2 Ag As3 Se6 and Rb2 Ag As3 Se6","Inorganic Chemistry","1999","38","","3863","3870","10.1021/ic990274r","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4331403","9.9401","","7.5714","","17.201","","90","","90.728","","90","","1294.45","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Rb (Ag2 As3 Se6)","","- Ag2 As3 Rb Se6 -","- Ag2 As3 Rb Se6 -","- Ag8 As12 Rb4 Se24 -","4","1","","Wachhold, M.; Kanatzidis, M.G.","Rb Ag2 As3 Se6 : a unique three-dimensional silver-selenoarsenate framework 3/(infinite)(Ag2 As3 Se6)(-), assembled from (As3 Se6)(3-) rings and ""Ag2(2+)"" dumbbell units","Inorganic Chemistry","1999","38","","4178","4180","10.1021/ic9905392","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4331409","5.6045","","5.2567","","7.8061","","90","","96.594","","90","","228.456","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","(Ag F)2 (Ag F4) (As F6)","","- Ag3 As F12 -","- Ag3 As F12 -","- Ag3 As F12 -","1","0.25","","Bartlett, N.; Graudejus, O.; Shen, C.-P.; Lucier, G.M.; Allman, J.A.; Zemva, B.","Disproportionation of Ag(II) to Ag(I) and Ag(III) in fluoride systems and syntheses and structures of (Ag F)(+)2 (Ag F4)(-) (M F6)(-) salts (M = As, Sb, Pt, Au, Ru)","Inorganic Chemistry","1999","38","","4570","4577","10.1021/ic9905603","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4344876","8.257","0.003","21.694","0.008","3.7543","0.0017","90","","90","","90","","672.5","0.5","220","2","220","2","","","","","","","","5","P n n m","-P 2 2n","58","","","","- C12 H8 Cu2 N4 S2 -","- C12 H8 Cu2 N4 S2 -","- C24 H16 Cu4 N8 S4 -","2","0.25","","Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Crew, Marcello; Hanton, Lyall R.; Hubberstey, Peter; Parsons, Simon; Schröder, Martin","Two- and three-dimensional CuSCN co-ordination networks including new CuSCN structural motifs","Journal of the Chemical Society, Dalton Transactions: Inorganic Chemistry (1972-1999)","1999","","16","2813","2817","10.1039/a903218e","","","0.71073","MoKα","","0.0719","0.0391","","","0.0703","0.0788","","","","","","1.047","","","","has coordinates,has disorder","180576","2020-10-21","18:00:00",""
"4344877","5.7282","0.0017","7.049","0.002","9.861","0.003","100.802","0.019","103.338","0.019","101.623","0.017","367.9","0.2","220","2","220","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H10 Cu2 N4 S2 -","- C14 H10 Cu2 N4 S2 -","- C14 H10 Cu2 N4 S2 -","1","0.5","","Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Crew, Marcello; Hanton, Lyall R.; Hubberstey, Peter; Parsons, Simon; Schröder, Martin","Two- and three-dimensional CuSCN co-ordination networks including new CuSCN structural motifs","Journal of the Chemical Society, Dalton Transactions: Inorganic Chemistry (1972-1999)","1999","","16","2813","2817","10.1039/a903218e","","","0.71073","MoKα","","0.0316","0.0229","","","0.0509","0.0538","","","","","","1.032","","","","has coordinates,has disorder","180576","2020-10-21","18:00:00",""
"5000057","21.262","0.01","21.262","0.01","5.984","0.005","90","","90","","120","","2342.77","","","","","","","","","","","","","3","P 31","P 31","144","","","","- C10 H20 O -","- C10 H20 O -","- C90 H180 O9 -","9","3","","Bombicz, P.; Buschmann, J.; Luger, P.; Dung, Nguyen Xuan; Nam, Chu Ba","Crystal structure of (1R,2S,5R)-2-isopropyl-5-methyl-cyclohexanol, (-)-menthol","Zeitschrift für Kristallographie - Crystalline Materials","1999","214","7","420","423","10.1524/zkri.1999.214.7.420","","","","","","","","","","","","","","","","","","","","","has coordinates","301844","2025-08-21","10:11:30",""
"5000250","13.456","0.001","17.884","0.002","28.965","0.002","90","","90","","90","","6970.34","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C64 H94 N8 O15 -","- C67 N8 O13 -","- C268 N32 O52 -","4","1","","Renner, Matthew K.; Shen, Ya-Ching; Cheng, Xing-Chung; Jensen, Paul R.; Frankmoelle, Walter; Kauffman, Christopher A.; Fenical, William; Lobkovsky, Emil; Clardy, Jon","Cyclomarins A‒C, New Antiinflammatory Cyclic Peptides Produced by a Marine Bacterium (Streptomyces sp.)","Journal of the American Chemical Society","1999","121","49","11273","11276","10.1021/ja992482o","","","","","","","","","","","","","","","","","","","","","has coordinates","175374","2020-10-21","18:00:00",""
"5000275","9.593","0.005","7.815","0.005","11.342","0.005","90","","99.47","0.04","90","","838.71","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H25 N O -","- C19 H25 N O -","- C38 H50 N2 O2 -","2","1","","Williams, Geoffrey M.; Roughley, Stephen D.; Davies, John E.; Holmes, Andrew B.; Adams, Joseph P.","Synthesis of (-)-Histrionicotoxin by a Tandem Process","Journal of the American Chemical Society","1999","121","20","4900","4901","10.1021/ja990138l","","","","","","","","","","","","","","","","","","","","","has coordinates","301844","2025-08-21","10:11:31",""
"5000287","12.438","0.006","8.753","0.006","13.696","0.003","90","","90","","90","","1491.08","","","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C10 H6 Br4 Cl2 N2 -","- C20 H12 Br8 Cl4 N4 -","- C80 H48 Br32 Cl16 N16 -","4","0.5","","Gribble, G. W.; Blank, D. H.; Jasinski, J. P.","Synthesis and identification of two halogenated bipyrroles present in seabird eggs","Chemical Communications","1999","","21","2195","2196","10.1039/A906655A","","","","","","","","","","","","","","","","","","","","","has coordinates","176754","2020-10-21","18:00:00",""
"5000314","10.52","0.003","18.475","0.005","26.692","0.007","90","","98.13","0.015","90","","5135.5","2.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C47 H87 N O6 W2 -","- C47 H87 N O6 W2 -","- C188 H348 N4 O24 W8 -","4","1","","Barry, Jane T.; Bollinger, John C.; Chisholm, Malcolm H.; Glasgow, Katherine C.; Huffman, John C.; Lucas, Eric A.; Lubkovsky, Emil B.; Streib, William E.","Preparation and Characterization of 1,3-Butadiene and Isoprene Complexes, W~2~(OCH~2~^t^Bu)~6~(diene)(py), and Studies of the Selective Hydrogenation of 1,3-Dienes","Organometallics","1999","18","12","2300","2308","10.1021/om990059i","","","0.71073","MoKα","","0.0908","0.0471","","0.1145","0.0945","","","","1.071","1.173","1.173","","","","","has coordinates,has disorder","301844","2025-08-21","10:11:31",""
"5000365","17.172","0.002","18.302","0.003","34.534","0.005","90","","100.363","0.008","90","","10677","2","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C105 H96 Cl10 Mn6 O16 -","- C110.51 H90 Cl6.684 Mn6 O16 -","- C442.04 H360 Cl26.736 Mn24 O64 -","4","1","","Guillem Aromí; Michael J. Knapp; Juan-Pablo Claude; John C. Huffman; David N. Hendrickson; George Christou","High-Spin Molecules: Hexanuclear MnIII Clusters with [Mn6O4X4]6+ (X = Cl-, Br-) Face-Capped Octahedral Cores and S= 12 Ground States","Journal of the American Chemical Society","1999","121","","5489","5499","10.1021/ja983446c","","","0.71069","MoKα","","","0.058","","","","0.0573","","","","","","2.4015","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000368","13.888","0.003","8.3476","0.0018","24.702","0.005","90","","102.689","0.012","90","","2793.8","1","105.15","","20","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H24 Cl3 Mn O4 -","- C31 H24 Cl3 Mn O4 -","- C124 H96 Cl12 Mn4 O16 -","4","1","","Guillem Aromí; Michael J. Knapp; Juan-Pablo Claude; John C. Huffman; David N. Hendrickson; George Christou","High-Spin Molecules: Hexanuclear MnIII Clusters with [Mn6O4X4]6+ (X = Cl-, Br-) Face-Capped Octahedral Cores and S= 12 Ground States","Journal of the American Chemical Society","1999","121","","5489","5499","10.1021/ja983446c","","","0.71069","MoKα","","","0.0533","","","","0.0456","","","","","","1.4551","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000370","25.421","0.003","34.611","0.003","13.1126","0.0013","90","","90","","90","","11537","2","106","","106","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C132 H155 N O8 W2 -","- C132 H159 N O8 W2 -","- C528 H636 N4 O32 W8 -","4","0.5","","Malcolm H. Chisholm; Kirsten Folting; William E. Streib; De-Dong Wu","Dinuclear Molybdenum and Tungsten Complexes with Metal-Metal Triple Bonds Supported by p-tert-Butylcalix[4]arene Ligands","Inorganic Chemistry","1999","38","","5219","5229","10.1021/ic990513a","","","0.71069","MoKα","","","0.0578","","","","0.0519","","","","","","1.118","","","","has coordinates,has disorder","277867","2022-09-15","08:51:11",""
"5000371","12.3843","0.0017","22.13","0.003","18.621","0.003","90","","100.264","0.008","90","","5021.7","1.3","105","","105","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C112 H140 Mo2 N6 O8 -","- C112 H127.46 Mo2 N4 O8 -","- C224 H254.92 Mo4 N8 O16 -","2","0.5","","Malcolm H. Chisholm; Kirsten Folting; William E. Streib; De-Dong Wu","Dinuclear Molybdenum and Tungsten Complexes with Metal-Metal Triple Bonds Supported by p-tert-Butylcalix[4]arene Ligands","Inorganic Chemistry","1999","38","","5219","5229","10.1021/ic990513a","","","0.71069","MoKα","","","0.0585","","","","0.0584","","","","","","1.2484","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000372","13.105","0.004","18.631","0.006","20.543","0.006","90","","94.035","0.016","90","","5003","3","104","","104","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C108 H152 Mo2 N2 O12 -","- C103.6 H133.6 Mo2 N2 O10.2 -","- C207.2 H267.2 Mo4 N4 O20.4 -","2","1","","Malcolm H. Chisholm; Kirsten Folting; William E. Streib; De-Dong Wu","Dinuclear Molybdenum and Tungsten Complexes with Metal-Metal Triple Bonds Supported by p-tert-Butylcalix[4]arene Ligands","Inorganic Chemistry","1999","38","","5219","5229","10.1021/ic990513a","","","0.71069","MoKα","","","0.067","","","","0.0662","","","","","","1.5027","","","","has coordinates,has disorder","176451","2020-10-21","18:00:00",""
"5000380","11.101","0.001","11.352","0.001","12.018","0.001","108.565","0.008","116.572","0.008","90.829","0.008","1261.86","","","","","","","","","","","","","6","P -1","-P 1","2","","cis-Tetracarbonyl-triphenylphosphine-(trifluoroacetoxymethyl)-rhenium","","- C25 H17 F3 O6 P Re -","- C25 H17 F3 O6 P Re -","- C50 H34 F6 O12 P2 Re2 -","2","1","","Brown, D. A.; Mandal, S. K.; Ho, D. M.; Becker, T. M.; Orchin, M.","Synthesis of some manganese and rhenium trifluoroacetoxymethyl and iodomethyl complexes. X-ray structures of cis-Re(CO)~4~(PPh~3~)CH~2~OC(O)CF~3~, fac-Re(CO)~3~(dppp)CH~2~OC(O)CF~3~ and cis-Re(CO)~4~(PPh~3~)CH~2~I","Journal of Organometallic Chemistry","1999","592","1","61","68","10.1016/S0022-328X(99)00482-9","","","","","","","4.41","","","4.41","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"5000390","16.6635","0.0007","7.8104","0.0003","14.4375","0.0004","90","","101.079","0.003","90","","1844","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Tri(o-tolyl)fluorosilane","","- C21 H21 F Si -","- C21 H24 F Si -","- C84 H96 F4 Si4 -","4","1","","Dell, Steven; Ho, Douglas M.; Pascal, Jr., Robert A.","in- and out-Cyclophanes Bearing Non-Hydrogen Bridgehead Substituents","The Journal of Organic Chemistry","1999","64","15","5626","5633","10.1021/jo990727+","","","","","","","5.1","","","5.1","","","","","","","","","","","has coordinates","199708","2020-10-21","18:00:00",""
"5000391","19.8971","0.0008","6.9274","0.0002","19.4153","0.0008","90","","103.846","0.001","90","","2598.35","","110","2","110","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","Hexabenzotriphenylene","Dibenzo(f,j)phenanthro(9,10-s)picene","","- C42 H24 -","- C42 H24 -","- C168 H96 -","4","1","","Lisa Barnett; Douglas M. Ho; Kim K. Baldridge; Robert A. Pascal","The Structure of Hexabenzotriphenylene and the Problem of Overcrowded ""D3h"" Polycyclic Aromatic Compounds","Journal of the American Chemical Society","1999","121","","727","733","10.1021/ja983471i","","","0.71073","MoKα","","0.0962","0.0563","","0.1621","0.1417","","","","1.054","1.176","1.176","","","","","has coordinates","301844","2025-08-21","10:11:31",""
"5000392","10.3293","0.0004","17.0485","0.0006","15.3155","0.0005","90","","109.324","0.002","90","","2545.1","","","","110","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Fluorosilaphane","Tribenzo 6-fluoro-6-sila-2,10,19-trithia(5^6,14^)(11)metacyclophane","","- C30 H27 F S3 Si -","- C30 H27 F S3 Si -","- C120 H108 F4 S12 Si4 -","4","1","","Dell, Steven; Ho, Douglas M.; Pascal, Jr., Robert A.","in- and out-Cyclophanes Bearing Non-Hydrogen Bridgehead Substituents","The Journal of Organic Chemistry","1999","64","15","5626","5633","10.1021/jo990727+","","","","","","","4.77","","","4.77","","","","","","","","","","","has coordinates","301844","2025-08-21","10:11:31",""
"5000393","10.1184","0.0004","14.51","0.0006","14.8047","0.0004","90","","101.102","0.002","90","","2132.92","","","","170","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","10-Acetoxy-9,11,20,22-tetraphenyltetrabenzo(a,c,l,n)pentacene","","- C64 H40 O2 -","- C136 H90 O10 -","- C272 H180 O20 -","2","0.5","","Jiajia Zhang; D.M.Ho; R.A.Pascal Junior","","Tetrahedron Lett.","1999","40","","3859","","10.1016/S0040-4039(99)00643-7","","","","","","","6.02","","","6.02","","","","","","","","","","","has coordinates","176451","2020-10-21","18:00:00",""
"6000145","7.313","","5.453","","10.64","","90","","90","","90","","424.3","","","","","","","","","","","","","3","P n m a","","","","","","- C4 Cr N3 -","","","","","","Quintero, M.; Barreto, A.; Grima, P.; Tovar, R.; Quintero, E.; Porras, G. S.; Ruiz, J.; Woolley, J. C.; Lamarche, G.; Lamarche, A. M.","Crystallographic properties of I-2-Fe-Iv-Vi(4) magnetic semiconductor compounds","Materials Research Bulletin","1999","34","","2263","2270","10.1016/S0025-5408(00)00166-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000153","5.7145","","7.8589","","5.5002","","90","","90","","90","","247.01","","","","","","","","","","","","","4","P n m a","","","","","","- Mn Nd2 O6 Ti -","","","","","","Nakano, H.; Nakazima, N.; Shirakami, T.; Kamegashira, N.","Crystal structure of a new oxide, Nd2TiMnO6","Materials Research Bulletin","1999","34","","1851","1858","10.1016/S0025-5408(99)00208-1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000176","9.134","","10.085","","12.691","","73.52","","86.05","","76.43","","1089.72","","","","","","","","","","","","","4","P 1","","","","","","- Cd Mn3 Sn Te4 -","","","","","","Zheng, C.; Wang, R. J.","Synthesis of the one dimensional telluride: [Mn(en)(3)]CdSnTe4(I) and its semiconductor characteristics","Chinese Journal of Inorganic Chemistry","1999","15","","661","666","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000181","5.7358","","5.7358","","46.849","","90","","90","","120","","1334.81","","","","","","","","","","","","","5","R -3 c","","","","","","- Al2 Ca4 Cl2 H20 O16 -","","","","","","Renaudin, G.; Kubel, F.; Rivera, J. P.; Francois, M.","Structural phase transition and high temperature phase structure of Friedels salt, 3CaO Al2O3 CaCl2 10H(2)O","Cement and Concrete Research","1999","29","","1937","1942","10.1016/S0008-8846(99)00199-4","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000182","7.7912","","7.231","","9.3114","","90","","106.873","","90","","502","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C H3.28 F0.72 Ga O3.28 P -","","","","","","Paulet, C.; Serre, C.; Loiseau, T.; Riou, D.; Ferey, G.","Hybrid open-frameworks (MIL-n): Syntheses and structures of 2-dimensional gallium methylphosphonates (MIL-23) and 3-dimensional copper vanadium methyldiphosphonate (MIL-24)","Comptes Rendus de l'Academie des Sciences, Serie IIc: Chimie","1999","2","","631","636","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000183","7.2514","","7.2514","","7.3413","","90","","90","","120","","334.31","","","","","","","","","","","","","7","P -3","","","","","","- C3 H16 F3 Ga3 N2 O9 P2 -","","","","","","Paulet, C.; Serre, C.; Loiseau, T.; Riou, D.; Ferey, G.","Hybrid open-frameworks (MIL-n): Syntheses and structures of 2-dimensional gallium methylphosphonates (MIL-23) and 3-dimensional copper vanadium methyldiphosphonate (MIL-24)","Comptes Rendus de l'Academie des Sciences, Serie IIc: Chimie","1999","2","","631","636","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000184","6.3884","","10.7284","","11.2762","","90","","90","","90","","772.84","","","","","","","","","","","","","6","P 21 21 21","","","","","","- C H6 Cu O9 P2 V -","","","","","","Paulet, C.; Serre, C.; Loiseau, T.; Riou, D.; Ferey, G.","Hybrid open-frameworks (MIL-n): Syntheses and structures of 2-dimensional gallium methylphosphonates (MIL-23) and 3-dimensional copper vanadium methyldiphosphonate (MIL-24)","Comptes Rendus de l'Academie des Sciences, Serie IIc: Chimie","1999","2","","631","636","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000187","7.257","","7.2434","","6.3","","90","","124.73","","90","","272.16","","","","10","","","","","","","","","3","P 1 21/c 1","","","","","","- Ca D4 N2 -","","","","","","Senker, J.; Jacobs, H.; Muller, M.; Press, W.; Mayer, H. M.; Ibberson, R. M.","Structure determination of a low temperature phase of calcium and strontium amide by means of neutron powder diffraction on Ca(ND2)(2) and Sr(ND2)(2)","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","2025","2032","10.1002/(SICI)1521-3749(199912)625:12<2025::AID-ZAAC2025>3.0.CO;2-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000188","7.695","","7.6837","","6.6324","","90","","124.917","","90","","321.56","","","","5","","","","","","","","","3","P 1 21/c 1","","","","","","- D4 N2 Sr -","","","","","","Senker, J.; Jacobs, H.; Muller, M.; Press, W.; Mayer, H. M.; Ibberson, R. M.","Structure determination of a low temperature phase of calcium and strontium amide by means of neutron powder diffraction on Ca(ND2)(2) and Sr(ND2)(2)","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","2025","2032","10.1002/(SICI)1521-3749(199912)625:12<2025::AID-ZAAC2025>3.0.CO;2-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000189","21.411","","11.221","","12.208","","90","","90","","90","","2933.01","","","","","","","","","","","","","5","F d d 2","","","","","","- H4 K2 N5 O17 Pr -","","","","","","Dong, W. T.; Zhang, H. J.; Su, Q. A.; Lin, Y. H.; Wang, S. M.; Zhu, C. S.","Crystal growth, structure, and properties of new nonlinear optical materials: K(2)Ln(NO3)(5) 2H(2)O (Ln = La, Ce, Pr, Nd, Sm)","Journal of Solid State Chemistry","1999","148","","302","307","10.1006/jssc.1999.8451","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000190","5.3739","","5.5411","","11.9536","","90","","90","","90","","355.95","","","","","","","","","","","","","4","B m a b","","","","","","- Ca Cr Nd O4 -","","","","","","de Paz, J. R.; Velasco, J. H.; Fernandez-Diaz, M. T.; Porcher, P.; Martinez, J. L.; Puche, R. S.","Structural and magnetic characterization of NdCaCrO4 oxide","Journal of Solid State Chemistry","1999","148","","361","369","10.1006/jssc.1999.8461","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000191","9.8198","","4.7436","","19.0638","","90","","90","","90","","888.01","","","","","","","","","","","","","3","P n m a","","","","","","- Ba2 Cd Te3 -","","","","","","Wang, Y. C.; Disalvo, F. J.","Synthesis and structural characterization of Ba2CdTe3","Journal of Solid State Chemistry","1999","148","","464","467","10.1006/jssc.1999.8480","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000192","10.64","","10.64","","10.64","","90","","90","","90","","1204.55","","","","","","","","","","","","","5","P m -3","","","","","","- H40 K3 Nb4 O62 W3 -","","","","","","Lin, B. F.; Zhu, S. S.; Xie, G. Y.; Chen, J.; Hu, C. H.","Prepare and structure determination of potassium peroxyniobatungstate","Chinese Journal of Inorganic Chemistry","1999","15","","78","82","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000193","12.8902","0.0001","12.8902","0.0001","12.8902","0.0001","90","","90","","90","","2141.8","0.03","295","","","","","","","","","","","3","F m -3 m","-F 4 2 3","","","","","- C13 H36 Si4 -","- C130.6 Si48 -","- C522.4 Si192 -","4","0.0208333","SE0261","Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander","Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~","Acta Crystallographica Section B","1999","55","6","1014","1029","10.1107/S0108768199006126","","","0.82488","synchrotron","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"6000194","13.5218","0.0001","13.5218","0.0001","13.5218","0.0001","90","","90","","90","","2472.31","0.03","295","","","","","","","","","","","3","F m -3 m","-F 4 2 3","","","","","- C12 H36 Si5 -","- C120 Si49 -","- C480 Si196 -","4","0.0208333","SE0261","Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander","Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~","Acta Crystallographica Section B","1999","55","6","1014","1029","10.1107/S0108768199006126","","","1.14946","synchrotron","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"6000195","13.17158","0.00006","13.17158","0.00006","13.17158","0.00006","90","","90","","90","","2285.14","0.018","200","","200","","","","","","","","","3","P 21 3","P 2ac 2ab 3","","","","","- C12 H36 Si5 -","- C18 H54 Si5 -","- C72 H216 Si20 -","4","0.333333","SE0261","Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander","Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~","Acta Crystallographica Section B","1999","55","6","1014","1029","10.1107/S0108768199006126","","","1.14946","synchrotron","","","","","","","","","","","","","","","","","has coordinates","188515","2020-10-21","18:00:00",""
"6000196","12.609","0.003","12.609","0.003","12.609","0.003","90","","90","","90","","2004.7","0.8","150","","150","","","","","","","","","3","P 21 3","P 2ac 2ab 3","","","","","- C13 H36 Si4 -","- C19 H54 Si4 -","- C76 H216 Si16 -","4","0.333333","SE0261","Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander","Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~","Acta Crystallographica Section B","1999","55","6","1014","1029","10.1107/S0108768199006126","","","0.82488","synchrotron","","","","","","","","","","","","","","","","","has coordinates","188515","2020-10-21","18:00:00",""
"6000197","12.7876","0.0001","12.7876","0.0001","12.7876","0.0001","90","","90","","90","","2091.06","0.03","260","","260","","","","","","","","","3","P a -3","-P 2ac 2ab 3","","","","","- C13 H36 Si4 -","- C19 Si4 -","- C76 Si16 -","4","0.166667","SE0261","Dinnebier, Robert E.; Dollase, Wayne A.; Helluy, Xavier; Kümmerlen, Jörg; Sebald, Angelika; Schmidt, Martin U.; Pagola, Silvina; Stephens, Peter W.; van Smaalen, Sander","Order‒disorder phenomena determined by high-resolution powder diffraction: the structures of tetrakis(trimethylsilyl)methane C[Si(CH~3~)~3~]~4~ and tetrakis(trimethylsilyl)silane Si[Si(CH~3~)~3~]~4~","Acta Crystallographica Section B","1999","55","6","1014","1029","10.1107/S0108768199006126","","","0.82488","synchrotron","","","","","","","","","","","","","","","","","has coordinates","176292","2020-10-21","18:00:00",""
"6000198","16.96","0.0006","8.1382","0.0002","11.781","0.0002","90","","104.777","0.002","90","","1572.28","0.07","120","1","120","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2,4,6-Tri-isopropylbenzenesulfonamide","","- C15 H25 N O2 S -","- C15 H25 N O2 S -","- C60 H100 N4 O8 S4 -","4","1","FG0009","Tremayne, Maryjane; MacLean, Elizabeth J.; Tang, Chiu C.; Glidewell, Christopher","2,4,6-Triisopropylbenzenesulfonamide: Monte Carlo structure solution from X-ray powder diffraction data for a molecular system containing four independent asymmetric rotors","Acta Crystallographica Section B","1999","55","6","1068","1074","10.1107/S0108768199006060","","","1.3","synchrotron","","","","","","","","","","2.97","","","","","","","has coordinates","301845","2025-08-21","10:22:19",""
"6000204","11.289","","20.644","","11.632","","90","","90.81","","90","","2710.57","","","","","","","","","","","","","3","P 1 21 1","","","","","","- C27 H36 O12 -","","","","","","Schenk, H.; Driessen, R. A. J.; de Gelder, R.; Goubitz, K.; Nieboer, H.; Brüggemann-Rotgans, I. E. M.; Diepenhorst, P.","Elucidation of the structure of Solanoeclepin A, a natural hatching factor of potato and tomato cyst nematodes, by single-crystal x-ray diffraction","Croatica Chemica Acta","1999","72","2-3","593","606","","","","","","","","","","","","","","","","","","","","","","","175218","2020-10-21","18:00:00",""
"6000205","15.265","","20.524","","3.99","","90","","90","","90","","1250.06","","","","","","","","","","","","","3","P 21 21 21","","","","","","- C18 H12 O2 -","","","","","","Yatsenko, A. V.; Chernyshev, V. V.; Zhukov, S. G.; Sonneveld, E. J.; Schenk, H.","Crystal structure of 3-methoxybenzanthrone from X-ray powder diffraction","Powder Diffraction","1999","14","","133","135","10.1017/S0885715600010447","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000206","8.3115","0.0001","8.3115","0.0001","3.3858","0.0001","90","","90","","120","","233.88","","","","","","","","","","","","","4","P -6","P -6","174","","","","- C Li Na O3 -","- C Li Na O4 -","- C3 Li3 Na3 O12 -","3","0.5","","Zhukov, S. G.; Yatsenko, A. V.; Chernyshev, V. V.; D'yakov, V. A.; Le, Loux R; Schenk, H.","X-ray high temperature powder diffraction study and computer simulation of gamma-LiNaCO3","Zeitschrift für Kristallographie","1999","214","5","255","258","10.1524/zkri.1999.214.5.255","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","203338","2020-10-21","18:00:00",""
"6000207","4.8963","","9.9849","","6.8391","","90","","91.994","","90","","334.15","","","","","","","","","","","","","3","P 1 21/c 1","","","","","","- Na2 O3 Se -","","","","","","Helmholdt, R. B.; Sonneveld, E. J.; Schenk, H.","The crystal structure of sodium selenite Na2SeO3 from powder diffraction data","Zeitschrift für Kristallographie","1999","214","3","151","153","10.1524/zkri.1999.214.3.151","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000221","11.599","","11.55","","8.575","","90","","110.76","","90","","1074.19","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C9 H12 N4 O4 -","- C9 H12 N4 O4 -","- C36 H48 N16 O16 -","4","1","","Chernyshev, V. V.; Yatsenko, A. V.; Tafeenko, V. A.; Sonneveld, E. J.; Schenk, H.; Makarov, V. A.","Crystal and molecular structure of 1-amino-4-methoxycarbonyl-3-methyl-8-oxopyrazolo[1,5-a]pyrimidine monohydrate from laboratory powder data","Powder Diffraction","1999","14","","289","292","10.1017/S0885715600010708","","","","","","","","","","","","","","","","","","","","","has coordinates","301845","2025-08-21","10:22:19",""
"6000222","7.299","","9.435","","9.42","","90","","90","","90","","648.72","","","","","","","","","","","","","4","P 21 21 21","","","","","","- C H N2 Rb -","","","","","","Becker, M.; Jansen, M.","Synthesis and characterization of rubidium hydrogen cyanamide","Zeitschrift für Naturforschung B","1999","54","11","1375","1378","10.1515/znb-1999-1107","","","","","","","","","","","","","","","","","","","","","","174976","2020-10-21","18:00:00",""
"6000223","20.2586","","7.9489","","13.9716","","90","","121.641","","90","","1915.46","","","","","","","","","","","","","4","C 1 2/c 1","","","","","","- C12 H18 O15 Pr2 -","","","","","","Serpaggi, F.; Ferey, G.","Hybrid open frameworks (MIL-n): synthesis and crystal structure of MIL-17-a rare-earth dicarboxylate with a relatively open framework, [Pr(H2O)](2)[O2C (CH2)(2)CO2](3) H2O","Microporous and Mesoporous Materials","1999","32","","311","318","10.1016/S1387-1811(99)00120-1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000224","25.128","","25.128","","25.128","","90","","90","","90","","15866.2","","","","","","","","","","","","","5","F d -3","","","","","","- Al92 H144 Na60 O440 Si100 -","","","","","","Zhu, L.; Seff, K.; Olson, D. H.; Cohen, B. J.; von Dreele, R. B.","Hydronium ions in zeolites. 1. Structures of partially and fully dehydrated Na,H3O-X by X-ray and neutron diffraction","Journal of Physical Chemistry B","1999","103","","10365","10372","10.1021/jp991070z","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000225","25.101","","25.101","","25.101","","90","","90","","90","","15815.1","","","","","","","","","","","","","5","F d -3","","","","","","- Al92 H32 Na60 O384 Si100 -","","","","","","Zhu, L.; Seff, K.; Olson, D. H.; Cohen, B. J.; von Dreele, R. B.","Hydronium ions in zeolites. 1. Structures of partially and fully dehydrated Na,H3O-X by X-ray and neutron diffraction","Journal of Physical Chemistry B","1999","103","","10365","10372","10.1021/jp991070z","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000226","8.379","","8.379","","8.379","","90","","90","","90","","588.27","","","","","","","","","","","","","4","P 21 3","","","","","","- As Cl Hg3 O4 -","","","","","","Romanenko, G. V.; Pervukhina, N. V.; Borisov, S. V.; Magarill, S. A.; Vasiliev, V. I.","Crystal structure of kuznetsovite Hg-3(AsO4)Cl","Journal of Structural Chemistry","1999","40","","270","275","10.1007/BF02903656","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000227","7.208","","7.208","","10.198","","90","","90","","90","","529.84","","","","","","","","","","","","","3","I 41/a m d","","","","","","- O7 Sm2 Ti2 -","","","","","","Rabanal, M. E.; Varez, A.; Amador, U.; Dompablo, E. A. Y.; Garcia-Alvarado, F.","Structure and reaction with lithium of tetragonal pyrochlore-like compound Sm~2~Ti~2~O~7~","Journal of Materials Processing Technology","1999","","","529","533","10.1016/S0924-0136(99)00211-3","","","","","","","","","","","","","","","","","","","","","","174853","2020-10-21","18:00:00",""
"6000228","8.3617","","7.1899","","5.4586","","90","","103.784","","90","","318.72","","","","","","","","","","","","","5","P 1 21/m 1","","","","","","- C3 H4 O5 P Pr -","","","","","","Serpaggi, F.; Ferey, G.","Hybrid organic-inorganic frameworks (MIL-n). Hydrothermal synthesis of a series of pillared lanthanide carboxyethylphosphonates and X-ray powder ab initio structure determination of MIL-19, Pr[O3P(CH2)(2)CO2]","Inorganic Chemistry","1999","38","","4741","4744","10.1021/ic981440i","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000229","4.6357","","8.7735","","2.8334","","90","","90","","90","","115.24","","","","","","","","","","","","","3","P b m m","","","","","","- Cu O3 Si -","","","","","","Otto, H. H.; Meibohm, M.","Crystal structure of copper polysilicate, Cu[SiO3]","Zeitschrift für Kristallographie","1999","214","9","558","565","10.1524/zkri.1999.214.9.558","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000230","7.6733","0.0004","9.6398","0.0005","7.0852","0.0003","90","","106.195","","90","","503.29","0.04","","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C H17 Co N6 O7 -","- C Co N6 O7 -","- C2 Co2 N12 O14 -","2","1","","Zhu, J. H.; Wu, H. X.; Le Bail, A.","Structure of [Co(NH3)(5)CO3]NO3·H2O","Solid State Sciences","1999","1","","55","62","10.1016/S1293-2558(00)80064-3","powder diffraction","x-ray","1.5418","CuKα","","","","","","","","","0.053","","","","","","","","has coordinates","190905","2020-10-21","18:00:00",""
"6000231","11.0859","","11.0859","","11.0859","","90","","90","","90","","1362.43","","","","","","","","","","","","","3","F d -3 m","","","","","","- Fe3 Mo3 N -","","","","","","Jackson, S. K.; Layland, R. C.; zur Loye, H. C.","The simultaneous powder X-ray and neutron diffraction refinement of two eta-carbide type nitrides, Fe3Mo3N and Co3Mo3N, prepared by ammonolysis and by plasma nitridation of oxide precursors","Journal of Alloys and Compounds","1999","291","","94","101","10.1016/S0925-8388(99)00484-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000232","11.027","","11.027","","11.027","","90","","90","","90","","1340.83","","","","","","","","","","","","","3","F d -3 m","","","","","","- Co3 Mo3 N -","","","","","","Jackson, S. K.; Layland, R. C.; zur Loye, H. C.","The simultaneous powder X-ray and neutron diffraction refinement of two eta-carbide type nitrides, Fe3Mo3N and Co3Mo3N, prepared by ammonolysis and by plasma nitridation of oxide precursors","Journal of Alloys and Compounds","1999","291","","94","101","10.1016/S0925-8388(99)00484-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000234","7.9362","","5.9639","","18.4416","","90","","91.325","","90","","872.62","","","","","","","","","","","","","4","P 1 2/c 1","","","","","","- Ba3 Er Ga2 O7.5 -","","","","","","Abakumov, A. M.; Shpanchenko, R. V.; Lebedev, O. I.; Van, Tendeloo G; Amelinckx, S.; Antipov, E. V.","The phase transitions and crystal structures of Ba3RM2O7.5 complex oxides (R = rare-earth elements, m = Al, Ga)","Acta Crystallographica Section A","1999","55","5","828","839","10.1107/S0108767399002068","","","","","","","","","","","","","","","","","","","","","","174685","2020-10-21","18:00:00",""
"6000235","24.7451","0.0002","8.4735","0.0006","4.8808","0.0001","90","","90","","90","","1023.39","0.08","","","298.1","1","","","","","","","","3","P m m a","","","","","","- Al14 O25 Sr4 -","- Al14 O25 Sr4 -","- Al28 O50 Sr8 -","2","0.25","","Wang, D.; Wang, M. Q.; Lu, G. L.","Synthesis, crystal structure and X-ray powder diffraction data of the phosphor matrix 4SrO . 7Al(2)O(3)","Journal of Materials Science","1999","34","","4959","4964","10.1023/A:1004759621850","","x-ray","","CuK","","","","","","","","","","","","","","","","","has coordinates","176292","2020-10-21","18:00:00",""
"6000240","9.037","","9.037","","9.037","","90","","90","","90","","738.03","","","","","","","","","","","","","2","F d -3 m","","","","","","- N4 Sn3 -","","","","","","Scotti, N.; Kockelmann, W.; Senker, J.; Trassel, S.; Jacobs, H.","Sn3N4, a tin(IV) nitride - Syntheses and the first crystal structure determination of a binary tin-nitrogen compound","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","1435","1439","10.1002/(SICI)1521-3749(199909)625:9<1435::AID-ZAAC1435>3.0.CO;2-#","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000241","3.3285","","3.3285","","58.127","","90","","90","","120","","557.71","","","","","","","","","","","","","3","R -3 m","","","","","","- In2 O8 Zn5 -","","","","","","Pitschke, W.; Koumoto, K.","Powder diffraction data and Rietveld refinement for Y-doped (ZnO)(5)In2O3","Powder Diffraction","1999","14","","213","218","10.1017/S0885715600010551","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000242","3.3505","","3.3505","","57.863","","90","","90","","120","","562.54","","","","","","","","","","","","","4","R -3 m","","","","","","- In1.6 O8 Y0.4 Zn5 -","","","","","","Pitschke, W.; Koumoto, K.","Powder diffraction data and Rietveld refinement for Y-doped (ZnO)(5)In2O3","Powder Diffraction","1999","14","","213","218","10.1017/S0885715600010551","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000243","12.3345","","8.523","","5.1397","","90","","102.572","","90","","527.37","","","","","","","","","","","","","3","C 1 2/c 1","","","","","","- N7 Na P4 -","","","","","","Landskron, K.; Irran, E.; Schnick, W.","High-temperature high-pressure synthesis of the highly condensed nitridophosphates NaP4N7, KP4N7, RbP4N7, and CsP4N7 and their crystal-structure determinations by X-ray powder diffraction","Chemistry - a European Journal","1999","5","","2548","2553","10.1002/(SICI)1521-3765(19990903)5:9<2548::AID-CHEM2548>3.0.CO;2-W","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000244","12.2387","","9.8485","","4.6651","","90","","90","","90","","562.3","","","","","","","","","","","","","3","P n m a","","","","","","- K N7 P4 -","","","","","","Landskron, K.; Irran, E.; Schnick, W.","High-temperature high-pressure synthesis of the highly condensed nitridophosphates NaP4N7, KP4N7, RbP4N7, and CsP4N7 and their crystal-structure determinations by X-ray powder diffraction","Chemistry - a European Journal","1999","5","","2548","2553","10.1002/(SICI)1521-3765(19990903)5:9<2548::AID-CHEM2548>3.0.CO;2-W","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000245","12.3107","","9.8946","","4.6844","","90","","90","","90","","570.6","","","","","","","","","","","","","3","P n m a","","","","","","- N7 P4 Rb -","","","","","","Landskron, K.; Irran, E.; Schnick, W.","High-temperature high-pressure synthesis of the highly condensed nitridophosphates NaP4N7, KP4N7, RbP4N7, and CsP4N7 and their crystal-structure determinations by X-ray powder diffraction","Chemistry - a European Journal","1999","5","","2548","2553","10.1002/(SICI)1521-3765(19990903)5:9<2548::AID-CHEM2548>3.0.CO;2-W","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000246","12.4205","","9.9782","","4.7162","","90","","90","","90","","584.5","","","","","","","","","","","","","3","P n m a","","","","","","- Cs N7 P4 -","","","","","","Landskron, K.; Irran, E.; Schnick, W.","High-temperature high-pressure synthesis of the highly condensed nitridophosphates NaP4N7, KP4N7, RbP4N7, and CsP4N7 and their crystal-structure determinations by X-ray powder diffraction","Chemistry - a European Journal","1999","5","","2548","2553","10.1002/(SICI)1521-3765(19990903)5:9<2548::AID-CHEM2548>3.0.CO;2-W","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000247","4.0413","","4.0413","","12.6073","","90","","90","","90","","205.9","","","","","","","","","","","","","4","I 4/m m m","","","","","","- N O3 Sr2 Ta -","","","","","","Diot, N.; Marchand, R.; Haines, J.; Leger, J. M.; Macaudiere, P.; Hull, S.","Crystal structure determination of the oxynitride Sr2TaO3N","Journal of Solid State Chemistry","1999","146","","390","393","10.1006/jssc.1999.8369","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000248","10.1394","","10.1394","","10.1394","","90","","90","","90","","1042.41","","","","","","","","","","","","","3","I a -3","","","","","","- N2 O Zr2 -","","","","","","Clarke, S. J.; Michie, C. W.; Rosseinsky, M. J.","Structure of Zr2ON2 by neutron powder diffraction: The absence of nitride-oxide ordering","Journal of Solid State Chemistry","1999","146","","399","405","10.1006/jssc.1999.8372","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000249","15.972","","7.1927","","6.916","","96.299","","131.643","","121.438","","353.84","","","","","","","","","","","","","3","P -1","","","","","","- Nd4 O7 Pd -","","","","","","Andersson, M.; Grins, J.; Nygren, M.","Structure, thermodynamic, and magnetic properties of Ln(4)PdO(7) with Ln = La, Nd, Sm, Eu, and Gd","Journal of Solid State Chemistry","1999","146","","428","436","10.1006/jssc.1999.8387","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000250","4.0373","","4.0373","","8.7912","","90","","90","","90","","143.29","","","","","","","","","","","","","4","P 4/m m m","","","","","","- Cl Nd O5 Te2 -","","","","","","Nikiforov, G. B.; Kusainova, A. M.; Berdonosov, P. S.; Dolgikh, V. A.; Lightfoot, P.","The crystal structure of the new REE-Te oxychlorides: NdTe2O5Cl and GdTe2O5Cl","Journal of Solid State Chemistry","1999","146","","473","477","10.1006/jssc.1999.8395","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000251","3.9611","","3.9611","","8.4043","","90","","90","","90","","131.87","","","","","","","","","","","","","4","P 4/m m m","","","","","","- Cl Gd O5 Te2 -","","","","","","Nikiforov, G. B.; Kusainova, A. M.; Berdonosov, P. S.; Dolgikh, V. A.; Lightfoot, P.","The crystal structure of the new REE-Te oxychlorides: NdTe2O5Cl and GdTe2O5Cl","Journal of Solid State Chemistry","1999","146","","473","477","10.1006/jssc.1999.8395","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000255","5.4704","","17.2471","","14.9219","","90","","90","","90","","1407.86","","","","","","","","","","","","","3","P n m a","","","","","","- Bi4 O10 V2 -","","","","","","Satto, C.; Millet, P.; Sciau, P.; Roucau, C.; Galy, J.","α-Bi4V2O10 crystal structure and oxidation mechanism. X-ray and electron diffraction analysis","Materials Research Bulletin","1999","34","","655","664","10.1016/S0025-5408(99)00058-6","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000256","16.0608","","5.3829","","3.6383","","90","","92.869","","90","","314.15","","","","","","","","","","","","","4","P 1 21 1","","","","","","- C7 H5 Na O3 -","","","","","","Dinnebier, R. E.; von Dreele, R.; Stephens, P. W.; Jelonek, S.; Sieler, J.","Structure of sodium para-hydroxybenzoate, NaO2C-C6H4OH by powder diffraction: application of a phenomenological model of anisotropic peak width","Journal of Applied Crystallography","1999","32","","761","769","10.1107/S0021889899005233","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000257","6.634","","6.634","","6.634","","90","","90","","90","","291.962","","","","","","","","","","","","","3","P 41 3 2","P 4bd 2ab 3","213","","","","- Mo3 N Ni2 -","- Mo3 N Ni2 -","- Mo12 N4 Ni8 -","4","0.166667","","Weil, K. S.; Kumta, P. N.; Grins, J.","Revisiting a Rare Intermetallic Ternary Nitride, Ni2Mo3N: Crystal Structure and Property Measurements","Journal of Solid State Chemistry","1999","146","1","22","35","10.1006/jssc.1999.8296","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176292","2020-10-21","18:00:00",""
"6000258","5.6723","","10.1722","","14.1575","","90","","90","","90","","816.88","","","","","","","","","","","","","4","C m c m","","","","","","- Ba3 Cu O9 Ru2 -","","","","","","Rijssenbeek, J. T.; Huang, Q.; Erwin, R. W.; Zandbergen, H. W.; Cava, R. J.","The crystal structure of Ba3CuRu2O9 and comparison to Ba3MRu2O9 (M = In, Co, Ni, and Fe)","Journal of Solid State Chemistry","1999","146","","65","72","10.1006/jssc.1999.8309","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000259","5.7444","","4.962","","7.97","","90","","90","","90","","227.17","","","","","","","","","","","","","3","P n m a","","","","","","- C Ca O3 -","","","","","","Lucas, A.; Mouallem-Bahout, M.; Carel, C.; Gaude, J.; Matecki, M.","Thermal expansion of synthetic aragonite condensed review of elastic properties","Journal of Solid State Chemistry","1999","146","","73","78","10.1006/jssc.1999.8310","","","","","","","","","","","","","","","","","","","","","","202022","2020-10-21","18:00:00",""
"6000260","11.3552","","3.5732","","4.6548","","90","","90","","90","","188.87","","","","413.15","","","","","","","","","3","P m m n","","","","","","- Li O5 V2 -","","","","","","Satto, C.; Sciau, P.; Dooryhee, E.; Galy, J.; Millet, P.","The δ→ε→γ LiV~2~O~5~ ""high temperature"" phase transitions evidenced by synchrotron X-ray powder diffraction analysis","Journal of Solid State Chemistry","1999","146","","103","109","10.1006/jssc.1999.8314","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000261","11.2416","","11.2572","","11.0791","","90","","90","","90","","1402.05","","","","","","","","","","","","","3","P b c a","","","","","","- O14 Sr5 U3 -","","","","","","Cordfunke, E. H. P.; Huntelaar, M. E.; Ijdo, D. J. W.","The structure of BaSr4U3O14 and a structural and thermodynamic characterization of Sr5U3O14","Journal of Solid State Chemistry","1999","146","","144","150","10.1006/jssc.1999.8320","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000262","11.3647","","11.377","","11.0203","","90","","90","","90","","1424.88","","","","","","","","","","","","","4","C m c a","","","","","","- Ba O14 Sr4 U3 -","","","","","","Cordfunke, E. H. P.; Huntelaar, M. E.; Ijdo, D. J. W.","The structure of BaSr4U3O14 and a structural and thermodynamic characterization of Sr5U3O14","Journal of Solid State Chemistry","1999","146","","144","150","10.1006/jssc.1999.8320","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000263","10.3478","","3.6967","","13.3769","","90","","90","","90","","511.7","","","","","","","","","","","","","4","P n m a","","","","","","- K Mo O6 V -","","","","","","Mucha, D.; Olszewski, P. K.; Napruszewska, B.","Structural investigation of the potassium vanadomolybdate crystal","Journal of Solid State Chemistry","1999","146","","197","201","10.1006/jssc.1999.8333","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000265","5.4498","","5.4498","","9.332","","90","","90","","120","","240.03","","","","","","","","","","","","","3","P -6 2 m","","","","","","- Ag3.5 Al1.5 Sm -","","","","","","Zhak, O. V.; Kuz'ma, Y. B.; Stel'makhovych, B. M.","The compounds Ln(Ag0.7Al0.3)(5) (Ln-Pr, Nd, Sm) and their crystal structure","Journal of Alloys and Compounds","1999","289","","181","184","10.1016/S0925-8388(99)00166-8","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000266","9.5323","","5.6064","","9.8535","","90","","110.667","","90","","492.7","","","","","","","","","","","","","3","C 1 2 1","","","","","","- Bi Mn O3 -","","","","","","Atou, T.; Chiba, H.; Ohoyama, K.; Yamaguchi, Y.; Syono, Y.","Structure determination of ferromagnetic perovskite BiMnO3","Journal of Solid State Chemistry","1999","145","","639","642","10.1006/jssc.1999.8267","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000267","34.33","","7.8","","7.25","","103.69","","89.86","","94.12","","1881.12","","","","","","","","","","","","","5","P 1","","","","","","- C68 H144 Cr2 N2 O7 -","","","","","","Fosse, N.; Brohan, L.","Thermal and structural investigations of the bis-dihexadecyldimethylammonium dichromate","Journal of Solid State Chemistry","1999","145","","655","667","10.1006/jssc.1999.8277","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000268","8.822","","9.236","","8.451","","67.19","","91.32","","111.1","","586.72","","","","","","","","","","","","","6","P -1","","","","","","- C3 H14 N O10 P3 Zn2 -","","","","","","Hajem, A. A.; Trojette, B.; Driss, A.; Jouini, T.","Synthesis and structure determination of a new layered zincophosphate: [H~2~N~2~C~6~H~16~](0.5)[Zn~2~(PO~4~)(HPO~4~)(H~2~O)].H~2~O","Journal of Chemical Crystallography","1999","29","2","217","221","10.1023/A:1009582429917","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000269","19.95","","3.8236","","10.6563","","90","","90","","90","","812.87","","","","","","","","","","","","","2","P n m a","","","","","","- Te Zr2 -","","","","","","Orlygsson, G.; Harbrecht, B.","Synthesis and crystal structure of Zr2Te. Distinctions in bonding to isotypic Sc2Te and the relationship to the structures of congeneric Hf2Te and Zr2Se","Inorganic Chemistry","1999","38","","3377","3383","10.1021/ic990024a","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000270","11.2728","","11.2728","","9.803","","90","","90","","90","","1245.73","","","","","","","","","","","","","3","I 41/a","","","","","","- Mn3 O8 Ta2 -","","","","","","Grins, J.; Esmaeilzadeh, S.; Berastegui, P.; Eriksson, S.","Determination of the magnetic structure at 10 k of Mn3Ta2O8, and refinement of the crystal structure at 295 K, using neutron powder diffraction data","Journal of Materials Chemistry","1999","9","","1575","1578","10.1039/a902149c","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000272","23.84","","5.925","","4.922","","90","","90","","90","","695.24","","","","","","","","","","","","","3","P b c n","","","","","","- Ni7 P5 Si2 -","","","","","","Oryshchyn, S. V.; Babizhets'ky, V. S.; Kuz'ma, Y. B.; Glowiak, T.","Preparation and crystal structure of the Ni7Si2P5 phosphide","Zeitschrift für Kristallographie","1999","214","6","337","340","10.1524/zkri.1999.214.6.337","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000273","7.577","","3.9226","","5.6965","","90","","90","","90","","169.31","","","","","","","","","","","","","3","P n m a","","","","","","- H N Sr -","","","","","","Schultz-Coulon, V.; Irran, E.; Putz, B.; Schnick, W.","beta-SrNH and beta-SrND - Synthesis and crystal structure determination by X-ray and neutron powder diffraction","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","1086","1092","10.1002/(SICI)1521-3749(199907)625:7<1086::AID-ZAAC1086>3.0.CO;2-B","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000274","5.256","","5.178","","26.739","","90","","93.11","","90","","726.65","","","","","","","","","","","","","5","P 1 21/c 1","","","","","","- H4 Li4 O14 Rb2 Se3 -","","","","","","Pietraszko, A.; Bronowska, W.","Rb2Li4(SeO4)(3)2H(2)O - the new crystal of selenates hydrates family","Solid State Communications","1999","111","","205","209","10.1016/S0038-1098(99)00186-6","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000275","6.4917","","6.4917","","9.1941","","90","","90","","90","","387.46","","","","195","","","","","","","","","3","I 4/m c m","","","","","","- N Na3 O3 -","","","","","","Klosters, G.; Jansen, M.","Neutron diffraction study of the low-temperature phases of sodium oxide nitrite, Na3ONO2","Journal of Solid State Chemistry","1999","145","","267","275","10.1006/jssc.1999.8263","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000276","6.4651","","6.4651","","4.6238","","90","","90","","90","","193.27","","","","125","","","","","","","","","3","P 4/m b m","","","","","","- N Na3 O3 -","","","","","","Klosters, G.; Jansen, M.","Neutron diffraction study of the low-temperature phases of sodium oxide nitrite, Na3ONO2","Journal of Solid State Chemistry","1999","145","","267","275","10.1006/jssc.1999.8263","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000277","6.4535","","6.4535","","4.6197","","90","","90","","90","","192.4","","","","5","","","","","","","","","3","P -4 21 m","","","","","","- N Na3 O3 -","","","","","","Klosters, G.; Jansen, M.","Neutron diffraction study of the low-temperature phases of sodium oxide nitrite, Na3ONO2","Journal of Solid State Chemistry","1999","145","","267","275","10.1006/jssc.1999.8263","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000278","14.3296","","15.2733","","10.4428","","90","","91.052","","90","","2285.13","","","","","","","","","","","","","5","P 1 21/n 1","","","","","","- C9 H9 N3 O2 S -","","","","","","Chan, F. C.; Anwar, J.; Cernik, R.; Barnes, P.; Wilson, R. M.","Ab initio structure determination of sulfathiazole polymorph v from synchrotron X-ray powder diffraction data","Journal of Applied Crystallography","1999","32","3","436","441","10.1107/S0021889898017233","","","","","","","","","","","","","","","","","","","","","","174950","2020-10-21","18:00:00",""
"6000279","14.4948","","14.4948","","9.3173","","90","","90","","90","","1957.56","","","","","","","","","","","","","3","I 41/a m d","","","","","","- Bi2 Cd O4 -","","","","","","Kirik, S. D.; Shimanskiy, A. F.; Koryagina, T. I.","Crystal structure investigation and conductivity of binary bismuth-cadmium oxide Bi2CdO4","Solid State Ionics","1999","122","","249","254","10.1016/S0167-2738(98)00444-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000280","14.837","","3.1667","","10.49","","90","","134.919","","90","","349","","","","","","","","","","","","","4","C 1 2/m 1","","","","","","- K2 Mg O16 Sn7 -","","","","","","Uheda, K.; Horiuchi, A.; Takizawa, H.; Endo, T.","Synthesis and crystal structure of novel hollandite compounds A(x)Mg(x)/2Sn(8-x/2)O(16) (A = K, Rb, and Cs)","Journal of Porous Materials","1999","6","","161","166","10.1023/A:1009639607457","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000281","14.89","","3.1706","","10.514","","90","","134.989","","90","","351.05","","","","","","","","","","","","","4","C 1 2/m 1","","","","","","- Mg O16 Rb2 Sn7 -","","","","","","Uheda, K.; Horiuchi, A.; Takizawa, H.; Endo, T.","Synthesis and crystal structure of novel hollandite compounds A(x)Mg(x)/2Sn(8-x/2)O(16) (A = K, Rb, and Cs)","Journal of Porous Materials","1999","6","","161","166","10.1023/A:1009639607457","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000282","15.015","","3.1656","","10.621","","90","","135.061","","90","","356.59","","","","","","","","","","","","","4","C 1 2/m 1","","","","","","- Cs1.26 Mg0.63 O16 Sn7.37 -","","","","","","Uheda, K.; Horiuchi, A.; Takizawa, H.; Endo, T.","Synthesis and crystal structure of novel hollandite compounds A(x)Mg(x)/2Sn(8-x/2)O(16) (A = K, Rb, and Cs)","Journal of Porous Materials","1999","6","","161","166","10.1023/A:1009639607457","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000283","5.561","","5.561","","4.1708","","90","","90","","120","","111.7","","","","","","","","","","","","","3","P -3 m 1","","","","","","- H6 Mg Sr2 -","","","","","","Bertheville, B.; Yvon, K.","High-pressure synthesis and crystal structure of Sr2MgH6","Journal of Alloys and Compounds","1999","288","","197","199","10.1016/S0925-8388(99)00090-0","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000284","5.5458","","5.5458","","4.163","","90","","90","","120","","110.88","","","","","","","","","","","","","3","P -3 m 1","","","","","","- D6 Mg Sr2 -","","","","","","Bertheville, B.; Yvon, K.","High-pressure synthesis and crystal structure of Sr2MgH6","Journal of Alloys and Compounds","1999","288","","197","199","10.1016/S0925-8388(99)00090-0","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000285","5.529","","14.542","","5.347","","90","","90","","90","","429.91","","","","","","","","","","","","","4","I b m 2","","","","","","- Al Ca2 Fe O5 -","","","","","","Landa-Canovas, A. R.; Hansen, S.","Transmission electron microscopic study of ferrite in sulfate-resisting Portland cement clinker","Cement and Concrete Research","1999","29","","679","686","10.1016/S0008-8846(99)00031-9","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000286","10.1405","","10.1496","","21.6599","","90","","90","","90","","2229.28","","","","","","","","","","","","","4","P3c&","","","","","","- Ba5 Cu Ir3 O12 -","","","","","","Blake, G. R.; Battle, P. D.; Sloan, J.; Vente, J. F.; Darriet, J.; Weill, F.","Neutron diffraction study of the structures of Ba5CuIr3O12 and Ba16Cu3Ir10O39","Chemistry of Materials","1999","11","","1551","1558","10.1021/cm9807844","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000287","10.1344","","10.1344","","35.0564","","90","","90","","120","","3118.14","","","","","","","","","","","","","4","P 3 2 1","","","","","","- Ba16 Cu3 Ir10 O39 -","","","","","","Blake, G. R.; Battle, P. D.; Sloan, J.; Vente, J. F.; Darriet, J.; Weill, F.","Neutron diffraction study of the structures of Ba5CuIr3O12 and Ba16Cu3Ir10O39","Chemistry of Materials","1999","11","","1551","1558","10.1021/cm9807844","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000288","11.4612","0.0008","11.4612","0.0008","8.904","0.0008","90","","90","","90","","1169.62","","","","","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C4 H8 K O12 Y -","- C4 H8 K O12 Y -","- C16 H32 K4 O48 Y4 -","4","0.25","","Bataille, T.; Auffredic, J. P.; Louer, D.","Ab initio structure determination and dehydration dynamics of YK(C2O4)(2).4H(2)O studied by X-ray powder diffraction","Chemistry of Materials","1999","11","","1559","1567","10.1021/cm981155x","","","1.5406","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000289","12.426","0.002","12.173","0.002","6.656","0.001","90","","100.19","0.01","90","","991","0.2","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H11 N3 O3 -","","","4","1","","De Armas, H. N.; Hernandez, R. G.; Rivera, A. B.; Hernandez, R. P.; Martinez, I. H.","Crystal pseudopolymorphism of secnidazole bulk drug, C7H11N3O3","Powder Diffraction","1999","14","","136","141","10.1017/S0885715600010459","","","","","","","","","","","","","","","","","","","","","","203339","2020-10-21","18:00:00",""
"6000290","6.90991","0.00007","6.90991","0.00007","11.59782","0.00016","90","","90","","90","","553.749","","","","","","","","","","annealed at 850 C for 2 days, 950 C for 3 days, 1000 C for 1.5 days","","","4","I 4/m c m","-I 4 2c","140","","","","- Ba La2 O5 Zn -","- Ba La2 O5 Zn -","- Ba4 La8 O20 Zn4 -","4","0.125","","Kaduk, J. A.; Wong-Ng, W.; Greenwood, W.; Dillingham, J.; Toby, B. H.","Crystal structures and reference powder patterns of BaR2ZnO5 (R = La, Nd, Sm, Eu, Gd, Dy, Ho, Y, Er, and Tm)","Journal of Research of the National Institute of Standards and Technology","1999","104","","147","171","10.6028/jres.104.011","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000291","6.75982","0.00004","6.75982","0.00004","11.54565","0.00011","90","","90","","90","","527.58","","","","","","","","","","annealed at 850 C for 2 days, 950 C for 3 days, 1000 C for 1.5 days","","","4","I 4/m c m","-I 4 2c","140","","","","- Ba Nd2 O5 Zn -","- Ba Nd4 O5 Zn -","- Ba4 Nd16 O20 Zn4 -","4","0.125","","Kaduk, J. A.; Wong-Ng, W.; Greenwood, W.; Dillingham, J.; Toby, B. H.","Crystal structures and reference powder patterns of BaR2ZnO5 (R = La, Nd, Sm, Eu, Gd, Dy, Ho, Y, Er, and Tm)","Journal of Research of the National Institute of Standards and Technology","1999","104","","147","171","10.6028/jres.104.011","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:05:59",""
"6000292","3.6294","","6.4125","","10.972","","90","","90","","90","","255.36","","","","","","","","","","","","","3","I m m m","","","","","","- B2 La3 N4 -","","","","","","Reckeweg, O.; Meyer, H. J.","The nitrido borates Ln(3)B(2)N(4) (Ln = La-Nd) and La5B4N9: syntheses, structures, and properties","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","866","874","10.1002/(SICI)1521-3749(199906)625:6<866::AID-ZAAC866>3.0.CO;2-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000293","3.562","","6.319","","10.7191","","90","","90","","90","","241.27","","","","","","","","","","","","","3","I m m m","","","","","","- B2 Ce3 N4 -","","","","","","Reckeweg, O.; Meyer, H. J.","The nitrido borates Ln(3)B(2)N(4) (Ln = La-Nd) and La5B4N9: syntheses, structures, and properties","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","866","874","10.1002/(SICI)1521-3749(199906)625:6<866::AID-ZAAC866>3.0.CO;2-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000294","3.5346","","6.3003","","10.7904","","90","","90","","90","","240.29","","","","","","","","","","","","","3","I m m m","","","","","","- B2 N4 Pr3 -","","","","","","Reckeweg, O.; Meyer, H. J.","The nitrido borates Ln(3)B(2)N(4) (Ln = La-Nd) and La5B4N9: syntheses, structures, and properties","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","866","874","10.1002/(SICI)1521-3749(199906)625:6<866::AID-ZAAC866>3.0.CO;2-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000295","3.5152","","6.2701","","10.7559","","90","","90","","90","","237.07","","","","","","","","","","","","","3","I m m m","","","","","","- B2 N4 Nd3 -","","","","","","Reckeweg, O.; Meyer, H. J.","The nitrido borates Ln(3)B(2)N(4) (Ln = La-Nd) and La5B4N9: syntheses, structures, and properties","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","866","874","10.1002/(SICI)1521-3749(199906)625:6<866::AID-ZAAC866>3.0.CO;2-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000296","9.5525","","12.6348","","7.7033","","90","","90","","90","","929.74","","","","","","","","","","","","","3","P b c m","","","","","","- B4 La5 N9 -","","","","","","Reckeweg, O.; Meyer, H. J.","The nitrido borates Ln(3)B(2)N(4) (Ln = La-Nd) and La5B4N9: syntheses, structures, and properties","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","866","874","10.1002/(SICI)1521-3749(199906)625:6<866::AID-ZAAC866>3.0.CO;2-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000297","3.7217","","7.5158","","8.8321","","90","","90","","90","","247.05","","","","","","","","","","","","","4","P m m m","","","","","","- Ni O5 Sr2 Ti -","","","","","","Knee, C. S.; Weller, M. T.","Structure of TlSr2NiO4+delta by high-resolution neutron powder diffraction","Journal of Solid State Chemistry","1999","144","","62","67","10.1006/jssc.1998.8118","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000298","13.6607","","13.6607","","13.6607","","90","","90","","90","","2549.29","","","","","","","","","","","","","4","P 41 3 2","","","","","","- K3 La2 N9 O27 -","","","","","","Gobichon, A. E.; Auffredic, J. P.; Louer, D.","Potassium lanthanum nitrate system: Phase equilibria and thermal and structural properties","Journal of Solid State Chemistry","1999","144","","68","80","10.1006/jssc.1998.8119","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000299","7.616","","16.459","","7.704","","90","","102.48","","90","","942.89","","","","","","","","","","","","","3","P 1 21 1","","","","","","- Ce6 O25 Ta6 -","","","","","","Thompson, J. G.; Rae, A. D.; Bliznyuk, N.; Withers, R. L.","Ordering of Ce-III/Ce-IV and interstitial oxygens in CeTaO4+x (x approximate to 0.17) superstructure","Journal of Solid State Chemistry","1999","144","","240","246","10.1006/jssc.1998.8030","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000300","5.523","","5.4914","","7.7725","","90","","90","","90","","235.73","","","","","","","","","","","","","3","P b n m","","","","","","- Ga La O3 -","","","","","","Vasylechko, L.; Matkovski, A.; Suchocki, A.; Savytskii, D.; Syvorotka, I.","Crystal structure of LaGaO3 and (La,Gd)GaO3 solid solutions","Journal of Alloys and Compounds","1999","286","","213","218","10.1016/S0925-8388(98)01009-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000301","5.0978","","5.0978","","3.9121","","90","","90","","120","","88.05","","","","","","","","","","","","","3","P 6/m m m","","","","","","- Co6 Ge6 Tm -","","","","","","Fedyna, M. F.; Skolozdra, R. V.; Gorelenko, Y. K.","Magnetic and electric properties of RCo6Ge6 (R = Y, Dy, Er-Lu)","Inorganic Materials","1999","35","","373","375","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000302","4.1129","","4.1129","","13.906","","90","","90","","90","","235.23","","","","","","","","","","","","","3","I 41/a m d","","","","","","- Ga0.88 Ge1.12 Tb -","","","","","","Fedorchuk, A. A.; Dol'nikova, T. V.","Crystal structure of TbGe1.12-1.48Ga0.88-0.52","Inorganic Materials","1999","35","","468","470","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000303","8.671","","8.671","","5.917","","90","","90","","120","","385.28","","","","","","","","","","","","","3","P 63/m c m","","","","","","- Cu In3 Zr5 -","","","","","","Gulai, L. D.; Zaremba, V. I.; Kalychak, Y. M.; Koblyuk, N. A.","Crystal structure of Zr5MIn3 (M = Cu, Ag)","Inorganic Materials","1999","35","","471","475","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000304","8.735","","8.735","","5.948","","90","","90","","120","","393.03","","","","","","","","","","","","","3","P 63/m c m","","","","","","- Ag In3 Zr5 -","","","","","","Gulai, L. D.; Zaremba, V. I.; Kalychak, Y. M.; Koblyuk, N. A.","Crystal structure of Zr5MIn3 (M = Cu, Ag)","Inorganic Materials","1999","35","","471","475","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000305","18.6945","","5.7009","","4.1506","","90","","90","","90","","442.35","","","","","","","","","","","","","3","C m m m","","","","","","- B2 Na3 O -","","","","","","Albert, B.; Hofmann, K.","Synthesis, characterization, and crystal structure of Na3B20, determined and refined from X-ray and neutron powder data","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","709","713","10.1002/(SICI)1521-3749(199905)625:5<709::AID-ZAAC709>3.0.CO;2-L","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000306","10.3955","","3.503","","12.1157","","90","","90","","90","","441.2","","","","","","","","","","","","","3","P n m a","","","","","","- Ba O4 Y2 -","","","","","","Massarotti, V.; Capsoni, D.; Bini, M.; Altomare, A.; Moliterni, A. G. G.","X-ray diffraction study of polycrystalline Y2BaO4: a test of the new expo program","Zeitschrift für Kristallographie","1999","214","4","200","204","10.1524/zkri.1999.214.4.200","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000307","4.0139","","4.0139","","9.5423","","90","","90","","120","","133.15","","","","","","","","","","","","","4","P -3","","","","","","- Bi2.34 La0.33 O5.33 U -","","","","","","Amarilla, J. M.; Alonso, J. A.; Rojas, R. M.","Structural study of the trigonal Bi2.34U0.33La0.33O5 oxide ion conductor: Rietveld refinement of X-ray and neutron powder diffraction data","Journal of the Chemical Society, Dalton Transactions: Inorganic Chemistry (1972-1999)","1999","","","1137","1141","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000308","17.862","","3.9533","","10.6398","","90","","90","","90","","751.32","","","","","","","","","","","","","3","P n m a","","","","","","- Ni2 Sc5 Te2 -","","","","","","Maggard, P. A.; Corbett, J. D.","Sc5Ni2Te2: Synthesis, structure, and bonding of a metal-metal-bonded chain phase, a relative of Gd3MnI3","Inorganic Chemistry","1999","38","","1945","1950","10.1021/ic981073a","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000309","9.2272","","7.3532","","9.8496","","90","","101.315","","90","","655.3","","","","","","","","","","","","","7","P 1 21/c 1","","","","","","- C2 H9 F N2 O4 P V -","","","","","","Riou-Cavellec, M.; Serre, C.; Férey, G.","Hydrothermal synthesis and structure determination of [VF(PO~4~),N~2~C~2~H~9~] and [Ti(OH)(PO~4~),N~2~C~2~H~9~], two M(III) phosphates with the ULM-11 bidimensional topology","Comptes Rendus de l'Academie des Sciences, Serie IIc: Chimie","1999","2","3","147","152","10.1016/S1387-1609(99)80057-7","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000310","9.265","","7.329","","9.911","","90","","100.89","","90","","660.87","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C2 H10 N2 O5 P Ti -","","","","","","Riou-Cavellec, M.; Serre, C.; Férey, G.","Hydrothermal synthesis and structure determination of [VF(PO~4~),N~2~C~2~H~9~] and [Ti(OH)(PO~4~),N~2~C~2~H~9~], two M(III) phosphates with the ULM-11 bidimensional topology","Comptes Rendus de l'Academie des Sciences, Serie IIc: Chimie","1999","2","3","147","152","10.1016/S1387-1609(99)80057-7","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000311","8.5487","","8.5487","","8.5487","","90","","90","","90","","624.74","","","","848.15","","","","","","","","","3","F d -3 m","","","","","","- Cu O4 Rh2 -","","","","","","Ismunandar; Kennedy, B. J.; Hunter, B. A.","Phase transformation in CuRh2O4: a powder neutron diffraction study","Materials Research Bulletin","1999","34","","135","143","10.1016/S0025-5408(98)00201-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000312","6.1707","","6.1707","","7.9183","","90","","90","","90","","301.51","","","","298.15","","","","","","","","","3","I 41/a m d","","","","","","- Cu O4 Rh2 -","","","","","","Ismunandar; Kennedy, B. J.; Hunter, B. A.","Phase transformation in CuRh2O4: a powder neutron diffraction study","Materials Research Bulletin","1999","34","","135","143","10.1016/S0025-5408(98)00201-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000313","8.4359","","8.4359","","12.6136","","90","","90","","90","","897.64","","","","","","","","","","","","","3","I 4/m c m","","","","","","- Cd Cs3 H5 -","","","","","","Bortz, M.; Gutmann, M.; Yvon, K.","Synthesis and structure determination of the first ternary cadmium hydride, Cs~3~CdH~5~","Journal of Alloys and Compounds","1999","285","1-2","L19","L21","10.1016/S0925-8388(99)00031-6","","","","","","","","","","","","","","","","","","","","","","174711","2020-10-21","18:00:00",""
"6000314","8.4235","","8.4235","","12.592","","90","","90","","90","","893.47","","","","","","","","","","","","","3","I 4/m c m","","","","","","- Cd Cs3 D5 -","","","","","","Bortz, M.; Gutmann, M.; Yvon, K.","Synthesis and structure determination of the first ternary cadmium hydride, Cs~3~CdH~5~","Journal of Alloys and Compounds","1999","285","1-2","L19","L21","10.1016/S0925-8388(99)00031-6","","","","","","","","","","","","","","","","","","","","","","174711","2020-10-21","18:00:00",""
"6000315","19.39","","20.26","","10.076","","90","","105.27","","90","","3818.53","","","","","","","","","","","","","4","C 1 2/m 1","","","","","","- Ba6 Fe45 O106 Ti17 -","","","","","","Vanderah, T. A.; Wong-Ng, W.; Toby, B. H.; Browning, V. M.; Shull, R. D.; Geyer, R. G.; Roth, R. S.","Characterization of ternary compounds in the BaO : Fe2O3 : TiO2 system: Ba6Fe45Ti17O106 and BaFe11Ti3O23","Journal of Solid State Chemistry","1999","143","","182","197","10.1006/jssc.1999.8075","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000316","19.561","","8.6614","","10.12","","90","","105.62","","90","","1651.27","","","","","","","","","","","","","4","C 1 2/c 1","","","","","","- Ba6 Fe11 O23 Ti3 -","","","","","","Vanderah, T. A.; Wong-Ng, W.; Toby, B. H.; Browning, V. M.; Shull, R. D.; Geyer, R. G.; Roth, R. S.","Characterization of ternary compounds in the BaO : Fe2O3 : TiO2 system: Ba6Fe45Ti17O106 and BaFe11Ti3O23","Journal of Solid State Chemistry","1999","143","","182","197","10.1006/jssc.1999.8075","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000317","8.124","","11.378","","13.16","","90","","92.06","","90","","1215.66","","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- B4 Cs2 H10 O12 -","","","","","","Touboul, M.; Penin, N.; Nowogrocki, G.","Crystal structure and thermal behavior of Cs-2[B4O5(OH)(4)]3H(2)O","Journal of Solid State Chemistry","1999","143","","260","265","10.1006/jssc.1998.8104","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000318","3.7368","","3.7368","","27.086","","90","","90","","90","","378.23","","","","","","","","","","","","","4","I 4/m m m","","","","","","- Ca4 Fe Mn2 O9.75 -","","","","","","Battle, P. D.; Branford, W. R.; Mihut, A.; Rosseinsky, M. J.; Singleton, J.; Sloan, J.; Spring, L. E.; Vente, J. F.","Structural chemistry and electronic properties of the n=3 Ruddlesden-Popper phases Ca4Mn2FeO9.75 and Sr4Mn2FeO9.80","Chemistry of Materials","1999","11","","674","683","10.1021/cm9807384","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000319","3.8339","","3.8339","","27.8148","","90","","90","","90","","408.85","","","","","","","","","","","","","4","I 4/m m m","","","","","","- Fe Mn2 O9.8 Sr4 -","","","","","","Battle, P. D.; Branford, W. R.; Mihut, A.; Rosseinsky, M. J.; Singleton, J.; Sloan, J.; Spring, L. E.; Vente, J. F.","Structural chemistry and electronic properties of the n=3 Ruddlesden-Popper phases Ca4Mn2FeO9.75 and Sr4Mn2FeO9.80","Chemistry of Materials","1999","11","","674","683","10.1021/cm9807384","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000320","3.8128","0.0001","3.8128","0.0001","27.568","0.001","90","","90","","90","","402.6","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- Co La2 O10 Ti3 -","- Co La2 O10 Ti3 -","- Co2 La4 O20 Ti6 -","2","0.0625","","Hyeon, K. A.; Byeon, S. H.","Synthesis and structure of new layered oxides, (MLa2Ti3O10)-La-II (M = Co, Cu, and Zn)","Chemistry of Materials","1999","11","","352","357","10.1021/cm980581f","","","","","","","","","","","","","","","","","","","","","has coordinates","203340","2020-10-21","18:00:00",""
"6000321","3.8248","0.0002","3.8248","0.0002","26.329","0.001","90","","90","","90","","385.17","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- Cu La2 O10 Ti3 -","- Cu La2 O10 Ti3 -","- Cu2 La4 O20 Ti6 -","2","0.0625","","Hyeon, K. A.; Byeon, S. H.","Synthesis and structure of new layered oxides, (MLa2Ti3O10)-La-II (M = Co, Cu, and Zn)","Chemistry of Materials","1999","11","","352","357","10.1021/cm980581f","","","","","","","","","","","","","","","","","","","","","has coordinates","203340","2020-10-21","18:00:00",""
"6000322","3.8127","0.0001","3.8127","0.0001","27.5129","0.0009","90","","90","","90","","399.95","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- La2 O10 Ti3 Zn -","- La2 O10 Ti3 Zn -","- La4 O20 Ti6 Zn2 -","2","0.0625","","Hyeon, K. A.; Byeon, S. H.","Synthesis and structure of new layered oxides, (MLa2Ti3O10)-La-II (M = Co, Cu, and Zn)","Chemistry of Materials","1999","11","","352","357","10.1021/cm980581f","","","","","","","","","","","","","","","","","","","","","has coordinates","203340","2020-10-21","18:00:00",""
"6000323","18.167","","5.085","","8.658","","90","","93.63","","90","","798.21","","","","","","","","","","","","","5","P 1 21/n 1","","","","","","- C3 H8 O6 P2 Zn -","","","","","","Poojary, D. M.; Zhang, B. L.; Clearfield, A.","Syntheses and X-ray powder structures of two zinc propylenebis(phosphonates)","Chemistry of Materials","1999","11","2","421","426","10.1021/cm980641h","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000324","20.5853","","5.0472","","18.014","","90","","97.226","","90","","1856.76","","","","","","","","","","","","","5","C 1 2/c 1","","","","","","- C6 H18 O14 P4 Zn3 -","","","","","","Poojary, D. M.; Zhang, B. L.; Clearfield, A.","Syntheses and X-ray powder structures of two zinc propylenebis(phosphonates)","Chemistry of Materials","1999","11","2","421","426","10.1021/cm980641h","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000325","7.6889","","7.6889","","4.996","","90","","90","","90","","295.36","","","","","","","","","","","","","4","P -4 21 m","","","","","","- N4 O3 Si3 Sm2 -","","","","","","Lauterbach, R.; Schnick, W.","Sm2Si3O3N4 and Ln(2)Si(2.5)Al(0.5)O(3.5)N(3.5) (Ln = Ce, Pr, Nd, Sm, Gd) - a novel synthetic approach for the preparation of N-containing melilites and X-ray single-crystal structure determination","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","429","434","10.1002/(SICI)1521-3749(199903)625:3<429::AID-ZAAC429>3.0.CO;2-T","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000326","7.792","","7.792","","5.0694","","90","","90","","90","","307.79","","","","","","","","","","","","","5","P -4 21 m","","","","","","- Al0.5 Ce2 N3.5 O3.5 Si2.5 -","","","","","","Lauterbach, R.; Schnick, W.","Sm2Si3O3N4 and Ln(2)Si(2.5)Al(0.5)O(3.5)N(3.5) (Ln = Ce, Pr, Nd, Sm, Gd) - a novel synthetic approach for the preparation of N-containing melilites and X-ray single-crystal structure determination","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","429","434","10.1002/(SICI)1521-3749(199903)625:3<429::AID-ZAAC429>3.0.CO;2-T","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000327","7.7826","","7.7826","","5.0856","","90","","90","","90","","308.03","","","","","","","","","","","","","5","P -4 21 m","","","","","","- Al0.5 N3.5 O3.5 Pr2 Si2.5 -","","","","","","Lauterbach, R.; Schnick, W.","Sm2Si3O3N4 and Ln(2)Si(2.5)Al(0.5)O(3.5)N(3.5) (Ln = Ce, Pr, Nd, Sm, Gd) - a novel synthetic approach for the preparation of N-containing melilites and X-ray single-crystal structure determination","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","429","434","10.1002/(SICI)1521-3749(199903)625:3<429::AID-ZAAC429>3.0.CO;2-T","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000328","7.7615","","7.7615","","5.067","","90","","90","","90","","305.24","","","","","","","","","","","","","5","P -4 21 m","","","","","","- Al0.5 N3.5 Nd2 O3.5 Si2.5 -","","","","","","Lauterbach, R.; Schnick, W.","Sm2Si3O3N4 and Ln(2)Si(2.5)Al(0.5)O(3.5)N(3.5) (Ln = Ce, Pr, Nd, Sm, Gd) - a novel synthetic approach for the preparation of N-containing melilites and X-ray single-crystal structure determination","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","429","434","10.1002/(SICI)1521-3749(199903)625:3<429::AID-ZAAC429>3.0.CO;2-T","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000329","7.7263","","7.7263","","5.028","","90","","90","","90","","300.15","","","","","","","","","","","","","5","P -4 21 m","","","","","","- Al0.5 N3.5 O3.5 Si2.5 Sm2 -","","","","","","Lauterbach, R.; Schnick, W.","Sm2Si3O3N4 and Ln(2)Si(2.5)Al(0.5)O(3.5)N(3.5) (Ln = Ce, Pr, Nd, Sm, Gd) - a novel synthetic approach for the preparation of N-containing melilites and X-ray single-crystal structure determination","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","429","434","10.1002/(SICI)1521-3749(199903)625:3<429::AID-ZAAC429>3.0.CO;2-T","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000330","7.7415","","7.7415","","5.0646","","90","","90","","90","","303.53","","","","","","","","","","","","","5","P -4 21 m","","","","","","- Al0.5 Gd2 N3.5 O3.5 Si2.5 -","","","","","","Lauterbach, R.; Schnick, W.","Sm2Si3O3N4 and Ln(2)Si(2.5)Al(0.5)O(3.5)N(3.5) (Ln = Ce, Pr, Nd, Sm, Gd) - a novel synthetic approach for the preparation of N-containing melilites and X-ray single-crystal structure determination","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","429","434","10.1002/(SICI)1521-3749(199903)625:3<429::AID-ZAAC429>3.0.CO;2-T","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000331","7.383","","7.3226","","7.3444","","90","","120.233","","90","","343.05","","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- Ni0.5 O5 P Ti -","","","","","","Gravereau, P.; Chaminade, J. P.; Manoun, B.; Krimi, S.; El, Jazouli A","Ab initio determination and Rietveld refinement of the crystal structure of Ni0.50TiO(PO4)","Powder Diffraction","1999","14","","10","15","10.1017/S088571560001023X","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000332","10.032","","10.032","","10.032","","90","","90","","90","","1009.63","","","","","","","","","","","","","4","Fm3m","","","","","","- C12 Co2 Cu3 N12 -","","","","","","Malecki, G.; Ratuszna, A.","Crystal structure of cyanometallates Me-3[Co(CN)(6)](2) and KMe[Fe(CN)(6)] with Me = Mn2+, Ni2+ Cu2+","Powder Diffraction","1999","14","","25","30","10.1017/S0885715600010265","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000333","10.413","","10.413","","10.413","","90","","90","","90","","1129.09","","","","","","","","","","","","","4","Fm3m","","","","","","- C12 Co2 Mn3 N12 -","","","","","","Malecki, G.; Ratuszna, A.","Crystal structure of cyanometallates Me-3[Co(CN)(6)](2) and KMe[Fe(CN)(6)] with Me = Mn2+, Ni2+ Cu2+","Powder Diffraction","1999","14","","25","30","10.1017/S0885715600010265","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000334","10.234","","10.234","","10.234","","90","","90","","90","","1071.86","","","","","","","","","","","","","5","Fm3m","","","","","","- C6 Fe K N6 Ni -","","","","","","Malecki, G.; Ratuszna, A.","Crystal structure of cyanometallates Me-3[Co(CN)(6)](2) and KMe[Fe(CN)(6)] with Me = Mn2+, Ni2+ Cu2+","Powder Diffraction","1999","14","","25","30","10.1017/S0885715600010265","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000335","10.108","","10.104","","10.114","","90","","92.93","","90","","1031.6","","","","","","","","","","","","","7","P 1 21/c 1","","","","","","- C6 H4 Fe K Mn N6 O2 -","","","","","","Malecki, G.; Ratuszna, A.","Crystal structure of cyanometallates Me-3[Co(CN)(6)](2) and KMe[Fe(CN)(6)] with Me = Mn2+, Ni2+ Cu2+","Powder Diffraction","1999","14","","25","30","10.1017/S0885715600010265","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000336","6.676","","8.9546","","7.3494","","90","","114.098","","90","","401.06","","","","","","","","","","","","","4","C 1 2/c 1","","","","","","- Al Ca O5 Ta -","","","","","","Sales, M.; Eguia, G.; Quintana, P.; Torres-Martinez, L. M.; West, A. R.","The phase diagram CaO-Al2O3-Ta2O5 and the crystal structures of Ca2AlTaO6 and CaAlTaO5","Journal of Solid State Chemistry","1999","143","","62","68","10.1006/jssc.1998.8079","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000337","5.3915","","5.4321","","7.6508","","90","","90.076","","90","","224.07","","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- Al Ca2 O6 Ta -","","","","","","Sales, M.; Eguia, G.; Quintana, P.; Torres-Martinez, L. M.; West, A. R.","The phase diagram CaO-Al2O3-Ta2O5 and the crystal structures of Ca2AlTaO6 and CaAlTaO5","Journal of Solid State Chemistry","1999","143","","62","68","10.1006/jssc.1998.8079","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000338","6.0238","","14.1126","","13.4616","","90","","90","","90","","1144.39","","","","","","","","","","","","","3","C m c a","","","","","","- D10 Mg3 Rb4 -","","","","","","Gingl, F.; Vogt, T.; Akiba, E.; Yvon, K.","Structure refinement of Rb~4~Mg~3~D~10~ on neutron powder diffraction data","Journal of Alloys and Compounds","1999","284","1-2","L4","L6","10.1016/S0925-8388(98)00951-7","","","","","","","","","","","","","","","","","","","","","","174711","2020-10-21","18:00:00",""
"6000339","7.7208","","7.7208","","12.0417","","90","","90","","90","","717.81","","","","","","","","","","","","","3","P-4-h(10)g(2)dcba","","","","","","- O32 Pb7.5 W8 -","","","","","","Moreau, J. M.; Gladyshevskii, R. E.; Galez, P.; Peigneux, J. P.; Korzhik, M. V.","A new structural model for Pb-deficient PbWO4","Journal of Alloys and Compounds","1999","284","","104","107","10.1016/S0925-8388(98)00750-6","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000341","7.321","","7.321","","7.322","","90","","90","","120","","339.86","","","","","","","","","","","","","3","P -6 2 c","","","","","","- Ir Sn Zr -","","","","","","Zumdick, M. F.; Pottgen, R.","Determination of the superstructures for the stannides ZrIrSn, HfCoSn, and HfRhSn","Zeitschrift für Kristallographie","1999","214","2","90","97","10.1524/zkri.1999.214.2.90","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000342","7.131","","7.131","","7.054","","90","","90","","120","","310.65","","","","","","","","","","","","","3","P -6 2 c","","","","","","- Co Hf Sn -","","","","","","Zumdick, M. F.; Pottgen, R.","Determination of the superstructures for the stannides ZrIrSn, HfCoSn, and HfRhSn","Zeitschrift für Kristallographie","1999","214","2","90","97","10.1524/zkri.1999.214.2.90","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000343","7.32","","7.32","","7.148","","90","","90","","120","","331.69","","","","","","","","","","","","","3","P -6 2 c","","","","","","- Hf Rh Sn -","","","","","","Zumdick, M. F.; Pottgen, R.","Determination of the superstructures for the stannides ZrIrSn, HfCoSn, and HfRhSn","Zeitschrift für Kristallographie","1999","214","2","90","97","10.1524/zkri.1999.214.2.90","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000344","9.702","","18.623","","13.676","","90","","91.18","","90","","2470.46","","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- C56 H50 O9 S3 -","","","","","","Kaduk, J. A.; Cahill, P. J.; Venkateshwaran, L. N.","Crystal structures of a solvated and unsolvated sulfone cyclic oligomer","Journal of Applied Crystallography","1999","32","","15","20","10.1107/S0021889898006189","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000345","9.5703","","18.7582","","13.3945","","90","","92.684","","90","","2401.96","","","","","","","","","","","","","4","P 1 21/c 1","","","","","","- C54 H44 O8 S2 -","","","","","","Kaduk, J. A.; Cahill, P. J.; Venkateshwaran, L. N.","Crystal structures of a solvated and unsolvated sulfone cyclic oligomer","Journal of Applied Crystallography","1999","32","","15","20","10.1107/S0021889898006189","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000346","5.4897","","5.5195","","7.1758","","90","","90","","90","","217.43","","","","","","","","","","","","","4","I b a m","","","","","","- Ag2 Bi O6 Ti2 -","","","","","","Park, J. H.; Woodward, P. M.; Parise, J. B.; Reeder, R. J.; Lubomirsky, I.; Stafsudd, O.","Synthesis, structure, and dielectric properties of (Bi1/2Ag1/2)TiO3","Chemistry of Materials","1999","11","","177","183","10.1021/cm9806533","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000347","5.5166","","5.5166","","7.8134","","90","","90","","90","","237.79","","","","573","","","","","","","","","4","I 4/m c m","","","","","","- Ag2 Bi O6 Ti2 -","","","","","","Park, J. H.; Woodward, P. M.; Parise, J. B.; Reeder, R. J.; Lubomirsky, I.; Stafsudd, O.","Synthesis, structure, and dielectric properties of (Bi1/2Ag1/2)TiO3","Chemistry of Materials","1999","11","","177","183","10.1021/cm9806533","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000348","3.9061","","3.9061","","3.9061","","90","","90","","90","","59.6","","","","673","","","","","","","","","4","P m -3 m","","","","","","- Ag2 Bi O6 Ti2 -","","","","","","Park, J. H.; Woodward, P. M.; Parise, J. B.; Reeder, R. J.; Lubomirsky, I.; Stafsudd, O.","Synthesis, structure, and dielectric properties of (Bi1/2Ag1/2)TiO3","Chemistry of Materials","1999","11","","177","183","10.1021/cm9806533","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000349","12.1715","","22.3772","","7.6752","","90","","90","","90","","2090.46","","","","","","","","","","","","","4","P b n m","","","","","","- Ba5.1 O54 Sm8.6 Ti18 -","","","","","","Okudera, H.; Nakamura, H.; Toraya, H.; Ohsato, H.","Tungsten bronze-type solid solutions Ba6-3xSm8+2xTi18O54 (x = 0.3, 0.5, 0.67, 0.71) with superstructure","Journal of Solid State Chemistry","1999","142","","336","343","10.1006/jssc.1998.8042","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000350","12.1568","","22.3253","","7.663","","90","","90","","90","","2079.77","","","","","","","","","","","","","4","P b n m","","","","","","- Ba4.5 O54 Sm9 Ti18 -","","","","","","Okudera, H.; Nakamura, H.; Toraya, H.; Ohsato, H.","Tungsten bronze-type solid solutions Ba6-3xSm8+2xTi18O54 (x = 0.3, 0.5, 0.67, 0.71) with superstructure","Journal of Solid State Chemistry","1999","142","","336","343","10.1006/jssc.1998.8042","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000351","12.1472","","22.2972","","7.6534","","90","","90","","90","","2072.91","","","","","","","","","","","","","4","P b n m","","","","","","- Ba4 O54 Sm9.33 Ti18 -","","","","","","Okudera, H.; Nakamura, H.; Toraya, H.; Ohsato, H.","Tungsten bronze-type solid solutions Ba6-3xSm8+2xTi18O54 (x = 0.3, 0.5, 0.67, 0.71) with superstructure","Journal of Solid State Chemistry","1999","142","","336","343","10.1006/jssc.1998.8042","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000352","12.1452","","22.3029","","7.6501","","90","","90","","90","","2072.2","","","","","","","","","","","","","4","P b n m","","","","","","- Ba3.87 O54 Sm9.42 Ti18 -","","","","","","Okudera, H.; Nakamura, H.; Toraya, H.; Ohsato, H.","Tungsten bronze-type solid solutions Ba6-3xSm8+2xTi18O54 (x = 0.3, 0.5, 0.67, 0.71) with superstructure","Journal of Solid State Chemistry","1999","142","","336","343","10.1006/jssc.1998.8042","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000353","35.288","","5.418","","9.522","","90","","98.95","","90","","1798.35","","","","","","","","","","","","","5","C 1 2/m 1","","","","","","- Ce1.62 Cl3.5 La1.62 Nb O6 -","","","","","","Weitzel, H.; Behler, B.; Gruehn, R.","Contributions on the investigation of inorganic nonstoichiometric compounds. XLV. New thermal decomposition products of Ln(2)CeMO(6)Cl(3) - Preparation of structure-related (La,Tb)(3,5)TaO6Cl4-x","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","221","232","10.1002/(SICI)1521-3749(199902)625:2<221::AID-ZAAC221>3.0.CO;2-Y","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000354","18.563","","5.454","","9.527","","90","","102.44","","90","","941.89","","","","","","","","","","","","","5","C 1 2/m 1","","","","","","- Ce1.75 Cl4 Nb O6 Pr1.75 -","","","","","","Weitzel, H.; Behler, B.; Gruehn, R.","Contributions on the investigation of inorganic nonstoichiometric compounds. XLV. New thermal decomposition products of Ln(2)CeMO(6)Cl(3) - Preparation of structure-related (La,Tb)(3,5)TaO6Cl4-x","Zeitschrift Fur Anorganische Und Allgemeine Chemie","1999","625","","221","232","10.1002/(SICI)1521-3749(199902)625:2<221::AID-ZAAC221>3.0.CO;2-Y","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000355","7.508","","8.881","","8.961","","90","","107.22","","90","","570.72","","","","","","","","","","","","","7","P 1 21/c 1","","","","","","- C2 H10 F4 N2 O8 P2 Ti2 -","","","","","","Serre, C.; Ferey, G.","Hydrothermal synthesis and ab initio structural approach of two new layered oxyfluorinated titanium(IV) phosphates: Ti2(PO4)(2)F4.N2C2H10(MIL-6) and Ti2(PO4)(2)F4.N2C3H12.H2O","Journal of Materials Chemistry","1999","9","","579","584","10.1039/a802710b","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000356","16.82","","6.333","","6.331","","90","","106.2","","90","","647.61","","","","","","","","","","","","","7","C 1 2 1","","","","","","- C3 H14 F4 N2 O9 P2 Ti2 -","","","","","","Serre, C.; Ferey, G.","Hydrothermal synthesis and ab initio structural approach of two new layered oxyfluorinated titanium(IV) phosphates: Ti2(PO4)(2)F4.N2C2H10(MIL-6) and Ti2(PO4)(2)F4.N2C3H12.H2O","Journal of Materials Chemistry","1999","9","","579","584","10.1039/a802710b","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000357","14.9085","","14.9085","","6.9196","","90","","90","","120","","1331.93","","","","","","","","","","","","","3","P 6/m m m","","","","","","- B Ni4.12 Y0.92 -","","","","","","Belger, A.; Zahn, G.; Wehner, B.; Paufler, P.; Graw, G.; Behr, G.","The defect structure of Y0.915Ni4.12B related to the superstructure of YNi4B","Journal of Alloys and Compounds","1999","283","","26","33","10.1016/S0925-8388(98)00862-7","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000358","3.954","","3.954","","4.125","","90","","90","","120","","55.85","","","","","","","","","","","","","2","P 6/m m m","","","","","","- Ge5 U3 -","","","","","","Boulet, P.; Potel, M.; André, G.; Rogl, P.; Noël, H.","Crystal and magnetic structure of the binary uranium germanide U~3~Ge~5~","Journal of Alloys and Compounds","1999","283","1-2","41","44","10.1016/S0925-8388(98)00873-1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000359","17.0051","","17.0051","","6.8607","","90","","90","","90","","1983.93","","","","","","","","","","","","","3","R -3 m","","","","","","- La7 Mo7 O30 -","","","","","","Goutenoire, F.; Retoux, R.; Suard, E.; Lacorre, P.","Ab initio determination of the novel perovskite-related structure of La7Mo7O30 from powder diffraction","Journal of Solid State Chemistry","1999","142","","228","235","10.1006/jssc.1998.8070","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000360","4.757","","4.757","","5.246","","90","","90","","120","","102.81","","","","","","","","","","","","","3","P 32 2 1","","","","","","- N O P -","","","","","","Leger, J. M.; Haines, J.; de Oliveira, L. S.; Chateau, C.; Le, Sauze A; Marchand, R.; Hull, S.","Crystal structure and high pressure behaviour of the quartz-type phase of phosphorus oxynitride pon","Journal of Physics and Chemistry of Solids","1999","60","","145","152","10.1016/S0022-3697(98)00282-0","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000369","11.844","","19.394","","3.4648","","90","","90","","90","","795.87","","","","","","","","","","","","","4","P n n m","","","","","","- Mo0.11 Se8 Si2 Ta10.89 -","","","","","","Mrotzek, A.; Harbrecht, B.","Ta11Si2Se8-condensed tetrakaidecahedral Ta9Si clusters arranged to an open network structure","European Journal of Inorganic Chemistry","1999","","","87","93","","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000549","10.4097","","11.4187","","6.4964","","90","","90.992","","90","","772.08","","","","","","","","","","","","","3","P 1 21/n 1","","","","","","- C9 H14 O -","","","","","","Mora, A. J.; Fitch, A. N.","The low-temperature structures of bicyclo[3.3.1]nonan-9-one and 3-azabicyclo[3.2.2]nonane","Zeitschrift für Kristallographie","1999","214","8","480","485","10.1524/zkri.1999.214.8.480","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000550","21.1318","","11.2357","","6.0863","","90","","90","","90","","1445.07","","","","","","","","","","","","","3","A b a 2","","","","","","- C8 H15 N -","","","","","","Mora, A. J.; Fitch, A. N.","The low-temperature structures of bicyclo[3.3.1]nonan-9-one and 3-azabicyclo[3.2.2]nonane","Zeitschrift für Kristallographie","1999","214","8","480","485","10.1524/zkri.1999.214.8.480","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000680","10.3749","","6.6077","","9.9094","","90.762","","115.265","","90.162","","614.27","","","","","","","","","","","","","6","P -1","","","","","","- C2 H16 Al2 N2 O12 P2 -","","","","","","Kongshaug, K. O.; Fjellvag, H.; Lillerud, K. P.","Layered aluminophosphates II. Crystal structure and thermal behaviour of the layered aluminophosphate UiO-15 and its high temperature variants","Journal of Materials Chemistry","1999","9","","1591","1598","10.1039/a901407a","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000681","10.289","","6.7508","","9.6253","","90","","116.124","","90","","600.26","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C2 H12 Al2 N2 O10 P2 -","","","","","","Kongshaug, K. O.; Fjellvag, H.; Lillerud, K. P.","Layered aluminophosphates II. Crystal structure and thermal behaviour of the layered aluminophosphate UiO-15 and its high temperature variants","Journal of Materials Chemistry","1999","9","","1591","1598","10.1039/a901407a","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000682","9.4218","","6.9137","","9.4082","","90","","113.002","","90","","564.12","","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C2 H10 Al2 N2 O9 P2 -","","","","","","Kongshaug, K. O.; Fjellvag, H.; Lillerud, K. P.","Layered aluminophosphates II. Crystal structure and thermal behaviour of the layered aluminophosphate UiO-15 and its high temperature variants","Journal of Materials Chemistry","1999","9","","1591","1598","10.1039/a901407a","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000711","9.3892","","9.3892","","6.9019","","90","","90","","120","","526.93","","","","","","","","","","","","","4","P 63/m","","","","","","- Ca10 H2 O25 P6 -","","","","","","El, Feki H; Savariault, J. M.; Ben, Salah A","Structure refinements by the Rietveld method of partially substituted hydroxyapatite: Ca9Na0.5(PO4)(4.5)(CO3)(1.5)(OH)(2)","Journal of Alloys and Compounds","1999","287","","114","120","10.1016/S0925-8388(99)00070-5","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000733","15.801","0.001","5.5878","0.0004","9.3743","0.0007","90","","116.321","0.006","90","","741.9","0.07","","","","","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C2 H10 Mo5 N2 O16 -","- C2 Mo5 N2 O16 -","- C4 Mo10 N4 O32 -","2","0.5","","Guillou, N.; Ferey, G.","Hydrothermal synthesis and structural characterization of two layered diamine pentamolybdates: (C2H10N2) [Mo5O16] and (C4H12N2) [Mo5O16]","Journal of Solid State Chemistry","1999","147","","240","246","10.1006/jssc.1999.8244","powder diffraction","","1.5418","","","","","","","","","","","","","","","","","","has coordinates","277869","2022-09-15","09:06:00",""
"6000734","23.3997","0.0003","5.6222","0.0001","14.4131","0.0002","90","","115.96","0.001","90","","1704.83","0.04","","","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C4 H12 Mo5 N2 O16 -","- C4 H12 Mo5 N2 O16 -","- C16 H48 Mo20 N8 O64 -","4","0.5","","Guillou, N.; Ferey, G.","Hydrothermal synthesis and structural characterization of two layered diamine pentamolybdates: (C2H10N2) [Mo5O16] and (C4H12N2) [Mo5O16]","Journal of Solid State Chemistry","1999","147","","240","246","10.1006/jssc.1999.8244","","","0.71073","","","0.0256","0.0208","","0.0514","0.0495","","","","","","","","","","","has coordinates","277869","2022-09-15","09:06:00",""
"6000735","17.4705","","6.7541","","8.0252","","90","","102.019","","90","","926.2","","","","","","","","","","","","","4","C 1 2/c 1","","","","","","- K O12 P3 U2 -","","","","","","Hawkins, H. T.; Spearing, D. R.; Veirs, D. K.; Danis, J. A.; Smith, D. M.; Tait, C. D.; Runde, W. H.; Spilde, M. N.; Scheetz, B. E.","Synthesis and characterization of uranium(IV)-bearing members of the [NZP] structural family","Chemistry of Materials","1999","11","","2851","2857","10.1021/cm990209f","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000771","14.471","","9.6","","11.948","","90","","93.21","","90","","1657.23","","","","","","","","","","","","","5","P 1 21/n 1","","","","","","- C18 H24 Cl N O2 -","","","","","","Henao, J. A.; Palma, A.; Kouznetsov, V. V.; Delgado, J. M.","X-ray powder diffraction data for two new N-substituted 3,4-dihydrospiro-2(1 H) quinolines","Powder Diffraction","1999","14","","249","252","10.1017/S0885715600010617","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000772","14.487","","9.878","","11.39","","90","","91.66","","90","","1629.25","","","","","","","","","","","","","5","P 1 21/n 1","","","","","","- C17 H21 Cl2 N O -","","","","","","Henao, J. A.; Palma, A.; Kouznetsov, V. V.; Delgado, J. M.","X-ray powder diffraction data for two new N-substituted 3,4-dihydrospiro-2(1 H) quinolines","Powder Diffraction","1999","14","","249","252","10.1017/S0885715600010617","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000773","17.356","0.006","3.528","0.001","11.285","0.001","90","","93.23","0.02","90","","1912.6","","","","","","","","","","","","","4","","","","","","","- C5 H7 N5 O3 -","","","4","","","Tettenhorst, R. T.; Gerkin, R. E.","X-ray powder diffraction data for ammonium hydrogen (acid) urate, NH4C5H3N4O3","Powder Diffraction","1999","14","","305","307","10.1017/S0885715600010745","","","","","","","","","","","","","","","","","","","","","","203577","2020-10-21","18:00:00",""
"6000774","6.251","","6.258","","8.065","","112.85","","112.86","","89.93","","263.71","","","","","","","","","","","","","6","P 1","","","","","","- H8 Mg0.72 O14 P2 V2 Zn0.28 -","","","","","","Le, Fur E; Pivan, J. Y.","Synthesis and crystal structure of the new zinc-magnesium vanadium(IV) phosphate hydrate Mg((1-x))Znx(VOPO4)(2) .4H(2)O (x similar to 0.28)","Materials Research Bulletin","1999","34","","1117","1127","10.1016/S0025-5408(99)00096-3","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000775","7.4519","0.0004","22.647","0.001","10.4103","0.0005","90","","92.052","0.001","90","","1755.75","0.15","","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C H13 Co N5 O6.5 -","- C Co N5 O6.5 -","- C8 Co8 N40 O52 -","8","2","","Christensen, A. Norlund; Hazell, R. G.","X-ray crystallographic study and thermogravimetric analysis of tetrammine-carbonatocobalt(III) nitrate hemihydrate, [Co(NH3)(4)CO3]NO3 .0.5H(2)O","Acta Chemica Scandinavica","1999","53","","399","402","10.3891/acta.chem.scand.53-0399","","x-ray","0.71069","MoKα","","","0.075","","","","","","","","","","","","","","has coordinates","190905","2020-10-21","18:00:00",""
"6000776","10.1724","","10.1724","","9.606","","90","","90","","90","","994.01","","","","","","","","","","","","","7","I -4 2 m","","","","","","- C H6 Al0.16 Co0.84 N O4.5 P -","","","","","","Christensen, A. N.; Hazell, R. G.","Use of hydrofluoric acid as mineralizer in hydrothermal and organothermal synthesis of Me2±substituted aluminophosphates. I.","Acta Chemica Scandinavica","1999","53","","403","409","10.3891/acta.chem.scand.53-0403","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000777","4.084","","4.084","","4.0674","","90","","90","","90","","67.84","","","","","","","","","","","","","4","P 4 m m","","","","","","- O3 Pb Ti0.03 Zr0.97 -","","","","","","Liu, H. C.; Toraya, H.","Study on a new tetragonal phase of Nb-doped lead titanate zirconate by synchrotron X-ray powder diffraction","Journal of Physics and Chemistry of Solids","1999","60","","729","735","10.1016/S0022-3697(98)00346-1","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"7026986","17.379","0.003","20.59","0.004","14.925","0.003","90","","108.52","0.03","90","","5064.1","1.9","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C20 H53 Ag Cl2 N12 Na O26.5 Pt2 -","- C20 H32 Ag Cl2 N12 Na O26.5 Pt2 -","- C80 H128 Ag4 Cl8 N48 Na4 O106 Pt8 -","4","0.5","","Zamora, Felix; Witkowski, Holger; Freisinger, Eva; Müller, Jens; Thormann, Birgit; Albinati, Alberto; Lippert, Bernhard","Crystal structures of a protonated form of trans-[Pt(NH3)2(mura)2] and of a derivative containing three different metal ions, Pt2+, Ag+, and Na+ (mura = 1-methyluracilate). Major difference in packing between heteronuclear pyrimidine nucleobase complexes of cis- and trans-(NH3)2PtII","Journal of the Chemical Society, Dalton Transactions","1999","","2","175","","10.1039/a804813d","","","0.71069","MoKα","","0.1112","0.044","","0.1404","0.0922","","","","0.868","1.092","1.092","","","","","has coordinates,has disorder","287753","2023-11-23","09:34:44",""
"7027006","12.827","0.001","19.622","0.001","23.149","0.006","90","","98.74","0.02","90","","5758.7","1.6","293","2","293","2","","","","","","","G.Besenyei (KKKI)","8","P 1 21/n 1","-P 2yn","14","","","","- C57 H49 Cl5 N2 O4 P4 Pd2 S -","- C57 H49 Cl5 N2 O4 P4 Pd2 S -","- C228 H196 Cl20 N8 O16 P16 Pd8 S4 -","4","1","","Foch, Isabella; Párkányi, László; Besenyei, Gábor; Simándi, László I.; Kálmán, Alajos","Arylsulfonylnitrene and arenesulfonyl azide complexes of palladium","Journal of the Chemical Society, Dalton Transactions","1999","","3","293","","10.1039/a805467c","","","0.71073","MOka","","0.1618","0.0471","","","0.1046","0.1201","","","","","","0.909","","","","has coordinates","179976","2020-10-21","18:00:00",""
"7027007","21.714","0.004","14.489","0.003","38.342","0.007","90","","90.39","0.01","90","","12063","4","293","2","293","2","","","","","","","G.Besenyei KKKI","8","P 1 21/n 1","-P 2yn","14","","","","- C60.5 H51.5 Cl3.5 N O3.67 P4 Pd2 S -","- C60.5 H51.5 Cl3.501 N O3.6695 P4 Pd2 S -","- C484 H412 Cl28.008 N8 O29.356 P32 Pd16 S8 -","8","2","","Foch, Isabella; Párkányi, László; Besenyei, Gábor; Simándi, László I.; Kálmán, Alajos","Arylsulfonylnitrene and arenesulfonyl azide complexes of palladium","Journal of the Chemical Society, Dalton Transactions","1999","","3","293","","10.1039/a805467c","","","0.71073","MOkα","","0.1604","0.0469","","","0.0915","0.1092","","","","","","0.813","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027008","12.414","0.002","22.267","0.002","44.002","0.005","90","","90","","90","","12163","3","293","2","293","2","","","","","","","G. Besenyei KKKI","9","P b c a","-P 2ac 2ab","61","","","","- C63 H59 Cl2 Fe N O3 P4 Pd2 S -","- C63 H59 Cl2 Fe N O3 P4 Pd2 S -","- C504 H472 Cl16 Fe8 N8 O24 P32 Pd16 S8 -","8","1","","Foch, Isabella; Párkányi, László; Besenyei, Gábor; Simándi, László I.; Kálmán, Alajos","Arylsulfonylnitrene and arenesulfonyl azide complexes of palladium","Journal of the Chemical Society, Dalton Transactions","1999","","3","293","","10.1039/a805467c","","","0.71073","MOkα","","0.1215","0.0401","","","0.0859","0.0984","","","","","","0.843","","","","has coordinates","179976","2020-10-21","18:00:00",""
"7027015","12.053","0.002","19.874","0.004","9.312","0.002","90","","99.97","0.02","90","","2196.9","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 Mn N2 O9 -","- C20 H25 Mn N2 O9 -","- C80 H100 Mn4 N8 O36 -","4","1","","Watkinson, Michael; Fondo, Matilde; Bermejo, Manuel R.; Sousa, Antonio; McAuliffe, Charles A.; Pritchard, Robin G.; Jaiboon, Nongnuj; Aurangzeb, Nadeem; Naeem, Mohammed","Further attempts to rationalise the co-ordination chemistry of manganese with Schiff base ligands and supplementary carboxylate donors","Journal of the Chemical Society, Dalton Transactions","1999","","1","31","","10.1039/a805555f","","","0.71069","MoKα","","0.0433","0.0433","","0.1186","0.1186","","","","1.093","1.093","1.093","","","","","has coordinates","179976","2020-10-21","18:00:00",""
"7027016","13.034","0.003","12.111","0.004","18.446","0.005","90","","102.76","0.01","90","","2839.9","1.4","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H31 Cl2 Mn N2 O6 -","- C25 H31 Cl2 Mn N2 O6 -","- C100 H124 Cl8 Mn4 N8 O24 -","4","1","","Watkinson, Michael; Fondo, Matilde; Bermejo, Manuel R.; Sousa, Antonio; McAuliffe, Charles A.; Pritchard, Robin G.; Jaiboon, Nongnuj; Aurangzeb, Nadeem; Naeem, Mohammed","Further attempts to rationalise the co-ordination chemistry of manganese with Schiff base ligands and supplementary carboxylate donors","Journal of the Chemical Society, Dalton Transactions","1999","","1","31","","10.1039/a805555f","","","0.71073","MoKα","","0.0936","0.0748","","0.2287","0.2098","","","","1.065","1.109","1.109","","","","","has coordinates","301848","2025-08-21","12:23:47",""
"7027017","9.692","0.002","12.088","0.002","20.027","0.004","90","","99.55","0.03","90","","2313.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H27 Mn N2 O6 -","- C23 H27 Mn N2 O6 -","- C92 H108 Mn4 N8 O24 -","4","1","","Watkinson, Michael; Fondo, Matilde; Bermejo, Manuel R.; Sousa, Antonio; McAuliffe, Charles A.; Pritchard, Robin G.; Jaiboon, Nongnuj; Aurangzeb, Nadeem; Naeem, Mohammed","Further attempts to rationalise the co-ordination chemistry of manganese with Schiff base ligands and supplementary carboxylate donors","Journal of the Chemical Society, Dalton Transactions","1999","","1","31","","10.1039/a805555f","","","0.71073","MoKα","","0.1063","0.1051","","","0.2923","0.2957","","","","","","1.451","","","","has coordinates","301848","2025-08-21","12:23:47",""
"7027018","9.927","0.002","13.495","0.003","18.761","0.004","90","","95.88","0.03","90","","2500.1","0.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H27 Mn N2 O8 -","- C26 H27 Mn N2 O8 -","- C104 H108 Mn4 N8 O32 -","4","1","","Watkinson, Michael; Fondo, Matilde; Bermejo, Manuel R.; Sousa, Antonio; McAuliffe, Charles A.; Pritchard, Robin G.; Jaiboon, Nongnuj; Aurangzeb, Nadeem; Naeem, Mohammed","Further attempts to rationalise the co-ordination chemistry of manganese with Schiff base ligands and supplementary carboxylate donors","Journal of the Chemical Society, Dalton Transactions","1999","","1","31","","10.1039/a805555f","","","0.71073","MoKα","","0.0541","0.0541","","","0.1385","0.1385","","","","","","1.062","","","","has coordinates","179976","2020-10-21","18:00:00",""
"7027019","10.44","0.006","13.647","0.005","19.3","0.011","90","","99.33","0.06","90","","2713","2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H32 Mn N2 O8 -","- C28 H32 Mn N2 O8 -","- C112 H128 Mn4 N8 O32 -","4","1","","Watkinson, Michael; Fondo, Matilde; Bermejo, Manuel R.; Sousa, Antonio; McAuliffe, Charles A.; Pritchard, Robin G.; Jaiboon, Nongnuj; Aurangzeb, Nadeem; Naeem, Mohammed","Further attempts to rationalise the co-ordination chemistry of manganese with Schiff base ligands and supplementary carboxylate donors","Journal of the Chemical Society, Dalton Transactions","1999","","1","31","","10.1039/a805555f","","","0.71073","MoKα","","0.1491","0.0961","","0.3005","0.2527","","","","1.06","1.175","1.175","","","","","has coordinates","179976","2020-10-21","18:00:00",""
"7027020","10.849","0.003","12.409","0.003","13.61","0.003","90","","95.54","0.03","90","","1823.7","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 Cl Mn N3 O2 -","- C19 H19 Cl Mn N3 O2 -","- C76 H76 Cl4 Mn4 N12 O8 -","4","1","","Watkinson, Michael; Fondo, Matilde; Bermejo, Manuel R.; Sousa, Antonio; McAuliffe, Charles A.; Pritchard, Robin G.; Jaiboon, Nongnuj; Aurangzeb, Nadeem; Naeem, Mohammed","Further attempts to rationalise the co-ordination chemistry of manganese with Schiff base ligands and supplementary carboxylate donors","Journal of the Chemical Society, Dalton Transactions","1999","","1","31","","10.1039/a805555f","","","0.71069","MoKα","","0.1405","0.0444","","","0.1057","0.1527","","","","","","1.102","","","","has coordinates","179976","2020-10-21","18:00:00",""
"7027021","17.844","0.003","18.881","0.004","12.337","0.004","90","","90","","90","","4156.5","1.8","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H23 Mn N2 O4 -","- C21 H23 Mn N2 O4 -","- C168 H184 Mn8 N16 O32 -","8","1","","Watkinson, Michael; Fondo, Matilde; Bermejo, Manuel R.; Sousa, Antonio; McAuliffe, Charles A.; Pritchard, Robin G.; Jaiboon, Nongnuj; Aurangzeb, Nadeem; Naeem, Mohammed","Further attempts to rationalise the co-ordination chemistry of manganese with Schiff base ligands and supplementary carboxylate donors","Journal of the Chemical Society, Dalton Transactions","1999","","1","31","","10.1039/a805555f","","","0.71069","MoKα","","0.1366","0.048","","","0.1226","0.1671","","","","","","0.977","","","","has coordinates","301848","2025-08-21","12:23:47",""
"7027022","14.014","0.002","12.086","0.002","13.37","0.002","90","","115.71","0.02","90","","2040.3","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 Mn N4 O9 -","- C18 H17 Mn N4 O9 -","- C72 H68 Mn4 N16 O36 -","4","1","","Watkinson, Michael; Fondo, Matilde; Bermejo, Manuel R.; Sousa, Antonio; McAuliffe, Charles A.; Pritchard, Robin G.; Jaiboon, Nongnuj; Aurangzeb, Nadeem; Naeem, Mohammed","Further attempts to rationalise the co-ordination chemistry of manganese with Schiff base ligands and supplementary carboxylate donors","Journal of the Chemical Society, Dalton Transactions","1999","","1","31","","10.1039/a805555f","","","0.71069","MoKα","","0.1612","0.0461","","","0.1096","0.1511","","","","","","0.993","","","","has coordinates","301848","2025-08-21","12:23:47",""
"7027023","12.592","0.002","12.103","0.003","20.266","0.002","90","","92.11","0.02","90","","3086.5","1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C49 H59 Br4 Mn2 N13 O19 -","- C49 H59 Br4 Mn2 N13 O19 -","- C98 H118 Br8 Mn4 N26 O38 -","2","0.5","","Watkinson, Michael; Fondo, Matilde; Bermejo, Manuel R.; Sousa, Antonio; McAuliffe, Charles A.; Pritchard, Robin G.; Jaiboon, Nongnuj; Aurangzeb, Nadeem; Naeem, Mohammed","Further attempts to rationalise the co-ordination chemistry of manganese with Schiff base ligands and supplementary carboxylate donors","Journal of the Chemical Society, Dalton Transactions","1999","","1","31","","10.1039/a805555f","","","0.71069","MoKα","","0.4375","0.043","","","0.0817","0.1149","","","","","","0.744","","","","has coordinates","179976","2020-10-21","18:00:00",""
"7027036","7.974","0.0006","23.452","0.002","12.267","0.001","90","","90.911","0.005","90","","2293.7","0.3","273.2","","273.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H34 N4 Ni O3 -","- C24 H34 N4 Ni O3 -","- C96 H136 N16 Ni4 O12 -","4","1","","Croucher, Paul D.; Nichols, Peter J.; Raston, Colin L.","Confinement of C60 in an extended saddle shaped nickel(II) macrocycle","Journal of the Chemical Society, Dalton Transactions","1999","","3","279","","10.1039/a805893h","","","0.7107","MoKα","","0.0673","0.0673","","0.081","","0.081","","","0.547","","","0.547","","","","has coordinates","301848","2025-08-21","12:23:47",""
"7027037","20.285","0.001","11.546","0.001","19.059","0.001","90","0.001","94.853","0.001","90","0.001","4447.8","0.5","298","","","","","","","","","","Local laboratory","4","C 1 2/c 1","-C 2yc","15","","","","- C26 H30 N4 Ni -","- C26 H30 N4 Ni -","- C208 H240 N32 Ni8 -","8","1","","Croucher, Paul D.; Nichols, Peter J.; Raston, Colin L.","Confinement of C60 in an extended saddle shaped nickel(II) macrocycle","Journal of the Chemical Society, Dalton Transactions","1999","","3","279","","10.1039/a805893h","","","0.71073","xray","","","0.042","","","0.046","","","","","2.922","2.922","","","","","has coordinates","301848","2025-08-21","12:23:47",""
"7027038","21.851","0.0005","13.2492","0.0004","19.6201","0.0005","90","","105.711","0.001","90","","5468","0.3","546.4","","546.4","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C88 H30 N4 Ni S4 -","- C88 H30 N4 Ni S4 -","- C352 H120 N16 Ni4 S16 -","4","0.5","","Croucher, Paul D.; Nichols, Peter J.; Raston, Colin L.","Confinement of C60 in an extended saddle shaped nickel(II) macrocycle","Journal of the Chemical Society, Dalton Transactions","1999","","3","279","","10.1039/a805893h","","","0.7107","MoKα","","0.0882","0.0882","","0.0893","","0.0893","","","8.748","","","8.748","","","","has coordinates","212870","2020-10-21","18:00:00",""
"7027046","14.283","0.002","16.671","0.002","17.596","0.002","90","","91.02","0.01","90","","4189.2","0.9","295","2","295","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[Ru(bpy)2OCP](ClO4)2.2H2O where bpy= 2,2'-bipyridine; OCP=2-(2-chlorophenyl)imidazo[4,5-f]1,10-phenanthroline","","- C39 H31 Cl3 N8 O10 Ru -","- C39 H31 Cl3 N8 O10 Ru -","- C156 H124 Cl12 N32 O40 Ru4 -","4","1","","Xiong, Ya; He, Xiao-Feng; Zou, Xiao-Hua; Wu, Jian-Zhong; Chen, Xiao-Ming; Ji, Liang-Nian; Li, Run-Hua; Zhou, Jian-Ying; Yu, Kai-Bei","Interaction of polypyridyl ruthenium(II) complexes containing non-planar ligands with DNA","Journal of the Chemical Society, Dalton Transactions","1999","","1","19","","10.1039/a806170j","","","0.71073","MoKα","","0.0818","0.0506","","","0.1286","0.14","","","","","","0.965","","","","has coordinates,has disorder","179976","2020-10-21","18:00:00",""
"7027047","17.5006","0.0003","21.0205","0.0004","16.4021","0.0003","90","","115.341","0.001","90","","5453.26","0.18","161","2","161","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H66 F9 N11 Ni2 O13 S3 -","- C41 H66 F9 N11 Ni2 O13 S3 -","- C164 H264 F36 N44 Ni8 O52 S12 -","4","1","","Escuer, Albert; Harding, Charles J.; Dussart, Yann; Nelson, Jane; McKee, Vickie; Vicente, Ramon","Constrained ferromagnetic coupling in dinuclear μ1,3-azido nickel(II) cryptate compounds. Crystal structure and magnetic behaviour of [Ni2(L1)(N3)(H2O)][CF3SO3]3·2H2O·EtOH {L1 = N[(CH2)2NHCH2(C6H4-m)CH2NH(CH2)2]3N} †","Journal of the Chemical Society, Dalton Transactions","1999","","2","223","","10.1039/a806174b","","","0.71073","MoKα","","0.108","0.0753","","","0.155","0.1774","","","","","","1.157","","","","has coordinates,has disorder","301848","2025-08-21","12:23:47",""
"7027049","9.683","0.003","24.944","0.006","15.149","0.002","90","","97.39","0.03","90","","3628.6","1.5","286.2","","286.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C38 H51 B N5 O3 Tc -","- C38 H51 B N5 O3 Tc -","- C152 H204 B4 N20 O12 Tc4 -","4","1","","Kani, Yuko; TakayamaTsutomuSekine, Tsutomu; Kudo, Hiroshi","Crystal structures of nitridotechnetium(V) complexes of amine oximes differing in carbon chain lengths","Journal of the Chemical Society, Dalton Transactions","1999","","2","209","","10.1039/a806245e","","","1.5418","CuKα","","","0.0461","","","0.0416","","","","","2.168","2.168","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027050","9.986","0.005","30.636","0.002","13.967","0.003","90","","95.24","0.03","90","","4255","2","286.2","","286.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H59 B N5 O4 Tc -","- C42 H59 B N5 O4 Tc -","- C168 H236 B4 N20 O16 Tc4 -","4","1","","Kani, Yuko; TakayamaTsutomuSekine, Tsutomu; Kudo, Hiroshi","Crystal structures of nitridotechnetium(V) complexes of amine oximes differing in carbon chain lengths","Journal of the Chemical Society, Dalton Transactions","1999","","2","209","","10.1039/a806245e","","","0.7107","MoKα","","","0.0337","","","0.036","","","","","1.3","1.3","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027052","11.505","0.006","13.545","0.005","18.72","0.011","90","","97.66","0.04","90","","2891","3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H25 Cl3 N2 P Re -","- C30 H25 Cl3 N2 P Re -","- C120 H100 Cl12 N8 P4 Re4 -","4","1","","Bhattacharyya, Sibaprasad; Banerjee, Sangeeta; Kumar Dirghangi, Bimal; Menon, Mahua; Chakravorty, Animesh","Synthesis, structure and redox behaviour of facial [ReIIIL(PPh3)Cl3] and its stereoretentive conversion to [ReIVL′(PPh3)Cl3] via metal promoted aldimine → amide oxidation (L = pyridine-2-aldimine; L′ = pyridine-2-carboxamide)","Journal of the Chemical Society, Dalton Transactions","1999","","2","155","","10.1039/a806346j","","","0.71073","MoKα","","0.0485","0.0316","","0.0851","0.068","","","","1.04","1.072","1.072","","","","","has coordinates","179976","2020-10-21","18:00:00",""
"7027053","9.994","0.006","11.617","0.006","15.135","0.009","76.26","0.04","88.11","0.05","67.4","0.04","1572.5","1.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H25 Cl4 N2 O2 P Re -","- C30 H25 Cl4 N2 O2 P Re -","- C60 H50 Cl8 N4 O4 P2 Re2 -","2","1","","Bhattacharyya, Sibaprasad; Banerjee, Sangeeta; Kumar Dirghangi, Bimal; Menon, Mahua; Chakravorty, Animesh","Synthesis, structure and redox behaviour of facial [ReIIIL(PPh3)Cl3] and its stereoretentive conversion to [ReIVL′(PPh3)Cl3] via metal promoted aldimine → amide oxidation (L = pyridine-2-aldimine; L′ = pyridine-2-carboxamide)","Journal of the Chemical Society, Dalton Transactions","1999","","2","155","","10.1039/a806346j","","","0.71073","MoKα","","0.062","0.0506","","0.1554","0.1319","","","","1.153","1.177","1.177","","","","","has coordinates","179976","2020-10-21","18:00:00",""
"7027077","7.486","0.002","26.719","0.007","10.717","0.003","90","","90.22","0.03","90","","2143.6","1","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H5 F6 P -","- C10 H5 F6 P -","- C80 H40 F48 P8 -","8","2","","Banger, Kulbinder K.; Banham, Russell P.; Brisdon, Alan K.; Cross, Wendy I.; Damant, Greame; Parsons, Simon; Pritchard, Robin G.; Sousa-Pedrares, Antonio","Synthesis and co-ordination chemistry of perfluorovinyl phosphine derivatives. Single crystal structures of PPh(CFCF2)2, cis-[PtCl2{PPh2(CFCF2)}2] and [{AuCl[PPh2(CFCF2)]}2]","Journal of the Chemical Society, Dalton Transactions","1999","","3","427","","10.1039/a806535g","","","0.71073","MoKα","","0.0712","0.0419","","0.1048","0.0899","","","","1.02","1.057","1.057","","","","","has coordinates","301848","2025-08-21","12:23:47",""
"7027078","11.083","0.003","15.162","0.002","16.668","0.003","90","","100.231","0.014","90","","2756.4","1","146","2","146","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H20 Cl2 F6 P2 Pt -","- C28 H20 Cl2 F6 P2 Pt -","- C112 H80 Cl8 F24 P8 Pt4 -","4","1","","Banger, Kulbinder K.; Banham, Russell P.; Brisdon, Alan K.; Cross, Wendy I.; Damant, Greame; Parsons, Simon; Pritchard, Robin G.; Sousa-Pedrares, Antonio","Synthesis and co-ordination chemistry of perfluorovinyl phosphine derivatives. Single crystal structures of PPh(CFCF2)2, cis-[PtCl2{PPh2(CFCF2)}2] and [{AuCl[PPh2(CFCF2)]}2]","Journal of the Chemical Society, Dalton Transactions","1999","","3","427","","10.1039/a806535g","","","0.71069","MoKα","","0.0947","0.0467","","","0.1156","0.1396","","","","","","0.916","","","","has coordinates","179976","2020-10-21","18:00:00",""
"7027079","20.1903","0.0014","9.822","0.0015","31.974","0.004","90","","103.493","0.009","90","","6165.7","1.3","203","2","203","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28.5 H21 Au2 Cl3 F6 P2 -","- C28.5 H21 Au2 Cl3 F6 P2 -","- C228 H168 Au16 Cl24 F48 P16 -","8","1","","Banger, Kulbinder K.; Banham, Russell P.; Brisdon, Alan K.; Cross, Wendy I.; Damant, Greame; Parsons, Simon; Pritchard, Robin G.; Sousa-Pedrares, Antonio","Synthesis and co-ordination chemistry of perfluorovinyl phosphine derivatives. Single crystal structures of PPh(CFCF2)2, cis-[PtCl2{PPh2(CFCF2)}2] and [{AuCl[PPh2(CFCF2)]}2]","Journal of the Chemical Society, Dalton Transactions","1999","","3","427","","10.1039/a806535g","","","0.71069","MoKα","","0.0559","0.0373","","","0.0768","0.0823","","","","","","1.137","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027086","24.01","0.003","6.957","0.004","21.172","0.002","90","","94.46","0.009","90","","3526","2","295.2","","295.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H40 N4 Nb2 S12 -","- C20 H40 N4 Nb2 S12 -","- C80 H160 N16 Nb8 S48 -","4","0.5","","Sokolov, Maxim; Imoto, Hideo; Saito, Taro; Fedorov, Vladimir","Substitution of bridging S2 ligands in the [Nb2(μ-S2)2]4+ core: a simple route to [Nb2(Se2)2]4+, [Nb2(S)(Te2)]4+ and [Nb2(S)2]4+","Journal of the Chemical Society, Dalton Transactions","1999","","1","85","","10.1039/a806627b","","","0.7107","MoKα","","","0.0424","","","0.0269","","","","","1.375","1.375","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027087","9","0.02","11.15","0.03","8.868","0.006","101.5","0.1","95.69","0.1","73.3","0.2","834","3","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H32 Cl4 Nb2 O8 S2 -","- C22 Cl4 Nb2 O8 S2 -","- C22 Cl4 Nb2 O8 S2 -","1","0.5","","Sokolov, Maxim; Imoto, Hideo; Saito, Taro; Fedorov, Vladimir","Substitution of bridging S2 ligands in the [Nb2(μ-S2)2]4+ core: a simple route to [Nb2(Se2)2]4+, [Nb2(S)(Te2)]4+ and [Nb2(S)2]4+","Journal of the Chemical Society, Dalton Transactions","1999","","1","85","","10.1039/a806627b","","","0.7107","MoKα","","","0.0737","","","0.0778","","","","","3.9","3.9","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027088","13.03","0.003","14.391","0.005","12.053","0.004","97.61","0.03","110.81","0.02","78.4","0.03","2064.9","1.2","173.2","","173.2","","","","","","","","","7","P -1","-P 1","2","","","","- C21 H41 Cl3 N4 Nb2 S9 Te2 -","- C21 H41 Cl3 N4 Nb2 S9 Te2 -","- C42 H82 Cl6 N8 Nb4 S18 Te4 -","2","1","","Sokolov, Maxim; Imoto, Hideo; Saito, Taro; Fedorov, Vladimir","Substitution of bridging S2 ligands in the [Nb2(μ-S2)2]4+ core: a simple route to [Nb2(Se2)2]4+, [Nb2(S)(Te2)]4+ and [Nb2(S)2]4+","Journal of the Chemical Society, Dalton Transactions","1999","","1","85","","10.1039/a806627b","","","0.7107","MoKα","","","0.091","","","0.0554","","","","","2.568","2.568","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027089","10.899","0.005","12.42","0.01","17.406","0.005","90","","104.25","0.03","90","","2284","2","296.2","","296.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C22 H42 Cl6 N4 Nb2 S8 Se4 -","- C22 H42 Cl6 N4 Nb2 S8 Se4 -","- C44 H84 Cl12 N8 Nb4 S16 Se8 -","2","0.5","","Sokolov, Maxim; Imoto, Hideo; Saito, Taro; Fedorov, Vladimir","Substitution of bridging S2 ligands in the [Nb2(μ-S2)2]4+ core: a simple route to [Nb2(Se2)2]4+, [Nb2(S)(Te2)]4+ and [Nb2(S)2]4+","Journal of the Chemical Society, Dalton Transactions","1999","","1","85","","10.1039/a806627b","","","0.7107","MoKα","","","0.0787","","","0.0488","","","","","2.534","2.534","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027090","23.923","0.003","7.868","0.003","17.819","0.003","90","","121.036","0.008","90","","2873.9","1.3","296.2","","296.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H28 Nb2 O8 S4 -","- C20 H28 Nb2 O8 S4 -","- C80 H112 Nb8 O32 S16 -","4","0.5","","Sokolov, Maxim; Imoto, Hideo; Saito, Taro; Fedorov, Vladimir","Substitution of bridging S2 ligands in the [Nb2(μ-S2)2]4+ core: a simple route to [Nb2(Se2)2]4+, [Nb2(S)(Te2)]4+ and [Nb2(S)2]4+","Journal of the Chemical Society, Dalton Transactions","1999","","1","85","","10.1039/a806627b","","","0.7107","MoKα","","","0.0396","","","0.0243","","","","","1.327","1.327","","","","","has coordinates","301848","2025-08-21","12:23:47",""
"7027099","8.9482","0.0001","8.9482","0.0001","18.3758","0.0001","90","","90","","120","","1274.23","0.02","163","2","163","2","","","","","","","","6","P 63","P 6c","173","","","","- C18 H30 Cl2 Hg N8 O8 -","- C18 H30 Cl2 Hg N8 O8 -","- C36 H60 Cl4 Hg2 N16 O16 -","2","0.333333","","Apperley, David C.; Clegg, William; Coles, Simon; Coyle, Joanne L.; Martin, Noreen; Maubert, Beatrice; McKee, Vickie; Nelson, Jane","Kinetically inert cryptate systems: solid state and solution NMR studies †","Journal of the Chemical Society, Dalton Transactions","1999","","2","229","","10.1039/a806791k","","","0.6879","","","0.0484","0.0471","","","0.1232","0.1243","","","","","","1.049","","","","has coordinates","301848","2025-08-21","12:23:47",""
"7027100","11.26","0.005","14.25","0.005","21.475","0.005","74.23","0.005","79.33","0.005","83.72","0.005","3252","2","298","","298","","","","","","","","","6","P -1","-P 1","2","","","","- C54 H73 Br6 N15 O5 Pb3 -","- C54 H63 Br6 N15 O4.99 Pb3 -","- C108 H126 Br12 N30 O9.98 Pb6 -","2","1","","Bazzicalupi, Carla; Bencini, Andrea; Fusi, Vieri; Giorgi, Claudia; Paoletti, Piero; Valtancoli, Barbara","Lead complexation by novel phenanthroline-containing macrocycles †","Journal of the Chemical Society, Dalton Transactions","1999","","3","393","","10.1039/a806800c","","","0.71069","MoKα","","0.1212","0.0621","","0.1499","0.1216","","","","1.03","1.072","1.072","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027101","9.777","0.007","13.7","0.01","16.75","0.01","89.16","0.07","84.9","0.1","71.9","0.1","2124","3","298","","298","","","","","","","","","7","P -1","-P 1","2","","","","- C46 H51 B Cl N7 O4 Pb -","- C46 H51 B Cl N7 O4 Pb -","- C92 H102 B2 Cl2 N14 O8 Pb2 -","2","1","","Bazzicalupi, Carla; Bencini, Andrea; Fusi, Vieri; Giorgi, Claudia; Paoletti, Piero; Valtancoli, Barbara","Lead complexation by novel phenanthroline-containing macrocycles †","Journal of the Chemical Society, Dalton Transactions","1999","","3","393","","10.1039/a806800c","","","0.71069","MoKα","","0.191","0.1031","","0.3231","0.2519","","","","1.026","1.142","1.142","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027102","8.92","0.002","12.903","0.003","13.55","0.01","67.19","0.04","76.02","0.04","73.68","0.02","1364.1","1.2","173","","173","","","","","","","","[Ti(NTol)(Me4taa)] + CO2","5","P -1","-P 1","2","","[Ti{N(Tol)C(O)O}(Me4taa)]","","- C30 H28 N5 O2 Ti -","- C30 H29 N5 O2 Ti -","- C60 H58 N10 O4 Ti2 -","2","1","","Blake, Alexander J.; McInnes, Jacqueline M.; Mountford, Philip; Nikonov, Georgii I.; Swallow, Daniel; Watkin, David J.","Cycloaddition reactions of titanium and zirconium imido, oxo and hydrazido complexes supported by tetraaza macrocyclic ligands ‡","Journal of the Chemical Society, Dalton Transactions","1999","","3","379","","10.1039/a806827e","","","1.5418","CuKα","","","0.067","","","0.0736","","","","","1.106","1.106","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027103","17.298","0.001","20.032","0.001","11.727","0.001","90","","90","","90","","4063.6","0.5","294","2","294","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C32 H62 K2 O3 Si3 -","- C32 H62 K2 O3 Si3 -","- C128 H248 K8 O12 Si12 -","4","1","","Hitchcock, Peter B.; Lappert, Michael F.; Leung, Wing-Por; Liu, Dian-Sheng; Mak, Thomas C. W.; Wang, Zhong-Xia","Synthesis and structures of some silylallyl-lithium or -potassium complexes","Journal of the Chemical Society, Dalton Transactions","1999","","8","1257","","10.1039/a806870d","","","0.71073","MoKα","","0.108","0.0989","","","0.2606","0.2684","","","","","","1.148","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027104","19.325","0.004","8.66","0.002","14.75","0.003","90","","90","","90","","2468.5","0.9","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C18 H41 Li N2 Si2 -","- C18 H41 Li N2 Si2 -","- C72 H164 Li4 N8 Si8 -","4","1","","Hitchcock, Peter B.; Lappert, Michael F.; Leung, Wing-Por; Liu, Dian-Sheng; Mak, Thomas C. W.; Wang, Zhong-Xia","Synthesis and structures of some silylallyl-lithium or -potassium complexes","Journal of the Chemical Society, Dalton Transactions","1999","","8","1257","","10.1039/a806870d","","","0.71073","MoKα","","0.2639","0.0482","","","0.1019","0.1337","","","","","","0.729","","","","has coordinates,has disorder","179977","2020-10-21","18:00:00",""
"7027111","11.489","0.005","41.653","0.02","13.086","0.004","90","","91.6","0.02","90","","6260","4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C57 H43 Cl3 N12 O13 Ru2 S2 -","- C57 H41 Cl3 N12 O13 Ru2 S2 -","- C228 H164 Cl12 N48 O52 Ru8 S8 -","4","1","","Baitalik, Sujoy; Flörke, Ulrich; Nag, Kamalaksha","Synthesis, structure, redox activity and spectroscopic properties of ruthenium(II) complexes with 3,5-bis(benzothiazol-2-yl)pyrazole, 3,5-bis(benzimidazol-2-yl)pyrazole and 2,2′-bipyridine as co-ligands","Journal of the Chemical Society, Dalton Transactions","1999","","5","719","","10.1039/a806989a","","","0.71073","MoKα","","0.2109","0.1073","","","0.2883","0.3827","","","","","","0.994","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027112","14.871","0.004","14.871","0.004","14.871","0.004","90","","90","","90","","3288.7","1.5","295","2","295","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","","","- C14 H28 Cd3 N12 O S6 -","- C14.004 Cd0.833 N12 O0.167 S6 -","- C56.016 Cd3.332 N48 O0.668 S24 -","4","0.166667","","Mondal, Arunendu; Mostafa, Golam; Ghosh, Ashutosh; Laskar, Inamur Rahaman; Chaudhuri, Nirmalendu Ray","Construction of a unique three-dimensional array with cadmium(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","1","9","","10.1039/a806999i","","","0.71073","MoKα","","0.0447","0.036","","0.0923","0.0874","","","","1.132","1.182","1.182","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027113","20.525","0.005","13.38","0.004","7.974","0.0007","90","","90","","90","","2189.9","0.9","293","2","293","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C14 H33 B F4 Mo O P3 -","- C14 H33 B F4 Mo O P3 -","- C56 H132 B4 F16 Mo4 O4 P12 -","4","1","","Fettinger, James C.; Kraatz, Heinz-Bernhard; Poli, Rinaldo; Quadrelli, E. Alessandra","Formation of organometallic hydroxo and oxo complexes by oxidation of transition metal hydrides in the presence of water. X-Ray structures of [CpMo(OH)(PMe3)3][BF4] and [CpMo(O)(PMe3)2][BF4]","Journal of the Chemical Society, Dalton Transactions","1999","","3","497","","10.1039/a807111j","","","0.71073","MoKα","","0.0353","0.0267","","","0.0567","0.0604","","","","","","1.071","","","","has coordinates,has disorder","179977","2020-10-21","18:00:00",""
"7027114","8.714","0.0009","13.3","0.004","37.939","0.006","90","","90","","90","","4397","1.6","293","2","293","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C28 H65.58 B2 Cl0.42 F8 Mo2 O1.59 P6 -","- C28 H65.58 B2 Cl0.42 F8 Mo2 O1.58 P6 -","- C112 H262.32 B8 Cl1.68 F32 Mo8 O6.32 P24 -","4","1","","Fettinger, James C.; Kraatz, Heinz-Bernhard; Poli, Rinaldo; Quadrelli, E. Alessandra","Formation of organometallic hydroxo and oxo complexes by oxidation of transition metal hydrides in the presence of water. X-Ray structures of [CpMo(OH)(PMe3)3][BF4] and [CpMo(O)(PMe3)2][BF4]","Journal of the Chemical Society, Dalton Transactions","1999","","3","497","","10.1039/a807111j","","","0.71073","MoKα","","0.0807","0.0509","","0.1292","0.1139","","","","1.118","1.125","1.125","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027115","17.289","0.016","15.201","0.002","6.6459","0.0006","90","","90","","90","","1746.6","1.6","293","2","293","2","","","","","","","","7","A m a 2","A 2 -2a","40","","","","- C11 H23 B F4 Mo O P2 -","- C11 H23 B F4 Mo O P2 -","- C44 H92 B4 F16 Mo4 O4 P8 -","4","0.5","","Fettinger, James C.; Kraatz, Heinz-Bernhard; Poli, Rinaldo; Quadrelli, E. Alessandra","Formation of organometallic hydroxo and oxo complexes by oxidation of transition metal hydrides in the presence of water. X-Ray structures of [CpMo(OH)(PMe3)3][BF4] and [CpMo(O)(PMe3)2][BF4]","Journal of the Chemical Society, Dalton Transactions","1999","","3","497","","10.1039/a807111j","","","0.71073","MoKα","","0.0782","0.0391","","0.0801","0.0715","","","","1.068","1.128","1.128","","","","","has coordinates,has disorder","179977","2020-10-21","18:00:00",""
"7027116","9.588","0.001","11.402","0.001","11.62","0.001","69.43","0.01","87.11","0.01","69.74","0.01","1112.1","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","butane-2,3-bis[(dimethylthiophosphoryl)hydrazide]","","- C18 H24 N4 P2 S2 -","- C18 H24 N4 P2 S2 -","- C36 H48 N8 P4 S4 -","2","1","","Batsanov, Andrei S.; Churakov, Andrei V.; Easson, Morag A. M.; Govenlock, Linda J.; Howard, Judith A. K.; Moloney, Janet M.; Parker, David","Dimethylthiophosphoryl hydrazone ligands and their copper complexes: crystal structures and analysis of their solution complexation behaviour by electrospray mass spectrometry","Journal of the Chemical Society, Dalton Transactions","1999","","3","323","","10.1039/a807142j","","","0.71073","MoKα","","0.0354","0.0324","","0.0944","0.0846","","","","1.054","1.04","1.04","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027117","6.22","0.0001","12.1463","0.0002","10.1414","0.0001","90","","97.937","0.001","90","","758.843","0.019","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","diphenyl-1,2-ethane-1,2-bis[(dimethylthiophosphoryl)hydrazide]","","- C8 H20 N4 P2 S2 -","- C8 H20 N4 P2 S2 -","- C16 H40 N8 P4 S4 -","2","0.5","","Batsanov, Andrei S.; Churakov, Andrei V.; Easson, Morag A. M.; Govenlock, Linda J.; Howard, Judith A. K.; Moloney, Janet M.; Parker, David","Dimethylthiophosphoryl hydrazone ligands and their copper complexes: crystal structures and analysis of their solution complexation behaviour by electrospray mass spectrometry","Journal of the Chemical Society, Dalton Transactions","1999","","3","323","","10.1039/a807142j","","","0.71073","MoKα","","0.0284","0.0253","","0.0726","0.0661","","","","1.056","1.066","1.066","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027118","11.415","0.001","8.348","0.001","11.983","0.001","90","","114.54","0.01","90","","1038.7","0.2","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-(dimethylthiophosphorylamino)-6-picoline","","- C8 H13 N2 P S -","- C8 H13 N2 P S -","- C32 H52 N8 P4 S4 -","4","1","","Batsanov, Andrei S.; Churakov, Andrei V.; Easson, Morag A. M.; Govenlock, Linda J.; Howard, Judith A. K.; Moloney, Janet M.; Parker, David","Dimethylthiophosphoryl hydrazone ligands and their copper complexes: crystal structures and analysis of their solution complexation behaviour by electrospray mass spectrometry","Journal of the Chemical Society, Dalton Transactions","1999","","3","323","","10.1039/a807142j","","","0.71073","MoKα","","0.0432","0.0329","","0.0824","0.0727","","","","1.163","1.151","1.151","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027119","11.649","0.001","15.064","0.001","9.682","0.001","90","","94.11","0.01","90","","1694.6","0.3","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C16 H40 Br0.54 Cl1.46 Cu2 N8 P4 S4 -","- C16 H40 Br0.544 Cl1.456 Cu2 N8 P4 S4 -","- C32 H80 Br1.088 Cl2.912 Cu4 N16 P8 S8 -","2","0.5","","Batsanov, Andrei S.; Churakov, Andrei V.; Easson, Morag A. M.; Govenlock, Linda J.; Howard, Judith A. K.; Moloney, Janet M.; Parker, David","Dimethylthiophosphoryl hydrazone ligands and their copper complexes: crystal structures and analysis of their solution complexation behaviour by electrospray mass spectrometry","Journal of the Chemical Society, Dalton Transactions","1999","","3","323","","10.1039/a807142j","","","0.71073","MoKα","","0.0486","0.039","","0.0856","0.079","","","","1.308","1.323","1.323","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027120","9.379","0.002","9.621","0.002","26.609","0.006","90","","90.34","0.02","90","","2401","0.9","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H36 N7 P2 Sb -","- C16 H36 N7 P2 Sb -","- C64 H144 N28 P8 Sb4 -","4","1","","Moser, Daniel F.; Schranz, Ingo; Gerrety, Michael C.; Stahl, Lothar; Staples, Richard J.","Polycyclic bis(amido)cyclodiphosphazane complexes of antimony(III) and bismuth(III): syntheses, molecular structures and solution behaviour","Journal of the Chemical Society, Dalton Transactions","1999","","5","751","","10.1039/a807207h","","","0.71073","MoKα","","0.0413","0.0326","","","0.0773","0.0826","","","","","","1.057","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027121","9.548","0.002","29.466","0.006","19.817","0.005","90","","90.07","0.02","90","","5575","2","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H41 N4 O P2 Sb -","- C22 H41 N4 O P2 Sb0.997 -","- C176 H328 N32 O8 P16 Sb7.976 -","8","2","","Moser, Daniel F.; Schranz, Ingo; Gerrety, Michael C.; Stahl, Lothar; Staples, Richard J.","Polycyclic bis(amido)cyclodiphosphazane complexes of antimony(III) and bismuth(III): syntheses, molecular structures and solution behaviour","Journal of the Chemical Society, Dalton Transactions","1999","","5","751","","10.1039/a807207h","","","0.71073","MoKα","","0.0932","0.0644","","","0.1171","0.1365","","","","","","1.235","","","","has coordinates,has disorder","179977","2020-10-21","18:00:00",""
"7027122","17.975","0.003","10.874","0.002","17.765","0.004","90","","112.67","0.01","90","","3204.1","1.1","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H54 N5 P2 Sb Si2 -","- C22 H54 N5 P2 Sb Si2 -","- C88 H216 N20 P8 Sb4 Si8 -","4","1","","Moser, Daniel F.; Schranz, Ingo; Gerrety, Michael C.; Stahl, Lothar; Staples, Richard J.","Polycyclic bis(amido)cyclodiphosphazane complexes of antimony(III) and bismuth(III): syntheses, molecular structures and solution behaviour","Journal of the Chemical Society, Dalton Transactions","1999","","5","751","","10.1039/a807207h","","","0.71073","MoKα","","0.047","0.0299","","","0.0605","0.0674","","","","","","1.054","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027123","11.0596","0.0002","24.5139","0.0002","18.1872","0.0003","90","","98.396","0.001","90","","4877.96","0.13","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H28 Cl N4 P2 Sb -","- C20 H28 Cl N4 P2 Sb -","- C160 H224 Cl8 N32 P16 Sb8 -","8","2","","Moser, Daniel F.; Schranz, Ingo; Gerrety, Michael C.; Stahl, Lothar; Staples, Richard J.","Polycyclic bis(amido)cyclodiphosphazane complexes of antimony(III) and bismuth(III): syntheses, molecular structures and solution behaviour","Journal of the Chemical Society, Dalton Transactions","1999","","5","751","","10.1039/a807207h","","","0.71073","MoKα","","0.0418","0.0288","","","0.0655","0.0672","","","","","","1.016","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027124","8.7432","0.0011","8.5509","0.0009","19.423","0.0015","90","","96.942","0.009","90","","1441.5","0.3","150","2","293","2","","","","","","","dichloromethane-petrol solution","4","P 1 21/c 1","-P 2ybc","14","1,4-(trans)bispyrazolylpyrazabole","","","- C12 H14 B2 N8 -","- C12 H14 B2 N8 -","- C48 H56 B8 N32 -","4","1","","Kresiński, Roman A.","Pyrazabole formation by thermolysis of the free acid of the hydrotris(pyrazolyl)borate ion","Journal of the Chemical Society, Dalton Transactions","1999","","3","401","","10.1039/a807338d","","","0.71069","MoKα","","0.0528","0.0312","","0.104","0.0759","","","","0.398","0.385","0.385","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027125","12.0191","0.0009","10.8998","0.0006","22.799","0.003","90","","90","","90","","2986.8","0.5","150","2","293","2","","","","","","","dichloromethane-petrol solution","4","P b c a","-P 2ac 2ab","61","1,4-(cis)bispyrazolylpyrazabole","","","- C12 H14 B2 N8 -","- C12 H14 B2 N8 -","- C96 H112 B16 N64 -","8","1","","Kresiński, Roman A.","Pyrazabole formation by thermolysis of the free acid of the hydrotris(pyrazolyl)borate ion","Journal of the Chemical Society, Dalton Transactions","1999","","3","401","","10.1039/a807338d","","","0.71069","MoKα","","0.1573","0.0354","","0.0701","0.0585","","","","0.602","0.947","0.947","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027126","9.4165","0.0013","16.3833","0.0015","18.6033","0.0009","90","","90","","90","","2870","0.5","293","2","293","2","","","","","","","dichloromethane-petrol solution","5","P b c a","-P 2ac 2ab","61","bispyrazolylboron oxide dimer","","","- C24 H24 B4 N16 O2 -","- C24 H24 B4 N16 O2 -","- C96 H96 B16 N64 O8 -","4","0.5","","Kresiński, Roman A.","Pyrazabole formation by thermolysis of the free acid of the hydrotris(pyrazolyl)borate ion","Journal of the Chemical Society, Dalton Transactions","1999","","3","401","","10.1039/a807338d","","","0.71069","MoKα","","0.1165","0.0351","","0.0656","0.0559","","","","0.557","0.77","0.77","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027128","9.857","0.002","13.365","0.003","8.244","0.002","103.48","0.02","101.19","0.02","87.95","0.02","1036","0.4","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C26 H28 Zr -","- C26 H28 Zr -","- C52 H56 Zr2 -","2","1","","Bochmann, Manfred; Green, Malcolm L. H.; Powell, Annie K.; Saßmannshausen, Jörg; Triller, Michael U.; Wocadlo, Sigrid","Cationic zirconocene complexes with benzyl and Si(SiMe3)3 substituted cyclopentadienyl ligands","Journal of the Chemical Society, Dalton Transactions","1999","","1","43","","10.1039/a807418f","","","0.71073","MoKα","","0.0331","0.0231","","0.0604","0.0568","","","","1.012","1.027","1.027","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027129","8.894","0.002","9.855","0.002","13.892","0.003","106.01","0.03","98.8","0.03","113.58","0.03","1023.6","0.6","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","1.1'-Bis[(pyridylmethlyamino)carbonyl]ferrocene","","- C24 H22 Fe N4 O2 -","- C24 H22 Fe N4 O2 -","- C48 H44 Fe2 N8 O4 -","2","1","","Carr, Jonathan D.; Coles, Simon J.; Hassan, William W.; Hursthouse, Michael B.; Malik, K. M. Abdul; Tucker, James H. R.","The effect of protonation on the spectroscopic and redox properties of a series of ferrocenoyl derivatives","Journal of the Chemical Society, Dalton Transactions","1999","","1","57","","10.1039/a807453d","","","0.71069","MoKα","","0.0558","0.0399","","0.0993","0.0955","","","","0.723","0.831","0.831","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027130","29.647","0.003","14.834","0.003","19.991","0.002","90","","115.257","0.005","90","","7951","2","183","","183","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H39 Cu2 N5 O6 -","- C45 H39 Cu2 N5 O6 -","- C360 H312 Cu16 N40 O48 -","8","1","","McNelis, Brian J.; Nathan, Lawrence C.; Clark, Curtis J.","Design, synthesis and crystal structure of a copper dimetallocyclophane complex exhibiting unique rotational isomerism","Journal of the Chemical Society, Dalton Transactions","1999","","11","1831","","10.1039/a807579d","","","0.71073","MoKα","","0.0688","0.0453","","0.1208","0.1069","","","","1.02","1.067","1.067","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027131","13.685","0.003","13.746","0.003","19.616","0.004","109.1","0.02","102.78","0.02","63.49","0.02","3107.9","1.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C72 H69 B Fe N2 O2 P4 -","- C72 H64 B Fe N1.5 O2 P4 -","- C144 H128 B2 Fe2 N3 O4 P8 -","2","1","","Almeida, Sílvia S. P. R.; da Silva, M. Fátima C. Guedes; Fraústoda Silva, João J. R.; Pombeiro, Armando J. L.","Reactions of a cyanosilane with an iron(II) centre. Synthesis and crystal structure of the isocyanotriphenylborate complex trans-[FeH(CNBPh3)(Ph2PCH2CH2PPh2)2] and anodic deprotonation of the hydrogen isocyanide (CNH) analogue","Journal of the Chemical Society, Dalton Transactions","1999","","3","467","","10.1039/a807707j","","","0.71073","MoKα","","0.0397","0.0397","","0.1111","0.1111","","","","1.019","","","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027132","10.6246","0.0011","21.341","0.002","16.676","0.002","90","","94.802","0.009","90","","3767.8","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H47 Bi N11 O19.5 S2 -","- C22 H28 Bi N11 O19.5 S2 -","- C88 H112 Bi4 N44 O78 S8 -","4","1","","Georgopoulou, Alexandra S.; Ulvenlund, Stefan; Mingos, D. Michael P.; Baxter, Ian; Williams, David J.","Synthesis of water soluble DTPA complexes with pendant uracil moieties capable of forming complementary hydrogen bonds","Journal of the Chemical Society, Dalton Transactions","1999","","4","547","","10.1039/a807723a","","","1.54178","CuKα","","0.0705","0.0511","","0.1289","0.1168","","","","1.062","1.114","1.114","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027133","8.612","0.002","9.9105","0.0016","24.25","0.006","90","","98.38","0.02","90","","2047.6","0.8","288","","288","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H56 Eu2 N4 Na2 O26 -","- C28 H3.6 Eu2 N4 Na2 O26 -","- C56 H7.2 Eu4 N8 Na4 O52 -","2","0.5","","Kang, Jun-Gill; Yoon, Soo-Kyung; Sohn, Youngku; Kim, Jong-Goo; Kim, Youn-Doo; Suh, Il-Hwan","Crystal structure and luminescence of Na[Eu(DCTA)·H2O]·4H2O (DCTA = trans-cyclohexane-1,2-diyldinitrilotetraacetate)","Journal of the Chemical Society, Dalton Transactions","1999","","9","1467","","10.1039/a807775d","","","0.71069","MoKα","","0.0318","0.0248","","","0.0612","0.0675","","","","","","1.143","","","","has coordinates","290444","2024-03-12","09:55:30",""
"7027135","12.171","0.002","13.098","0.002","14.221","0.003","100.74","0.01","104.32","0.02","115.38","0.01","1870.7","0.7","293","2","293","2","","","","","","","prepared as reported in the manuscript","6","P 1","P 1","1","CUTERADP","dihydrogenadenosin-5'-diphosphate(adenosin-5'-diphosphate)(terpyridine) rameate(II)of diaqua(terpyridine)copper(II) hexadeca hydrate.","","- C50 H84 Cu2 N16 O38 P4 -","- C50 H48 Cu2 N16 O38 P4 -","- C50 H48 Cu2 N16 O38 P4 -","1","1","","Cini, Renzo; Pifferi, Claudia","Supramolecular networks via hydrogen bonding and stacking interactions for adenosine 5′-diphosphate. Synthesis and crystal structure of diaqua(2,2′∶6′,2″-terpyridine)copper(II) [adenosine 5′-diphosphato(3−)](2,2′∶6′,2″-terpyridine)cuprate(II) adenosine 5′-diphosphate(1−) hexadecahydrate and density functional geometry optimization analysis of copper(II)- and zinc(II)-pyrophosphate complexes","Journal of the Chemical Society, Dalton Transactions","1999","","5","699","","10.1039/a807793b","","","0.71073","MoKα","","0.0909","0.0628","","0.2062","0.1429","","","","1.108","0.992","0.992","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027136","12.613","0.0006","13.6968","0.0006","14.5593","0.0007","71.114","0.001","85.649","0.002","72.319","0.001","2266.7","0.18","153","2","153","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H18 B Cl F4 N4 Pt -","- C23 H15 B Cl F4 N4 Pt -","- C92 H60 B4 Cl4 F16 N16 Pt4 -","4","2","","Büchner, Riaan; Cunningham, Corey T.; Field, John S.; Haines, Raymond J.; McMillin, David R.; Summerton, Grant C.","Luminescence properties of salts of the [Pt(4′Ph-terpy)Cl]+ chromophore: crystal structure of the red form of [Pt(4′Ph-terpy)Cl]BF4 (4′Ph-terpy = 4′-phenyl-2,2′∶6′,2″-terpyridine)","Journal of the Chemical Society, Dalton Transactions","1999","","5","711","","10.1039/a807914e","","","0.71073","MoKa","","0.061","0.0444","","0.1175","0.1086","","","","1.036","1.083","1.083","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027137","49.218","0.004","8.146","0.001","17.146","0.001","90","","104.92","","90","","6642.6","1.1","291","2","291","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H33 N6 O2.5 S2 Zn -","- C34 H32 N6 O2.5 S2 Zn -","- C272 H256 N48 O20 S16 Zn8 -","8","1","","Sun, Wei-Yin; Zhang, Li; Yu, Kai-Bei","Structure and characterization of novel zinc(II) and cadmium(II) complexes with 2-(benzoylamino)benzenethiolate and 1-methylimidazole. NH · · · S Hydrogen bonding in metal complexes with a S2N2 binding site","Journal of the Chemical Society, Dalton Transactions","1999","","5","795","","10.1039/a807922f","","","0.71073","MoKα","","0.0593","0.0329","","0.0873","0.0701","","","","0.881","1.032","1.032","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027138","49.911","0.005","8.166","0.001","17.272","0.002","90","","105.26","0.01","90","","6791.4","1.4","290","2","290","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H33 Cd N6 O2.5 S2 -","- C34 H32 Cd N6 O2.5 S2 -","- C272 H256 Cd8 N48 O20 S16 -","8","1","","Sun, Wei-Yin; Zhang, Li; Yu, Kai-Bei","Structure and characterization of novel zinc(II) and cadmium(II) complexes with 2-(benzoylamino)benzenethiolate and 1-methylimidazole. NH · · · S Hydrogen bonding in metal complexes with a S2N2 binding site","Journal of the Chemical Society, Dalton Transactions","1999","","5","795","","10.1039/a807922f","","","0.71073","MoKα","","0.0534","0.0303","","0.0645","0.0604","","","","0.869","1","1","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027139","12.9611","0.0003","13.1505","0.0003","14.7587","0.0003","75.784","0.001","76.545","0.001","82.647","0.001","2364.88","0.09","203","2","203","2","","","","","","","","4","P -1","-P 1","2","","","","- C76 H140 O26 Zr6 -","- C76 H138 O26 Zr6 -","- C76 H138 O26 Zr6 -","1","0.5","","Kickelbick, Guido; Schubert, Ulrich","Hydroxy carboxylate substituted oxozirconium clusters","Journal of the Chemical Society, Dalton Transactions","1999","","8","1301","","10.1039/a807939k","","","0.71073","MoKα","","0.0689","0.0523","","0.1904","0.1276","","","","1.079","1.067","1.067","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027140","29.9805","0.0015","21.5033","0.0011","23.7488","0.0013","90","","110.656","0.002","90","","14326.1","1.3","203","2","203","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C130 H124 O64 Zr10 -","- C130 H62 O64 Zr10 -","- C520 H248 O256 Zr40 -","4","0.5","","Kickelbick, Guido; Schubert, Ulrich","Hydroxy carboxylate substituted oxozirconium clusters","Journal of the Chemical Society, Dalton Transactions","1999","","8","1301","","10.1039/a807939k","","","0.71073","MoKα","","0.1679","0.0694","","0.2898","0.1801","","","","1.061","1.131","1.131","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027141","23.288","0.005","13.901","0.002","29.507","0.009","90","","108.7","0.03","90","","9048","4","223","","223","","","","","","","","?","7","P 1 2/a 1","-P 2ya","13","","","","- C70.5 H71 F24 N12 O5.5 P4 Ru2 -","- C70.25 H71 F24 N12 O5.25 P4 Ru2 -","- C281 H284 F96 N48 O21 P16 Ru8 -","4","1","","Heirtzler, Fenton R.; Neuburger, Markus; Zehnder, Margareta; Bird, Steven J.; Orrell, Keith G.; Sik, Vladimir","Synthesis, 1H/13C NMR spectroscopic and structural studies of sterically induced internal dynamics in novel mono- and di-ruthenium(II) 2,2′∶6′,2″-terpyridine complexes of 2,3-bis(2,2′-bipyridin-6-yl)pyrazine","Journal of the Chemical Society, Dalton Transactions","1999","","4","565","","10.1039/a807970f","","","1.5418","CuKα","","","0.1145","","","0.1293","","","","","0.9467","0.9467","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027142","14.626","0.001","16.343","0.002","13.398","0.001","99.2","0.002","114.834","0.001","69.368","0.004","2719.7","0.4","297.2","","","","","","","","","","","7","P -1","-P 1","2","","","","- C50 H64 B Cl3 N2 O9 Zn2 -","- C50 H63 B Cl3 N2 O9 Zn2 -","- C100 H126 B2 Cl6 N4 O18 Zn4 -","2","1","","Sakiyama, Hiroshi; Mochizuki, Rieko; Sugawara, Akihiko; Sakamoto, Masatomi; Nishida, Yuzo; Yamasaki, Mikio","Dinuclear zinc(II) complex of a new acyclic phenol-based dinucleating ligand with four methoxyethyl chelating arms: first dizinc model with aminopeptidase function","Journal of the Chemical Society, Dalton Transactions","1999","","6","997","","10.1039/a808055k","","","0.7107","MoKα","","","0.0564","","","","0.0859","","","","","","1.439","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027143","15.83","0.002","22.432","0.002","14.249","0.0012","90","","90","","90","","5059.8","0.9","294","2","294","2","","","","","","","synthesis","7","P b c a","-P 2ac 2ab","61","","","","- C18 H22 Cl2 N2 Ni O10 S3 -","- C18 H22 Cl2 N2 Ni O10 S3 -","- C144 H176 Cl16 N16 Ni8 O80 S24 -","8","1","","Blake, Alexander J.; Casabò, Jaume; Devillanova, Francesco A.; Escriche, Lluis; Garau, Alessandra; Isaia, Francesco; Lippolis, Vito; Kivekas, Raikko; Muns, Vincens; Schröder, Martin; Sillanpää, Reijo; Verani, Gaetano","Mixed aza‒thia crowns containing the 1,10-phenanthroline sub-unit. Substitution reactions in [NiL(MeCN)][BF4]2 {L = 2,5,8-trithia[9](2,9)-1,10-phenanthrolinophane} †","Journal of the Chemical Society, Dalton Transactions","1999","","7","1085","","10.1039/a808062c","","","0.71069","MoKα","","0.1724","0.0657","","0.1692","0.117","","","","1.056","1.171","1.171","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027144","10.972","0.003","11.472","0.002","10.264","0.002","99.226","0.014","117.279","0.013","109.407","0.013","1004.9","0.5","294","2","294","2","","","","","","","synthesis","7","P -1","-P 1","2","","","","- C18 H20 Cl2 N2 Ni O S3 -","- C18 H12 Cl2 N2 Ni O S3 -","- C36 H24 Cl4 N4 Ni2 O2 S6 -","2","1","","Blake, Alexander J.; Casabò, Jaume; Devillanova, Francesco A.; Escriche, Lluis; Garau, Alessandra; Isaia, Francesco; Lippolis, Vito; Kivekas, Raikko; Muns, Vincens; Schröder, Martin; Sillanpää, Reijo; Verani, Gaetano","Mixed aza‒thia crowns containing the 1,10-phenanthroline sub-unit. Substitution reactions in [NiL(MeCN)][BF4]2 {L = 2,5,8-trithia[9](2,9)-1,10-phenanthrolinophane} †","Journal of the Chemical Society, Dalton Transactions","1999","","7","1085","","10.1039/a808062c","","","0.71069","MoKα","","0.0718","0.0442","","0.1284","0.1238","","","","1.054","1.176","1.176","","","","","has coordinates,has disorder","179977","2020-10-21","18:00:00",""
"7027145","10.27","0.02","13.5","0.02","18.27","0.02","90","","90.27","0.13","90","","2533","7","220","2","220","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H23 B2 F8 N3 Ni S3 -","- C23 H23 B2 F8 N3 Ni S3 -","- C92 H92 B8 F32 N12 Ni4 S12 -","4","1","","Blake, Alexander J.; Casabò, Jaume; Devillanova, Francesco A.; Escriche, Lluis; Garau, Alessandra; Isaia, Francesco; Lippolis, Vito; Kivekas, Raikko; Muns, Vincens; Schröder, Martin; Sillanpää, Reijo; Verani, Gaetano","Mixed aza‒thia crowns containing the 1,10-phenanthroline sub-unit. Substitution reactions in [NiL(MeCN)][BF4]2 {L = 2,5,8-trithia[9](2,9)-1,10-phenanthrolinophane} †","Journal of the Chemical Society, Dalton Transactions","1999","","7","1085","","10.1039/a808062c","","","0.71073","MoKα","","0.1481","0.1143","","0.3629","0.2975","","","","1.066","1","1","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027146","11.2603","0.0006","11.6778","0.0016","12.0492","0.0014","77.607","0.011","68.151","0.009","77.32","0.011","1419.2","0.3","150","2","150","2","","","","","","","","8","P -1","-P 1","2","","","","- C23 H26 B2 F8 N4 Ni S3 Se -","- C23 H26 B2 F8 N4 Ni S3 Se -","- C46 H52 B4 F16 N8 Ni2 S6 Se2 -","2","1","","Blake, Alexander J.; Casabò, Jaume; Devillanova, Francesco A.; Escriche, Lluis; Garau, Alessandra; Isaia, Francesco; Lippolis, Vito; Kivekas, Raikko; Muns, Vincens; Schröder, Martin; Sillanpää, Reijo; Verani, Gaetano","Mixed aza‒thia crowns containing the 1,10-phenanthroline sub-unit. Substitution reactions in [NiL(MeCN)][BF4]2 {L = 2,5,8-trithia[9](2,9)-1,10-phenanthrolinophane} †","Journal of the Chemical Society, Dalton Transactions","1999","","7","1085","","10.1039/a808062c","","","0.71073","MoKα","","0.0748","0.0446","","","0.1018","0.107","","","","","","0.817","","","","has coordinates,has disorder","179977","2020-10-21","18:00:00",""
"7027147","15.606","0.002","12.2919","0.0006","13.671","0.002","90","","110.749","0.013","90","","2452.4","0.5","150","2","150","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 B F4 N4 Ni O2 S4 -","- C20 H21 B F4 N4 Ni O2 S4 -","- C80 H84 B4 F16 N16 Ni4 O8 S16 -","4","1","","Blake, Alexander J.; Casabò, Jaume; Devillanova, Francesco A.; Escriche, Lluis; Garau, Alessandra; Isaia, Francesco; Lippolis, Vito; Kivekas, Raikko; Muns, Vincens; Schröder, Martin; Sillanpää, Reijo; Verani, Gaetano","Mixed aza‒thia crowns containing the 1,10-phenanthroline sub-unit. Substitution reactions in [NiL(MeCN)][BF4]2 {L = 2,5,8-trithia[9](2,9)-1,10-phenanthrolinophane} †","Journal of the Chemical Society, Dalton Transactions","1999","","7","1085","","10.1039/a808062c","","","0.71073","MoKα","","0.0523","0.0338","","","0.0691","0.0715","","","","","","0.826","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027148","20.064","0.007","21.306","0.008","15.751","0.004","90","","90","","90","","6733","4","293.2","","293.2","","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C28 H34 Cl Fe N7 O7 Pb S -","- C28 H33 Cl Fe N7 O7 Pb S -","- C224 H264 Cl8 Fe8 N56 O56 Pb8 S8 -","8","1","","Furutachi, Hideki; Ishida, Akiko; Miyasaka, Hitoshi; Fukita, Nobuo; Ohba, Masaaki; Ōkawa, Hisashi; Koikawa, Masayuki","FeIIPbII and FeIII complexes of macrocyclic compartmental ligands: different cyclization in stepwise template synthesis using FeII/PbII or FeIII/PbII pairs","Journal of the Chemical Society, Dalton Transactions","1999","","3","367","","10.1039/a808101h","","","0.7107","MoKα","","","0.0402","","","0.057","","","","","1.099","1.099","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027149","9.892","0.003","24.786","0.007","15.5","0.004","90","","95.38","0.02","90","","3783.6","1.9","296.2","","296.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H41 Cl2 Fe N8 O11 S -","- C30 H41 Cl2 Fe N8 O11 S -","- C120 H164 Cl8 Fe4 N32 O44 S4 -","4","1","","Furutachi, Hideki; Ishida, Akiko; Miyasaka, Hitoshi; Fukita, Nobuo; Ohba, Masaaki; Ōkawa, Hisashi; Koikawa, Masayuki","FeIIPbII and FeIII complexes of macrocyclic compartmental ligands: different cyclization in stepwise template synthesis using FeII/PbII or FeIII/PbII pairs","Journal of the Chemical Society, Dalton Transactions","1999","","3","367","","10.1039/a808101h","","","0.7107","MoKα","","","0.0619","","","0.1043","","","","","1.95","1.95","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027150","13.058","0.004","36.961","0.006","13.417","0.002","90","","92.54","0.03","90","","6469","2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H66 Cl17 Cu17 N6 O0 S6 -","- C24 H66 Cl17 Cu17 N6 S6 -","- C96 H264 Cl68 Cu68 N24 S24 -","4","1","","Prichard, Robin G.; Parish, R. V.; Salehi, Zahra","Self-assembling copper(I) clusters involving electron-deficient, quadruply bridging thiolate ligands","Journal of the Chemical Society, Dalton Transactions","1999","","2","243","","10.1039/a808125e","","","0.71073","MoKα","","0.2372","0.1052","","","0.157","0.2101","","","","","","1.26","","","","has coordinates,has disorder","179977","2020-10-21","18:00:00",""
"7027151","22.074","0.004","11.955","0.002","21.039","0.004","90","","115.2","0.02","90","","5023.7","1.8","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C12 H42 Br13 Cu13 N6 O2 S6 -","- C12 H42 Br13 Cu12.946 N6 O1.58 S6 -","- C48 H168 Br52 Cu51.784 N24 O6.32 S24 -","4","1","","Prichard, Robin G.; Parish, R. V.; Salehi, Zahra","Self-assembling copper(I) clusters involving electron-deficient, quadruply bridging thiolate ligands","Journal of the Chemical Society, Dalton Transactions","1999","","2","243","","10.1039/a808125e","","","0.71069","MoKα","","0.1082","0.0867","","","0.1908","0.1965","","","","","","2.276","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027152","7.009","0.003","11.633","0.004","12.838","0.004","109.01","0.02","94.91","0.02","106.07","0.02","933","0.6","110","","110","","","","","","","","?","3","P -1","-P 1","2","","","","- C22 H28 Zr -","- C22 H28 Zr -","- C44 H56 Zr2 -","2","1","","H. Doerrer, Linda; L. H. Green, Malcolm; Häußinger, Daniel; Samßannshausen, Jörg","Evidence for cationic Group 4 zirconocene complexes with intramolecular phenyl co-ordination","Journal of the Chemical Society, Dalton Transactions","1999","","13","2111","","10.1039/a808177h","","","0.71069","MoKα","","","0.0407","","","0.0501","","","","","1.086","1.086","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027153","18.889","0.0008","6.863","0.0003","19.036","0.0005","90","","101.401","0.003","90","","2419.04","0.16","125","","125","","","","","","","","?","3","C 1 2/c 1","-C 2yc","15","","","","- C15 H18 Zr0.5 -","- C15 H18 Zr0.5 -","- C120 H144 Zr4 -","8","1","","H. Doerrer, Linda; L. H. Green, Malcolm; Häußinger, Daniel; Samßannshausen, Jörg","Evidence for cationic Group 4 zirconocene complexes with intramolecular phenyl co-ordination","Journal of the Chemical Society, Dalton Transactions","1999","","13","2111","","10.1039/a808177h","","","0.71069","MoKα","","","0.0403","","","0.0395","","","","","0.9832","0.9832","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027154","13.072","0.002","15.041","0.002","15.622","0.003","103.631","0.013","93.331","0.015","103.126","0.013","2886.7","0.8","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C51 H72 B Cl4 F4 N2 P2 Pt Rh -","- C51 H72 B Cl4 F4 N2 P2 Pt Rh -","- C102 H144 B2 Cl8 F8 N4 P4 Pt2 Rh2 -","2","1","","Polborn, Kurt; Severin, Kay","A facile method for the synthesis of heterobimetallic chloro-bridged complexes containing (R3P)2MCl (M = Pt or Pd) fragments","Journal of the Chemical Society, Dalton Transactions","1999","","5","759","","10.1039/a808210c","","","0.71073","MoKα","","0.0365","0.0304","","0.0859","0.0805","","","","1.101","1.099","1.099","","","","","has coordinates,has disorder","179977","2020-10-21","18:00:00",""
"7027155","13.675","0.002","14.791","0.003","19.451","0.004","90","0.02","104.745","0.015","90","0.02","3804.7","1.3","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C27 H59 B Cl2 F4 P2 Pd Pt -","- C27 H59 B Cl2 F4 P2 Pd Pt -","- C108 H236 B4 Cl8 F16 P8 Pd4 Pt4 -","4","1","","Polborn, Kurt; Severin, Kay","A facile method for the synthesis of heterobimetallic chloro-bridged complexes containing (R3P)2MCl (M = Pt or Pd) fragments","Journal of the Chemical Society, Dalton Transactions","1999","","5","759","","10.1039/a808210c","","","0.71073","MoKα","","0.075","0.052","","0.1426","0.1241","","","","1.162","1.178","1.178","","","","","has coordinates,has disorder","179977","2020-10-21","18:00:00",""
"7027156","6.3013","0.0004","7.8308","0.0007","33.242","0.003","90","","90","","90","","1640.3","0.2","183","2","183","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","2,5-Bis(1-phenylimonoethyl)pyrazine","2,5-Bis(1-phenyliminoethyl)pyrazine","","- C20 H18 N4 -","- C20 H18 N4 -","- C80 H72 N16 -","4","0.5","","Klein, Axel; Kasack, Volker; Reinhardt, Ralf; Sixt, Torsten; Scheiring, Thomas; Zalis, Stanislav; Fiedler, Jan; Kaim, Wolfgang","2,5-Bis(1-phenyliminoethyl)pyrazine (bpip): a conjugated metal–metal bridging acceptor ligand and its homodinuclear complexes with low-valent metal centres","Journal of the Chemical Society, Dalton Transactions","1999","","4","575","","10.1039/a808293f","","","0.71073","MoKα","","0.0756","0.048","","0.1449","0.1201","","","","1.046","1.11","1.11","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027157","13.844","0.003","11.111","0.003","26.604","0.006","90","","105.03","0.02","90","","3952.3","1.7","183","2","183","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","(-2,5-Bis(1-phenyliminoethyl)pyrazine)-di-(bis-triphenylphosphinocopper(I)) tetrafluoroborate","(-2,5-Bis(1-phenyliminoethyl)pyrazine)-di-(bis-triphenylphosphinocopper(I)) tetrafluoroborate","","- C92 H78 B2 Cu2 F8 N4 P4 -","- C92 H78 B2 Cu2 F8 N4 P4 -","- C184 H156 B4 Cu4 F16 N8 P8 -","2","0.5","","Klein, Axel; Kasack, Volker; Reinhardt, Ralf; Sixt, Torsten; Scheiring, Thomas; Zalis, Stanislav; Fiedler, Jan; Kaim, Wolfgang","2,5-Bis(1-phenyliminoethyl)pyrazine (bpip): a conjugated metal–metal bridging acceptor ligand and its homodinuclear complexes with low-valent metal centres","Journal of the Chemical Society, Dalton Transactions","1999","","4","575","","10.1039/a808293f","","","0.71073","MoKα","","0.1025","0.0622","","0.1844","0.1516","","","","1.126","1.21","1.21","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027158","11.759","0.014","14.428","0.016","14.855","0.016","78.131","0.01","88.426","0.01","86.037","0.01","2460","5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C39 H33 Cl I O11 P3 W4 -","- C39.5 H40 Cl I O11 P3 W4 -","- C79 H80 Cl2 I2 O22 P6 W8 -","2","1","","Baker, Paul K.; Drew, Michael G. B.; Meehan, Margaret M.","Cationic linear triphos, L [PhP(CH2CH2PPh2)2], alkyne complexes of molybdenum(II) and tungsten(II); crystal structures of [WI(CO)(L-P,P′,P ″)(η2-MeC2Me)]2[W6O19], [WI(CO)(L-P,P ′,P ″)(η2-MeC2Me)][BPh4] and [MoBr2(O){Ph2P(CH2)2PPh(CH2)2POPh2-P,P ′,O}]","Journal of the Chemical Society, Dalton Transactions","1999","","5","765","","10.1039/a808398c","","","0.7107","MoKα","","0.1637","0.0941","","","0.2219","0.2638","","","","","","1.3","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027159","16.76","0.02","18.88","0.02","20.21","0.02","90","","109.913","0.01","90","","6013","11","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C64 H61 B Cl2 I O P3 W -","- C64 H59 B Cl2 I O P3 W -","- C256 H236 B4 Cl8 I4 O4 P12 W4 -","4","1","","Baker, Paul K.; Drew, Michael G. B.; Meehan, Margaret M.","Cationic linear triphos, L [PhP(CH2CH2PPh2)2], alkyne complexes of molybdenum(II) and tungsten(II); crystal structures of [WI(CO)(L-P,P′,P ″)(η2-MeC2Me)]2[W6O19], [WI(CO)(L-P,P ′,P ″)(η2-MeC2Me)][BPh4] and [MoBr2(O){Ph2P(CH2)2PPh(CH2)2POPh2-P,P ′,O}]","Journal of the Chemical Society, Dalton Transactions","1999","","5","765","","10.1039/a808398c","","","0.71073","MoKα","","0.1149","0.0704","","","0.1981","0.2271","","","","","","1.099","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027160","12.63","0.019","14.308","0.014","18.708","0.019","90","","97.02","0.01","90","","3355","7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H29 Br2 Mo N0 P3 -","- C34 H33 Br2 Mo O2 P3 -","- C136 H132 Br8 Mo4 O8 P12 -","4","1","","Baker, Paul K.; Drew, Michael G. B.; Meehan, Margaret M.","Cationic linear triphos, L [PhP(CH2CH2PPh2)2], alkyne complexes of molybdenum(II) and tungsten(II); crystal structures of [WI(CO)(L-P,P′,P ″)(η2-MeC2Me)]2[W6O19], [WI(CO)(L-P,P ′,P ″)(η2-MeC2Me)][BPh4] and [MoBr2(O){Ph2P(CH2)2PPh(CH2)2POPh2-P,P ′,O}]","Journal of the Chemical Society, Dalton Transactions","1999","","5","765","","10.1039/a808398c","","","0.71073","MoKα","","0.2146","0.1046","","","0.2419","0.3046","","","","","","1.057","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027161","11.2999","0.0007","14.6693","0.0015","18.003","0.002","113.605","0.009","95.52","0.01","103.02","0.007","2605.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H54 Cl2 Cu2 N8 O9 -","- C52 H54 Cl2 Cu2 N8 O9 -","- C104 H108 Cl4 Cu4 N16 O18 -","2","1","","Shu, Mou-Hai; Sun, Wei-Yin; Duan, Chun-Ying; Fu, You-Jun; Zhang, Wen-Jian; Tang, Wen-Xia","The influence of the linkage mode between bipyridine units in oligobipyridine ligands on the formation of copper-(I) and -(II) helicates","Journal of the Chemical Society, Dalton Transactions","1999","","5","729","","10.1039/a808550a","","","0.71073","MoKα","","0.0919","0.0588","","0.1867","0.1528","","","","1.046","1.067","1.067","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027162","11.216","0.003","21.616","0.004","20.795","0.005","90","","95.91","0.02","90","","5015","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H47 Cl3 Cu2 N8 O14 -","- C48 H47 Cl3 Cu2 N8 O14 -","- C192 H188 Cl12 Cu8 N32 O56 -","4","1","","Shu, Mou-Hai; Sun, Wei-Yin; Duan, Chun-Ying; Fu, You-Jun; Zhang, Wen-Jian; Tang, Wen-Xia","The influence of the linkage mode between bipyridine units in oligobipyridine ligands on the formation of copper-(I) and -(II) helicates","Journal of the Chemical Society, Dalton Transactions","1999","","5","729","","10.1039/a808550a","","","0.71073","MoKα","","0.1187","0.0712","","0.1522","0.1319","","","","1.064","1.144","1.144","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027163","10.357","0.002","10.806","0.002","11.689","0.002","101.18","0.01","98.49","0.02","98","0.02","1250.2","0.4","195","2","195","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H11 Au Cl O P -","- C12 H11 Au Cl O P -","- C48 H44 Au4 Cl4 O4 P4 -","4","2","","Hollatz, Christian; Schier, Annette; Riede, Jürgen; Schmidbaur, Hubert","Self-assembly of triatomic gold units as supporting frames for a large gold diphenylphosphinite cage molecule†","Journal of the Chemical Society, Dalton Transactions","1999","","2","111","","10.1039/a808570f","","","0.71073","MoKα","","0.0477","0.0361","","0.1053","0.0918","","","","1.039","1.066","1.066","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027164","15.709","0.001","15.709","0.001","23.705","0.001","90","","90","","120","","5066","0.5","196","2","196","2","","","","","","","","8","P 63/m","-P 6c","176","","","","- C75 H66 Au6 B3 Cl9 F6 O6 P6 -","- C75 H66 Au6 B3 Cl9 F6 O6 P6 -","- C150 H132 Au12 B6 Cl18 F12 O12 P12 -","2","0.166667","","Hollatz, Christian; Schier, Annette; Riede, Jürgen; Schmidbaur, Hubert","Self-assembly of triatomic gold units as supporting frames for a large gold diphenylphosphinite cage molecule†","Journal of the Chemical Society, Dalton Transactions","1999","","2","111","","10.1039/a808570f","","","0.71073","MoKα","","0.0762","0.0363","","0.1413","0.0954","","","","1.038","1.133","1.133","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027165","13.307","0.001","13.305","0.001","16.538","0.002","104.94","0.01","111.67","0.01","102.76","0.01","2460.9","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C23 H32 Cl2 Cu N4 O -","- C23 H32 Cl2 Cu N4 O -","- C92 H128 Cl8 Cu4 N16 O4 -","4","2","","Bernardo, Ma Alexandra; Pina, Fernando; Escuder, Beatriu; García-España, Enrique; Godino-Salido, Ma Luz; Latorre, Julio; Luis, Santiago V.; Ramírez, José A.; Soriano, Conxa","Thermodynamic and fluorescence emission studies on chemosensors containing anthracene fluorophores. Crystal structure of {[CuL1Cl]Cl}2·2H2O [L1 = N-(3-aminopropyl)-N ′-3-(anthracen-9-ylmethyl)aminopropylethane-1,2-diamine]","Journal of the Chemical Society, Dalton Transactions","1999","","6","915","","10.1039/a808649d","","","0.71073","MoKα","","0.1649","0.0885","","0.2667","0.2075","","","","1.812","2.315","2.315","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027166","9.745","0.002","7.913","0.001","6.954","0.001","90","","117.05","0.01","90","","477.58","0.14","296.2","","296.2","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C4 H4 Ag2 O10 Pt -","- C4 Ag2 O10 Pt -","- C8 Ag4 O20 Pt2 -","2","0.25","","Yamaguchi, Tadashi; Yamazaki, Fumie; Ito, Tasuku","A short platinum to silver dative bond and its application in the construction of extended structures: syntheses and structures of Ag2[Pt(ox)2]·2H2O and [Ag(H2O)]2[Ag2(CF3SO3)4][Pt(acac)2]2","Journal of the Chemical Society, Dalton Transactions","1999","","3","273","","10.1039/a808678h","","","0.7107","MoKα","","","0.0241","","","0.0302","","","","","2.335","2.335","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027167","13.039","0.007","12.287","0.003","15","0.003","90","","102.9","0.02","90","","2342.5","1.5","296.2","","296.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H32 Ag4 F12 O22 Pt2 S4 -","- C24 Ag4 F12 O22 Pt2 S4 -","- C48 Ag8 F24 O44 Pt4 S8 -","2","0.5","","Yamaguchi, Tadashi; Yamazaki, Fumie; Ito, Tasuku","A short platinum to silver dative bond and its application in the construction of extended structures: syntheses and structures of Ag2[Pt(ox)2]·2H2O and [Ag(H2O)]2[Ag2(CF3SO3)4][Pt(acac)2]2","Journal of the Chemical Society, Dalton Transactions","1999","","3","273","","10.1039/a808678h","","","0.7107","MoKα","","","0.0455","","","0.037","","","","","1.926","1.926","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027168","7.118","0.001","11.377","0.002","12.616","0.003","70.91","0.03","82.79","0.03","78.15","0.03","943","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","[(aqua)(1,10-phenantroline){2-(hydroxyimino)propanoato (2-)}copper(II)] tetrahydrate","","- C15 H21 Cu N3 O8 -","- C15 H21 Cu N3 O8 -","- C30 H42 Cu2 N6 O16 -","2","1","","Dobosz, Agnieszka; Dudarenko, Nikolai M.; Fritsky, Igor O.; Głowiak, Tadeusz; Karaczyn, Aldona; Kozłowski, Henryk; Sliva, Tatiana Yu.; Świątek-Kozłowska, Jolanta","N-Bonding of the hydroxamic function in nickel(II) and copper(II) complexes with 2-(hydroxyimino)propanohydroxamic acid","Journal of the Chemical Society, Dalton Transactions","1999","","5","743","","10.1039/a808681h","","","0.71073","MoKα","","0.0442","0.0385","","","0.1056","0.1129","","","","","","1.022","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027169","10.876","0.003","16.507","0.005","19.011","0.006","70.302","0.005","82.212","0.005","73.769","0.007","3082","1.6","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H27 B Eu N11 O7 -","- C27 H27 B Eu N11 O7 -","- C108 H108 B4 Eu4 N44 O28 -","4","2","","Reeves, Zoe R.; Mann, Karen L. V.; Jeffery, John C.; McCleverty, Jon A.; Ward, Michael D.; Barigelletti, Francesco; Armaroli, Nicola","Lanthanide complexes of a new sterically hindered potentially hexadentate podand ligand based on a tris(pyrazolyl)borate core; crystal structures, solution structures and luminescence properties","Journal of the Chemical Society, Dalton Transactions","1999","","3","349","","10.1039/a808724e","","","0.71073","MoKα","","0.0924","0.0453","","0.0856","0.0724","","","","0.982","1.047","1.047","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027170","10.87","0.002","16.4827","0.0013","18.996","0.002","70.356","0.007","82.054","0.008","73.9","0.013","3075.8","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H27 B Gd N11 O7 -","- C27 H27 B Gd N11 O7 -","- C108 H108 B4 Gd4 N44 O28 -","4","2","","Reeves, Zoe R.; Mann, Karen L. V.; Jeffery, John C.; McCleverty, Jon A.; Ward, Michael D.; Barigelletti, Francesco; Armaroli, Nicola","Lanthanide complexes of a new sterically hindered potentially hexadentate podand ligand based on a tris(pyrazolyl)borate core; crystal structures, solution structures and luminescence properties","Journal of the Chemical Society, Dalton Transactions","1999","","3","349","","10.1039/a808724e","","","0.71073","MoKα","","0.0301","0.0226","","0.0579","0.0557","","","","0.916","0.971","0.971","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027171","18.588","0.002","16.382","0.0012","11.3938","0.0014","90","","106.099","0.007","90","","3333.4","0.6","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H29 B Cl2 N11 O7 Tb -","- C28 H29 B Cl2 N11 O7 Tb -","- C112 H116 B4 Cl8 N44 O28 Tb4 -","4","1","","Reeves, Zoe R.; Mann, Karen L. V.; Jeffery, John C.; McCleverty, Jon A.; Ward, Michael D.; Barigelletti, Francesco; Armaroli, Nicola","Lanthanide complexes of a new sterically hindered potentially hexadentate podand ligand based on a tris(pyrazolyl)borate core; crystal structures, solution structures and luminescence properties","Journal of the Chemical Society, Dalton Transactions","1999","","3","349","","10.1039/a808724e","","","0.71073","MoKα","","0.0383","0.0259","","0.0591","0.0559","","","","0.97","1.035","1.035","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027172","7.377","0.0001","8.093","0.0001","10.235","0.0001","101.807","0.001","102.801","0.001","98.831","0.001","570.458","0.013","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C4 H13 N3 Ni O6 V2 -","- C4 H13 N3 Ni O6 V2 -","- C8 H26 N6 Ni2 O12 V4 -","2","1","","Zheng, Li-Min; Zhao, Jie-Shou; Lii, Kwang-Hwa; Zhang, Li-Yi; Liu, Yang; Xin, Xin-Quan","One- and two-dimensional materials containing vanadium oxide: structures and magnetic properties of Cu(dien)V2O6·H2O and Ni(dien)V2O6 (dien = diethylenetriamine) †","Journal of the Chemical Society, Dalton Transactions","1999","","6","939","","10.1039/a808839j","","","0.71073","MoKα","","0.038","0.029","","0.0748","0.0696","","","","1.049","1.063","1.063","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027173","8.0144","0.0003","9.7028","0.0004","16.23","0.0007","90","","90","","90","","1262.08","0.09","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C4 H15 Cu N3 O7 V2 -","- C4 H15 Cu N3 O7 V2 -","- C16 H60 Cu4 N12 O28 V8 -","4","1","","Zheng, Li-Min; Zhao, Jie-Shou; Lii, Kwang-Hwa; Zhang, Li-Yi; Liu, Yang; Xin, Xin-Quan","One- and two-dimensional materials containing vanadium oxide: structures and magnetic properties of Cu(dien)V2O6·H2O and Ni(dien)V2O6 (dien = diethylenetriamine) †","Journal of the Chemical Society, Dalton Transactions","1999","","6","939","","10.1039/a808839j","","","0.71073","MoKα","","0.0626","0.0369","","0.0737","0.0649","","","","0.987","1.002","1.002","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027174","10.5","0.004","14.374","0.005","15.037","0.005","108.1","0.02","90.18","0.02","103.26","0.03","2092.9","1.3","220","2","220","2","","","","","","","","6","P -1","-P 1","2","","","","- C33.25 H21.5 Cl4.5 N O14 Ru6 -","- C33 H21 Cl4.5 N O14 Ru6 -","- C66 H42 Cl9 N2 O28 Ru12 -","2","1","","Schooler, Paul; Johnson, Brian F. G.; Parsons, Simon","Synthesis and characterisation of amino and bromo ring substituted derivatives of [Ru6C(CO)14L] (L = [2.2]paracyclophane)","Journal of the Chemical Society, Dalton Transactions","1999","","4","559","","10.1039/a808886a","","","0.71073","MoKα","","0.121","0.0594","","0.1447","0.1194","","","","0.974","1.073","1.073","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027175","10.7076","0.0009","11.361","0.001","9.533","0.001","105.7","0.008","94.633","0.008","76.127","0.007","1083.69","0.18","293.2","","293.2","","","","","","","","-","5","P -1","-P 1","2","","","","- C23 H25 Fe P S2 -","- C23 H25 Fe P S2 -","- C46 H50 Fe2 P2 S4 -","2","1","","St. John Foreman, Mark R.; Slawin, Alexandra M. Z.; Woollins, J. Derek","The reaction of dithiadiphosphetane disulfides with dienes, alkenes and thioaldehydes","Journal of the Chemical Society, Dalton Transactions","1999","","7","1175","","10.1039/a808918c","","","1.5418","CuKα","","","0.0464","","","","0.0412","","","","","","2.23","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027176","7.347","0.002","14.262","0.003","25.66","0.002","90","0.01","95.75","0.01","90","0.02","2675.2","0.9","293.2","","293.2","","","","","","","","-","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H25 Fe2 N P2 S3 -","- C27 H25 Fe2 N P2 S3 -","- C108 H100 Fe8 N4 P8 S12 -","4","1","","St. John Foreman, Mark R.; Slawin, Alexandra M. Z.; Woollins, J. Derek","The reaction of dithiadiphosphetane disulfides with dienes, alkenes and thioaldehydes","Journal of the Chemical Society, Dalton Transactions","1999","","7","1175","","10.1039/a808918c","","","1.5418","CuKα","","0.0596","0.0596","","0.0582","","0.0582","","","2.316","","","2.316","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027177","12.0594","0.0009","18.3884","0.0013","11.6422","0.0008","90","","114.602","0.001","90","","2347.3","0.3","293","2","293","2","","","","","","","-","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H29 Fe P S4 -","- C20 H29 Fe P S4 -","- C80 H116 Fe4 P4 S16 -","4","1","","St. John Foreman, Mark R.; Slawin, Alexandra M. Z.; Woollins, J. Derek","The reaction of dithiadiphosphetane disulfides with dienes, alkenes and thioaldehydes","Journal of the Chemical Society, Dalton Transactions","1999","","7","1175","","10.1039/a808918c","","","0.71073","MoKα","","0.0446","0.0363","","0.0869","0.0766","","","","1.155","1.161","1.161","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027178","11.219","0.002","11.614","0.001","10.977","0.002","107.34","0.01","118.54","0.02","89.35","0.01","1184.6","0.4","293.2","","293.2","","","","","","","","-","5","P -1","-P 1","2","","","","- C24 H21 Fe P S4 -","- C24 H21 Fe P S4 -","- C48 H42 Fe2 P2 S8 -","2","1","","St. John Foreman, Mark R.; Slawin, Alexandra M. Z.; Woollins, J. Derek","The reaction of dithiadiphosphetane disulfides with dienes, alkenes and thioaldehydes","Journal of the Chemical Society, Dalton Transactions","1999","","7","1175","","10.1039/a808918c","","","1.5418","CuKα","","","0.0395","","","","0.0384","","","","","","2.064","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027179","12.232","0.001","14.473","0.002","6.75","0.001","99.56","0.01","92.68","0.01","68.671","0.007","1097.6","0.2","293.2","","293.2","","","","","","","","-","5","P -1","-P 1","2","","","","- C24 H21 Fe P S3 -","- C24 H21 Fe P S3 -","- C48 H42 Fe2 P2 S6 -","2","1","","St. John Foreman, Mark R.; Slawin, Alexandra M. Z.; Woollins, J. Derek","The reaction of dithiadiphosphetane disulfides with dienes, alkenes and thioaldehydes","Journal of the Chemical Society, Dalton Transactions","1999","","7","1175","","10.1039/a808918c","","","1.5418","CuKα","","","0.0351","","","","0.0338","","","","","","1.951","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027180","17.029","0.008","9.523","0.004","11.261","0.005","90","","102.42","0.02","90","","1783.4","1.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H19 Cl3 N2 Pt -","- C14 H19 Cl3 N2 Pt -","- C56 H76 Cl12 N8 Pt4 -","4","1","","Biagini, Marina Cingi; Ferrari, Maura; Lanfranchi, Maurizio; Marchiò, Luciano; Pellinghelli, Maria Angela","Chirality in mononuclear square planar complexes","Journal of the Chemical Society, Dalton Transactions","1999","","10","1575","","10.1039/a808940j","","","0.71073","MoKα","","0.1102","0.0472","","","0.1031","0.1242","","","","","","0.874","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027181","7.453","0.005","7.522","0.005","8.423","0.006","97.36","0.02","114.85","0.02","107.97","0.02","389","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H18 Cl2 N2 Pd -","- C14 H18 Cl2 N2 Pd -","- C14 H18 Cl2 N2 Pd -","1","0.5","","Biagini, Marina Cingi; Ferrari, Maura; Lanfranchi, Maurizio; Marchiò, Luciano; Pellinghelli, Maria Angela","Chirality in mononuclear square planar complexes","Journal of the Chemical Society, Dalton Transactions","1999","","10","1575","","10.1039/a808940j","","","0.71073","MoKα","","0.0547","0.0416","","","0.1012","0.1044","","","","","","0.892","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027182","8.603","0.005","10.786","0.007","8.286","0.005","91.17","0.02","116.37","0.02","91.54","0.02","688.2","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H14 Cl2 N2 Pd -","- C12 H14 Cl2 N2 Pd -","- C24 H28 Cl4 N4 Pd2 -","2","1","","Biagini, Marina Cingi; Ferrari, Maura; Lanfranchi, Maurizio; Marchiò, Luciano; Pellinghelli, Maria Angela","Chirality in mononuclear square planar complexes","Journal of the Chemical Society, Dalton Transactions","1999","","10","1575","","10.1039/a808940j","","","1.54184","CuKα","","0.0648","0.0576","","","0.1577","0.1693","","","","","","1.033","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027183","10.693","0.006","13.656","0.007","11.749","0.006","90","","93.41","0.02","90","","1712.6","1.6","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H18 I2 N2 Pt -","- C14 H18 I2 N2 Pt -","- C56 H72 I8 N8 Pt4 -","4","1","","Biagini, Marina Cingi; Ferrari, Maura; Lanfranchi, Maurizio; Marchiò, Luciano; Pellinghelli, Maria Angela","Chirality in mononuclear square planar complexes","Journal of the Chemical Society, Dalton Transactions","1999","","10","1575","","10.1039/a808940j","","","0.71073","MoKα","","0.0725","0.0455","","","0.1233","0.1315","","","","","","0.983","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027184","7.2131","0.0004","10.595","0.002","11.664","0.004","90","","90","","90","","891.4","0.4","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Dicloro-{3S-(R-methylamino)pyrrolidine}palladium(II)","","- C5 H12 Cl2 N2 Pd -","- C5 H12 Cl2 N2 Pd -","- C20 H48 Cl8 N8 Pd4 -","4","1","","Newman, Paul D.; Hursthouse, Michael B.; Malik, K. M. Abdul","Co-ordination chemistry of 3S-aminopyrrolidine and 3S-(methylamino)pyrrolidine: crystallisation of the two diastereomers of dichloro[3S-(R,S-methylamino)pyrrolidine]palladium(II)","Journal of the Chemical Society, Dalton Transactions","1999","","4","599","","10.1039/a808959k","","","0.71069","MoKα","","0.0234","0.0231","","0.0548","0.0544","","","","0.898","0.897","0.897","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027185","15.023","0.004","16.592","0.004","23.174","0.011","90","","90.78","0.03","90","","5776","3","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C55 H80 Li N4 P3 Si3 -","- C55 H80 Li N4 P3 Si3 -","- C220 H320 Li4 N16 P12 Si12 -","4","1","","Avent, Anthony G.; Bonafoux, Dominique; Eaborn, Colin; Gupta, Sushil K.; Hitchcock, Peter B.; Smith, J. David","Reaction of tris[(diphenylphosphino)dimethylsilyl]methane with molybdenum hexacarbonyl and deprotonation to give a salt with a planar carbanion. Crystal structures of (Ph2PMe2Si)3CH and [Li(tmen)2][C(SiMe2PPh2)3], tmen = N,N,N ′,N ′-tetramethylethane-1,2-diamine","Journal of the Chemical Society, Dalton Transactions","1999","","6","831","","10.1039/a808971j","","","0.71073","MoKα","","0.1887","0.0897","","0.1789","0.1445","","","","1.088","1.269","1.269","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027186","18.314","0.004","10.398","0.003","21.859","0.007","90","","100.61","0.02","90","","4091","2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C43 H49 P3 Si3 -","- C43 H49 P3 Si3 -","- C172 H196 P12 Si12 -","4","1","","Avent, Anthony G.; Bonafoux, Dominique; Eaborn, Colin; Gupta, Sushil K.; Hitchcock, Peter B.; Smith, J. David","Reaction of tris[(diphenylphosphino)dimethylsilyl]methane with molybdenum hexacarbonyl and deprotonation to give a salt with a planar carbanion. Crystal structures of (Ph2PMe2Si)3CH and [Li(tmen)2][C(SiMe2PPh2)3], tmen = N,N,N ′,N ′-tetramethylethane-1,2-diamine","Journal of the Chemical Society, Dalton Transactions","1999","","6","831","","10.1039/a808971j","","","0.71073","MoKα","","0.1045","0.0527","","0.1365","0.1069","","","","0.945","0.943","0.943","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027187","34.12","0.012","24.245","0.007","24.169","0.008","90","","134.21","0.02","90","","14331","9","143","2","143","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C64 H46 Cl3 O9 P3 Pt3 Rh2 -","- C64 H46 Cl3 O9 P3 Pt3 Rh2 -","- C512 H368 Cl24 O72 P24 Pt24 Rh16 -","8","1","","Dolgushin, Fiodor M.; Grachova, Elena V.; Heaton, Brian T.; Iggo, Jonathan A.; Koshevoy, Igor O.; Podkorytov, Ivan S.; Smawfield, Daniel J.; Tunik, Sergey P.; Whyman, Robin; Yanovskii, Aleksandr I.","Synthesis and structural characterisation of the mixed metal clusters [Rh2Pt3(μ-CO)5(CO)4(PPh3)3] and [Rh2Pt2(μ-CO)3(CO)4(PPh3)3]; crystal structure of [Rh2Pt3(μ-CO)5(CO)4(PPh3)3] †","Journal of the Chemical Society, Dalton Transactions","1999","","10","1609","","10.1039/a809118h","","","0.71073","MoKα","","0.132","0.0621","","0.1684","0.1354","","","","0.96","1.096","1.096","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027188","12.0751","0.0003","12.4215","0.0003","16.7708","0.0001","85.288","0.002","81.273","0.001","67.557","0.001","2297.22","0.08","293","2","293","2","","","","","","","","3","P -1","-P 1","2","L","1,3,5-tris(bis(pyrid-2-ylmethyl)amino)methyl-2,4,6- triethyl-benzene","","- C51 H57 N9 -","- C51 H57 N9 -","- C102 H114 N18 -","2","1","","Walsdorff, Christian; Park, Sunyoung; Kim, Jeongho; Heo, Jungseok; Park, Ki-Min; Oh, Jinho; Kim, Kimoon","Co-ordination chemistry of CuI with 1,3,5-tris[bis(pyridin-2-ylmethyl)aminomethyl]-2,4,6-triethylbenzene, a conformationally constrained trinucleating ligand","Journal of the Chemical Society, Dalton Transactions","1999","","6","923","","10.1039/a809179j","","","0.71073","MoKα","","0.151","0.0748","","0.2783","0.2058","","","","0.902","1.022","1.022","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027189","16.6703","0.0004","14.0313","0.0004","22.9276","0.0005","90","","104.948","0.001","90","","5181.4","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","L(CuI)3","","","- C51 H57 Cu3 I3 N9 -","- C51 H57 Cu3 I3 N9 -","- C204 H228 Cu12 I12 N36 -","4","1","","Walsdorff, Christian; Park, Sunyoung; Kim, Jeongho; Heo, Jungseok; Park, Ki-Min; Oh, Jinho; Kim, Kimoon","Co-ordination chemistry of CuI with 1,3,5-tris[bis(pyridin-2-ylmethyl)aminomethyl]-2,4,6-triethylbenzene, a conformationally constrained trinucleating ligand","Journal of the Chemical Society, Dalton Transactions","1999","","6","923","","10.1039/a809179j","","","0.71073","MoKα","","0.0922","0.0433","","0.099","0.079","","","","1.044","1.077","1.077","","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027190","16.3631","0.0002","17.4425","0.0002","17.7148","0.0001","71.31","","77.771","0.001","68.974","0.001","4443.63","0.08","188","2","188","2","","","","","","","","7","P -1","-P 1","2","[L(CuNCMe)3](PF6)3-7CH2Cl2","","","- C64 H80 Cl14 Cu3 F18 N12 P3 -","- C64 H80 Cl14 Cu3 F18 N12 P3 -","- C128 H160 Cl28 Cu6 F36 N24 P6 -","2","1","","Walsdorff, Christian; Park, Sunyoung; Kim, Jeongho; Heo, Jungseok; Park, Ki-Min; Oh, Jinho; Kim, Kimoon","Co-ordination chemistry of CuI with 1,3,5-tris[bis(pyridin-2-ylmethyl)aminomethyl]-2,4,6-triethylbenzene, a conformationally constrained trinucleating ligand","Journal of the Chemical Society, Dalton Transactions","1999","","6","923","","10.1039/a809179j","","","0.71073","MoKα","","0.0749","0.0662","","","0.1819","0.1936","","","","","","1.049","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027191","13.737","0.0003","14.5407","0.0003","16.7511","0.0003","65.871","0.001","83.257","0.001","88.697","0.001","3031.31","0.11","188","2","188","2","","","","","","","","6","P -1","-P 1","2","[LCu3Cl(ClO4)2]ClO4-2CH2Cl2","","","- C53 H61 Cl8 Cu3 N9 O12 -","- C53 H61 Cl8 Cu3 N9 O12 -","- C106 H122 Cl16 Cu6 N18 O24 -","2","1","","Walsdorff, Christian; Park, Sunyoung; Kim, Jeongho; Heo, Jungseok; Park, Ki-Min; Oh, Jinho; Kim, Kimoon","Co-ordination chemistry of CuI with 1,3,5-tris[bis(pyridin-2-ylmethyl)aminomethyl]-2,4,6-triethylbenzene, a conformationally constrained trinucleating ligand","Journal of the Chemical Society, Dalton Transactions","1999","","6","923","","10.1039/a809179j","","","0.71073","MoKα","","0.0698","0.0529","","","0.12","0.1335","","","","","","1.135","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027192","10.034","0.004","27.69","0.03","19.83","0.02","90","","92.45","0.05","90","","5505","8","188","2","188","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","[LCu2](BF4)2-CH2Cl2","","","- C52 H59 B2 Cl2 Cu2 F8 N9 -","- C52 H59 B2 Cl2 Cu2 F8 N9 -","- C208 H236 B8 Cl8 Cu8 F32 N36 -","4","1","","Walsdorff, Christian; Park, Sunyoung; Kim, Jeongho; Heo, Jungseok; Park, Ki-Min; Oh, Jinho; Kim, Kimoon","Co-ordination chemistry of CuI with 1,3,5-tris[bis(pyridin-2-ylmethyl)aminomethyl]-2,4,6-triethylbenzene, a conformationally constrained trinucleating ligand","Journal of the Chemical Society, Dalton Transactions","1999","","6","923","","10.1039/a809179j","","","0.71073","MoKα","","0.13","0.0783","","","0.1368","0.1602","","","","","","1.181","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027193","16.5648","0.0011","16.5648","0.0011","5.3351","0.0004","90","","90","","120","","1267.78","0.15","296","2","296","2","","","","","","","","3","R 3 :H","R 3","146","TriBr","1,3,5-Tris(bromomethyl)-2,4,6-triethylbenzene","","- C15 H21 Br3 -","- C15 H21 Br3 -","- C45 H63 Br9 -","3","0.333333","","Walsdorff, Christian; Park, Sunyoung; Kim, Jeongho; Heo, Jungseok; Park, Ki-Min; Oh, Jinho; Kim, Kimoon","Co-ordination chemistry of CuI with 1,3,5-tris[bis(pyridin-2-ylmethyl)aminomethyl]-2,4,6-triethylbenzene, a conformationally constrained trinucleating ligand","Journal of the Chemical Society, Dalton Transactions","1999","","6","923","","10.1039/a809179j","","","0.71073","MoKα","","0.029","0.0282","","","0.0678","0.0689","","","","","","1.056","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027194","20.43","0.003","21.288","0.003","14.4499","0.0019","90","","92.371","0.012","90","","6279.1","1.5","223","2","223","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Bis[2,6-bis-(3-{2,4,6-trimethylphenyl}pyrazol-1-yl)pyridine]dicopper(I) ditetrafluoroborate diacetone solvate","","- C64 H70 B2 Cu2 F8 N10 O2 -","- C64 H70 B2 Cu2 F8 N10 O2 -","- C256 H280 B8 Cu8 F32 N40 O8 -","4","0.5","","Solanki, Nayan K.; Wheatley, Andrew E. H.; Radojevic, Sanja; McPartlin, Mary; Halcrow, Malcolm A.","Structural variations in dicopper(I) double helicate complexes","Journal of the Chemical Society, Dalton Transactions","1999","","4","521","","10.1039/a809237k","","","0.71073","MoKα","","0.1018","0.0608","","","0.1559","0.1916","","","","","","0.969","","","","has coordinates","179977","2020-10-21","18:00:00",""
"7027195","20.732","0.005","12.235","0.002","9.238","0.005","90","","95.35","0.02","90","","2333.1","1.4","223","2","223","2","","","","","","","","6","C 1 2 1","C 2y","5","","Bis[2,6-bis-(3-tert-butylpyrazol-1-yl)pyridine]dicopper(I) dihexafluorophosphate","","- C38 H50 Cu2 F12 N10 P2 -","- C38 H50 Cu2 F12 N10 P2 -","- C76 H100 Cu4 F24 N20 P4 -","2","0.5","","Solanki, Nayan K.; Wheatley, Andrew E. H.; Radojevic, Sanja; McPartlin, Mary; Halcrow, Malcolm A.","Structural variations in dicopper(I) double helicate complexes","Journal of the Chemical Society, Dalton Transactions","1999","","4","521","","10.1039/a809237k","","","0.71073","MoKα","","0.0653","0.0498","","0.1321","0.1217","","","","1.055","1.081","1.081","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027196","12.29","0.02","13.49","0.03","15","0.01","90","","95.11","0.1","90","","2477","7","294.2","","294","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C44 H53 Au Cl2 N8 O6 P4 -","- C44 H40 Au Cl2 N8 O6 P4 -","- C88 H80 Au2 Cl4 N16 O12 P8 -","2","1","","Berners-Price, Susan J.; Bowen, Richard J.; Hambley, Trevor W.; Healy, Peter C.","NMR and structural studies of gold(I) chloride adducts with bidentate 2-, 3- and 4-pyridyl phosphines","Journal of the Chemical Society, Dalton Transactions","1999","","8","1337","","10.1039/a809285k","","","0.71069","MoKalpha","","","0.078","","","0.09","","","","","3.21","3.21","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027197","22.519","0.005","17.937","0.006","26.565","0.007","90","","90","","90","","10730","5","294.2","","294.2","","","","","","","","","7","P b c n","-P 2n 2ab","60","","","","- C88 H108 Au2 Cl2 N16 O14 P8 -","- C88 H80 Au2 N16 O19 P8 -","- C352 H320 Au8 N64 O76 P32 -","4","0.5","","Berners-Price, Susan J.; Bowen, Richard J.; Hambley, Trevor W.; Healy, Peter C.","NMR and structural studies of gold(I) chloride adducts with bidentate 2-, 3- and 4-pyridyl phosphines","Journal of the Chemical Society, Dalton Transactions","1999","","8","1337","","10.1039/a809285k","","","1.5418","CuKα","","","0.07","","","","0.086","","","","","","3.04","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027198","8.04","0.003","8.04","","43.73","0.004","90","","90","","120","","2448.1","0.9","296.2","","296.2","","","","","","","","","5","P 65","P 65","170","","[(1,1,1-tris(4-amino-1-oxo-2-azabutyl)ethane)cobalt(III)] trihydrate","","- C11 H27 Co N6 O6 -","- C11 H27 Co N6 O6 -","- C66 H162 Co6 N36 O36 -","6","1","","Angus, Patricia M.; Elliott, Anthony J.; Sargeson, Alan M.; Willis, Anthony C.","Synthesis and properties of cobalt(III) complexes of tripodal ligands containing amide functional groups","Journal of the Chemical Society, Dalton Transactions","1999","","7","1131","","10.1039/a809316d","","","1.5418","CuKα","","","0.027","","","","0.029","","","","","","1.72","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027199","9.0263","0.0014","10.4338","0.0016","17.2896","0.0024","88.912","0.017","85.958","0.018","77.907","0.018","1588.2","0.4","180","2","180","2","","","","","","","synthetic route","8","P -1","-P 1","2","","","","- C29 H32 B Cl3 N6 O P Rh -","- C29 H32 B Cl3 N6 O P Rh -","- C58 H64 B2 Cl6 N12 O2 P2 Rh2 -","2","1","","Malbosc, François; Kalck, Philippe; Daran, Jean-Claude; Etienne, Michel","An unprecedented κ2N,H bonding mode for a hydridotris(pyrazolyl)borato ligand","Journal of the Chemical Society, Dalton Transactions","1999","","3","271","","10.1039/a809323g","","","0.71073","MoKα","","","0.0237","","","0.0273","","","","","1.0742","1.0742","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027200","11.1644","0.0019","12.0058","0.0019","17.097","0.003","101.073","0.018","102.282","0.019","92.46","0.019","2189.1","0.7","180","2","180","2","","","","","","","synthetic route","8","P -1","-P 1","2","","","","- C42 H45 B Cl3 N6 O P2 Rh -","- C42 H45 B Cl3 N6 O P2 Rh -","- C84 H90 B2 Cl6 N12 O2 P4 Rh2 -","2","1","","Malbosc, François; Kalck, Philippe; Daran, Jean-Claude; Etienne, Michel","An unprecedented κ2N,H bonding mode for a hydridotris(pyrazolyl)borato ligand","Journal of the Chemical Society, Dalton Transactions","1999","","3","271","","10.1039/a809323g","","","0.71073","MoKα","","","0.0407","","","0.0425","","","","","1.0112","1.0112","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027201","7.8304","0.0013","11.288","0.002","11.375","0.002","109.08","0.02","95.29","0.02","103.41","0.02","908.7","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","(Me~3~TTF-CH~2~OH)~2~ Mo~6~O~19~","","","- C20 H24 Mo6 O21 S8 -","- C20 Mo6 O21.04 S8 -","- C20 Mo6 O21.04 S8 -","1","0.5","","Dolbecq, Anne; Guirauden, Aude; Fourmigué, Marc; Boubekeur, Kamal; Batail, Patrick; Rohmer, Marie-Madeleine; Bénard, Marc; Coulon, Claude; Sallé, Marc; Blanchard, Philippe","Relative basicities of the oxygen atoms of the Linquist polyoxometalate [Mo6O19]2− and their recognition by hydroxyl groups in radical cation salts based on functionalized tetrathiafulvalene π donors","Journal of the Chemical Society, Dalton Transactions","1999","","8","1241","","10.1039/a809442j","","","0.71073","MoKα","","0.0339","0.026","","0.0797","0.0669","","","","1.036","1.051","1.051","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027202","20.654","0.002","11.5411","0.0008","17.11","0.0012","90","","101.342","0.009","90","","3998.9","0.6","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Bis[3,4-(ethylenedithio)-3'-4'-bis(hydroxymethyl)-tetrathiafulvalene] nonadecaoxohexamolybdate(VI)","","- C20 H20 Mo6 O23 S12 -","- C20 H12 Mo6 O23 S12 -","- C80 H48 Mo24 O92 S48 -","4","1","","Dolbecq, Anne; Guirauden, Aude; Fourmigué, Marc; Boubekeur, Kamal; Batail, Patrick; Rohmer, Marie-Madeleine; Bénard, Marc; Coulon, Claude; Sallé, Marc; Blanchard, Philippe","Relative basicities of the oxygen atoms of the Linquist polyoxometalate [Mo6O19]2− and their recognition by hydroxyl groups in radical cation salts based on functionalized tetrathiafulvalene π donors","Journal of the Chemical Society, Dalton Transactions","1999","","8","1241","","10.1039/a809442j","","","0.71073","MoKα","","0.0754","0.0637","","0.1335","0.1292","","","","1.292","1.376","1.376","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027203","8.668","0.002","10.862","0.002","11.478","0.002","69.58","0.03","83.28","0.03","77","0.03","985.9","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","[TTF(CH~2~OH)~4~]^2^Mo~6~O~19~","Bis[tetrakis-3,4,3',4'-(hydroxymethyl)tetrathiafulvalenium] nonadecaoxohexamolybdate(VI)","","- C20 H24 Mo6 O27 S8 -","- C20 H24 Mo6 O27 S8 -","- C20 H24 Mo6 O27 S8 -","1","0.5","","Dolbecq, Anne; Guirauden, Aude; Fourmigué, Marc; Boubekeur, Kamal; Batail, Patrick; Rohmer, Marie-Madeleine; Bénard, Marc; Coulon, Claude; Sallé, Marc; Blanchard, Philippe","Relative basicities of the oxygen atoms of the Linquist polyoxometalate [Mo6O19]2− and their recognition by hydroxyl groups in radical cation salts based on functionalized tetrathiafulvalene π donors","Journal of the Chemical Society, Dalton Transactions","1999","","8","1241","","10.1039/a809442j","","","0.71073","MoKα","","0.0445","0.0247","","0.0446","0.0403","","","","0.89","0.962","0.962","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027204","13.036","0.0011","16.1964","0.0014","9.749","0.0009","90","","97.117","0.003","90","","2042.5","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H56 N8 O4 -","- C44 H56 N8 O4 -","- C88 H112 N16 O8 -","2","0.5","","Zucchi, Gaël; Scopelliti, Rosario; Pittet, Pierre-André; Bünzli, Jean-Claude G.; Rogers, Robin D.","Structural and photophysical behaviour of lanthanide complexes with a tetraazacyclododecane featuring carbamoyl pendant arms †","Journal of the Chemical Society, Dalton Transactions","1999","","6","931","","10.1039/a809459d","","","0.71073","MoKα","","0.1815","0.0733","","0.1732","0.1174","","","","1.027","1.183","1.183","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027205","7.0787","0.0016","16.833","0.005","13.573","0.005","90","","115.21","0.02","90","","1463.3","0.8","150","","150","","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H12 N3 O3 V -","- C18 H12 N3 O3 V -","- C72 H48 N12 O12 V4 -","4","1","","Ligtenbarg, Alette G. J.; Spek, Anthony L.; Hage, Ronald; Feringa, Ben L.","Vanadium(V) complexes based on a bis(pyridine)-imine ligand (HL); synthesis and crystal structure of a dioxovanadium(V) complex involving a ligand cyclisation","Journal of the Chemical Society, Dalton Transactions","1999","","5","659","","10.1039/a809476d","","","0.71073","MoKα","","0.0992","0.0579","","","0.1237","0.1415","","","","","","1.017","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027206","16.157","0.001","21.204","0.001","23.912","0.001","90","","92.731","0.002","90","","8182.8","0.7","100","","100","","","","","","","","?","7","P 1 21/c 1","-P 2ybc","14","","","","- C78 H56 B3 F45 N2 O4 W -","- C78 H56 B3 F45 N2 O4 W -","- C312 H224 B12 F180 N8 O16 W4 -","4","1","","Barrado, Georgina; Doerrer, Linda; Green, Malcolm L. H.; Leech, Michael A.","Adducts of the Lewis acid [B(C6F5)3] with transition metal oxo compounds","Journal of the Chemical Society, Dalton Transactions","1999","","7","1061","","10.1039/a809519a","","","0.71069","MoKα","","","0.0303","","","0.0301","","","","","1.0941","1.0941","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027207","11.3","0.001","9.585","0.001","20.596","0.001","90","","90.648","0.002","90","","2230.6","0.3","150","","150","","","","","","","","?","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H5 B F15 O3 Re -","- C23 H5 B F15 O3 Re -","- C92 H20 B4 F60 O12 Re4 -","4","1","","Barrado, Georgina; Doerrer, Linda; Green, Malcolm L. H.; Leech, Michael A.","Adducts of the Lewis acid [B(C6F5)3] with transition metal oxo compounds","Journal of the Chemical Society, Dalton Transactions","1999","","7","1061","","10.1039/a809519a","","","0.71069","MoKα","","","0.0346","","","0.0362","","","","","1.1246","1.1246","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027208","13.289","0.001","14.028","0.001","18.27","0.001","90","","110.256","0.003","90","","3195.2","0.4","100","","100","","","","","","","","?","8","P 1 21 1","P 2yb","4","","","","- C28 H23 B Cl2 F15 N3 O3 W -","- C28 H23 B Cl2 F15 N3 O3 W -","- C112 H92 B4 Cl8 F60 N12 O12 W4 -","4","2","","Barrado, Georgina; Doerrer, Linda; Green, Malcolm L. H.; Leech, Michael A.","Adducts of the Lewis acid [B(C6F5)3] with transition metal oxo compounds","Journal of the Chemical Society, Dalton Transactions","1999","","7","1061","","10.1039/a809519a","","","0.71069","MoKα","","","0.0189","","","0.022","","","","","1.0705","1.0705","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027209","7.232","0.004","16.96","0.003","11.95","0.003","90","","94.65","0.03","90","","1460.9","0.9","288.2","","288.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 Fe N10 O2 S2 -","- C24 H22 Fe0.5 N10 O2 S2 -","- C48 H44 Fe N20 O4 S4 -","2","0.5","","Noro, Shin-ichiro; Kondo, Mitsuru; Ishii, Tomohiko; Kitagawa, Susumu; Matsuzaka, Hiroyuki","Syntheses and crystal structures of iron co-ordination polymers with 4,4′-bipyridine (4,4′-bpy) and 4,4′-azopyridine (azpy). Two-dimensional networks supported by hydrogen bonding, {[Fe(azpy)(NCS)2(MeOH)2]·azpy}n and {[Fe(4,4′-bpy)(NCS)2(H2O)2]·4,4′-bpy}n","Journal of the Chemical Society, Dalton Transactions","1999","","10","1569","","10.1039/a809523j","","","0.7107","MoKα","","","0.0634","","","0.0638","","","","","1.423","1.423","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027210","9.017","0.001","10.222","0.001","7.489","0.001","104.318","0.009","96.65","0.01","107.454","0.01","624.42","0.14","288.2","","288.2","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H20 Fe N6 O2 S2 -","- C22 H20 Fe0.5 N6 O2 S2 -","- C22 H20 Fe0.5 N6 O2 S2 -","1","0.5","","Noro, Shin-ichiro; Kondo, Mitsuru; Ishii, Tomohiko; Kitagawa, Susumu; Matsuzaka, Hiroyuki","Syntheses and crystal structures of iron co-ordination polymers with 4,4′-bipyridine (4,4′-bpy) and 4,4′-azopyridine (azpy). Two-dimensional networks supported by hydrogen bonding, {[Fe(azpy)(NCS)2(MeOH)2]·azpy}n and {[Fe(4,4′-bpy)(NCS)2(H2O)2]·4,4′-bpy}n","Journal of the Chemical Society, Dalton Transactions","1999","","10","1569","","10.1039/a809523j","","","0.7107","MoKα","","","0.0467","","","0.0541","","","","","2.036","2.036","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027211","8.7678","0.001","8.9525","0.0009","9.8668","0.0008","104.034","0.008","113.016","0.008","99.226","0.009","662.72","0.13","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","trans-bis(N-benzoyl-N'-propylthioureato)dibromopalladium(II)","","- C22 H28 Br2 N4 O2 Pd S2 -","- C22 H28 Br2 N4 O2 Pd S2 -","- C22 H28 Br2 N4 O2 Pd S2 -","1","0.5","","Koch, Klaus R.; Wang, Yali; Coetzee, Anita","Platinum(II) and palladium(II) complexes of N-benzoyl-N ′-propylthiourea (H2L): synthesis and geometric isomer distribution of [M(H2L-S )2X2] (M = PtII or PdII; X = Cl−, Br− or I−); crystal structure of trans-[Pd(H2L-S )2Br2]","Journal of the Chemical Society, Dalton Transactions","1999","","6","1013","","10.1039/a809543d","","","0.71069","MoKα","","0.0306","0.0254","","","0.0724","0.074","","","","","","1.093","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027212","9.4901","0.0019","10.4479","0.0016","18.623","0.0013","74.544","0.009","79.718","0.006","80.364","0.009","1737.1","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H34 N2 O4 P2 Pd -","- C38 H34 N2 O4 P2 Pd -","- C76 H68 N4 O8 P4 Pd2 -","2","1","","Dervisi, Athanasia; Edwards, Peter G.; Newman, Paul D.; Tooze, Robert P.; Coles, Simon J.; Hursthouse, Michael B.","Comments on the catalytic alkoxycarbonylation of alkynes","Journal of the Chemical Society, Dalton Transactions","1999","","7","1113","","10.1039/a809624d","","","0.71069","MoKα","","0.0525","0.0375","","","0.079","0.0813","","","","","","0.852","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027213","18.084","0.009","15.609","0.008","24.354","0.002","90","","110.63","0.01","90","","6434","5","150","2","150","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C36 H30 Cl N2 O2 P2 Pd -","- C36 H31 Cl N2 O2 P2 Pd -","- C288 H248 Cl8 N16 O16 P16 Pd8 -","8","1","","Dervisi, Athanasia; Edwards, Peter G.; Newman, Paul D.; Tooze, Robert P.; Coles, Simon J.; Hursthouse, Michael B.","Comments on the catalytic alkoxycarbonylation of alkynes","Journal of the Chemical Society, Dalton Transactions","1999","","7","1113","","10.1039/a809624d","","","0.71069","MoKα","","0.0634","0.04","","","0.091","0.0947","","","","","","0.862","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027214","11.557","0.004","20.895","0.002","15.5579","0.0007","90","","92.767","0.01","90","","3752.6","1.4","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C42 H37 F3 N2 O2 P2 Pd -","- C42 H37 F3 N2 O2 P2 Pd -","- C168 H148 F12 N8 O8 P8 Pd4 -","4","1","","Dervisi, Athanasia; Edwards, Peter G.; Newman, Paul D.; Tooze, Robert P.; Coles, Simon J.; Hursthouse, Michael B.","Comments on the catalytic alkoxycarbonylation of alkynes","Journal of the Chemical Society, Dalton Transactions","1999","","7","1113","","10.1039/a809624d","","","0.71069","MoKα","","0.0533","0.0339","","0.0651","0.063","","","","0.834","0.979","0.979","","","","","has coordinates,has disorder","179978","2020-10-21","18:00:00",""
"7027215","13.103","0.006","8.238","0.004","16.808","0.005","90","","100.21","0.04","90","","1785.6","1.3","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 Cl3 N3 Rh -","- C16 H17 Cl3 N3 Rh -","- C64 H68 Cl12 N12 Rh4 -","4","1","","Bradd, Kerry J.; Heaton, Brian T.; Jacob, Chacko; Sampanthar, Jeyagowry T.; Steiner, Alexander","Oxidative addition of chlorinated solvents (e.g. CH2Cl2 and CHCl3) with rhodium(I) complexes; crystal structure of mer-[Rh(py)3(CH2Cl)Cl2]","Journal of the Chemical Society, Dalton Transactions","1999","","7","1109","","10.1039/a809652j","","","0.71073","MoKα","","0.0897","0.0684","","","0.1658","0.1876","","","","","","1.103","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027216","7.789","0.001","7.329","0.001","7.957","0.001","90","","118.65","0.01","90","","398.62","0.1","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","sodium-cobalt methylene diphosphonate","Na3Co(O3PCH2PO3)(OH)","","- C H3 Co Na3 O7 P2 -","- C H3 Co Na3 O7 P2 -","- C2 H6 Co2 Na6 O14 P4 -","2","0.5","","Distler, Anne; Lohse, Douglas L.; Sevov, Slavi C.","Chains, planes, and tunnels of metal diphosphonates: synthesis, structure, and characterization of Na3Co(O3PCH2PO3)(OH), Na3Mg(O3PCH2PO3)F·H2O, Na2Co(O3PCH2PO3)·H2O, NaCo2(O3PCH2CH2CH2PO3)(OH), and Co2(O3PCH2PO3)(H2O)","Journal of the Chemical Society, Dalton Transactions","1999","","11","1805","","10.1039/a809671f","","","0.71073","MoKα","","0.0724","0.0444","","0.1175","0.0978","","","","1.182","1.174","1.174","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027217","7.996","0.002","7.1516","0.0007","8.1","0.002","90","","118.73","0.01","90","","406.17","0.15","293","2","293","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","sodium-magnesium methylene diphosphonate","Na3Mg(O3PCH2PO3)(F)*2H2O","","- C H4 F Mg Na3 O7 P2 -","- C H4 F Mg Na3 O7 P2 -","- C2 H8 F2 Mg2 Na6 O14 P4 -","2","0.5","","Distler, Anne; Lohse, Douglas L.; Sevov, Slavi C.","Chains, planes, and tunnels of metal diphosphonates: synthesis, structure, and characterization of Na3Co(O3PCH2PO3)(OH), Na3Mg(O3PCH2PO3)F·H2O, Na2Co(O3PCH2PO3)·H2O, NaCo2(O3PCH2CH2CH2PO3)(OH), and Co2(O3PCH2PO3)(H2O)","Journal of the Chemical Society, Dalton Transactions","1999","","11","1805","","10.1039/a809671f","","","0.71073","MoKα","","0.0634","0.0402","","0.0998","0.0886","","","","1.014","1.081","1.081","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027218","8.997","0.001","10.348","0.002","16.26","0.003","90","","90","","90","","1513.8","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","sodium-cobalt methylene diphosphonate","Na2Co(O3PCH2PO3)*(H2O)","","- C H4 Co Na2 O7 P2 -","- C H4 Co Na2 O7 P2 -","- C8 H32 Co8 Na16 O56 P16 -","8","2","","Distler, Anne; Lohse, Douglas L.; Sevov, Slavi C.","Chains, planes, and tunnels of metal diphosphonates: synthesis, structure, and characterization of Na3Co(O3PCH2PO3)(OH), Na3Mg(O3PCH2PO3)F·H2O, Na2Co(O3PCH2PO3)·H2O, NaCo2(O3PCH2CH2CH2PO3)(OH), and Co2(O3PCH2PO3)(H2O)","Journal of the Chemical Society, Dalton Transactions","1999","","11","1805","","10.1039/a809671f","","","0.71073","MoKα","","0.026","0.0228","","0.0627","0.0593","","","","1.077","1.065","1.065","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027219","6.123","0.001","16.634","0.003","18.78","0.004","90","","90","","90","","1912.7","0.6","293","2","293","2","","","","","","","","6","C m c m","-C 2c 2","63","sodium-cobalt propylene diphosphonate","NaCo2(O3PCH2CH2CH2PO3)(OH)","","- C3 H7 Co2 Na O7 P2 -","- C3 H7 Co2 Na O7 P2 -","- C24 H56 Co16 Na8 O56 P16 -","8","0.5","","Distler, Anne; Lohse, Douglas L.; Sevov, Slavi C.","Chains, planes, and tunnels of metal diphosphonates: synthesis, structure, and characterization of Na3Co(O3PCH2PO3)(OH), Na3Mg(O3PCH2PO3)F·H2O, Na2Co(O3PCH2PO3)·H2O, NaCo2(O3PCH2CH2CH2PO3)(OH), and Co2(O3PCH2PO3)(H2O)","Journal of the Chemical Society, Dalton Transactions","1999","","11","1805","","10.1039/a809671f","","","0.71073","MoKα","","0.1122","0.0608","","0.1467","0.1121","","","","1.097","1.083","1.083","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027220","18.82","0.004","8.246","0.002","8.916","0.002","90","","106.68","0.03","90","","1325.5","0.6","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Cobalt Methylene Diphosphonate Monohydrate","Co2(O3P-CH2-PO3).H2O","","- C H4 Co2 O7 P2 -","- C H4 Co2 O7 P2 -","- C8 H32 Co16 O56 P16 -","8","1","","Distler, Anne; Lohse, Douglas L.; Sevov, Slavi C.","Chains, planes, and tunnels of metal diphosphonates: synthesis, structure, and characterization of Na3Co(O3PCH2PO3)(OH), Na3Mg(O3PCH2PO3)F·H2O, Na2Co(O3PCH2PO3)·H2O, NaCo2(O3PCH2CH2CH2PO3)(OH), and Co2(O3PCH2PO3)(H2O)","Journal of the Chemical Society, Dalton Transactions","1999","","11","1805","","10.1039/a809671f","","","0.71073","MoKα","","0.0684","0.0456","","0.1158","0.1028","","","","1.11","1.134","1.134","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027221","12.5572","0.0013","13.7113","0.0013","19.494","0.002","99.835","0.008","87.427","0.008","107.024","0.008","3162.1","0.6","293","2","293","1","","","","","","","","6","P -1","-P 1","2","","","","- C47 H77 Fe4 Mo N4 S10 -","- C47 H59 Fe4 Mo N4 S10 -","- C94 H118 Fe8 Mo2 N8 S20 -","2","1","","Barrière, Frédéric; Evans, David J.; Hughes, David L.; Ibrahim, Saad K.; Talarmin, Jean; Pickett, Christopher J.","Exo-iron centres linked to MoFeS clusters","Journal of the Chemical Society, Dalton Transactions","1999","","6","957","","10.1039/a809710k","","","0.71069","MoKα","","0.0641","0.0413","","0.1179","0.1013","","","","1.072","1.107","1.107","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027222","9.759","0.001","11.362","0.002","27.183","0.003","90","","99.35","0.01","90","","2974.1","0.7","195","2","195","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C5 H9 Au F3 O2 P -","- C5 H9 Au F3 O2 P -","- C60 H108 Au12 F36 O24 P12 -","12","3","","Preisenberger, Max; Schier, Annette; Schmidbaur, Hubert","(Phosphine)gold(I) trifluoromethanesulfonates, trifluoroacetates and trichlorothioacetates †","Journal of the Chemical Society, Dalton Transactions","1999","","10","1645","","10.1039/a809714c","","","0.71073","MoKα","","0.1348","0.0656","","0.2043","0.1687","","","","1.075","1.182","1.182","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027223","10.637","0.001","11.303","0.001","11.785","0.001","67.8","0.01","81.99","0.01","76.01","0.01","1271.1","0.2","193","2","193","2","","","","","","","","8","P -1","-P 1","2","","","","- C23 H23 Au Cl2 F3 O3 P S -","- C23 H23 Au Cl2 F3 O3 P S -","- C46 H46 Au2 Cl4 F6 O6 P2 S2 -","2","1","","Preisenberger, Max; Schier, Annette; Schmidbaur, Hubert","(Phosphine)gold(I) trifluoromethanesulfonates, trifluoroacetates and trichlorothioacetates †","Journal of the Chemical Society, Dalton Transactions","1999","","10","1645","","10.1039/a809714c","","","0.71073","MoKα","","0.0345","0.0312","","0.0834","0.0796","","","","1.033","1.046","1.046","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027224","6.208","0.001","10.216","0.001","19.18","0.002","90","","98.7","0.01","90","","1202.4","0.3","163.15","","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C5 H9 Au Cl3 O P S -","- C5 H9 Au Cl3 O P S -","- C20 H36 Au4 Cl12 O4 P4 S4 -","4","1","","Preisenberger, Max; Schier, Annette; Schmidbaur, Hubert","(Phosphine)gold(I) trifluoromethanesulfonates, trifluoroacetates and trichlorothioacetates †","Journal of the Chemical Society, Dalton Transactions","1999","","10","1645","","10.1039/a809714c","","","0.71073","MoKα","","0.0702","0.0507","","0.1618","0.1207","","","","1.196","1.244","1.244","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027225","11.229","0.002","14.256","0.001","15.642","0.002","90","","103.91","0.01","90","","2430.6","0.6","194","2","194","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H21 Au Cl3 O P S -","- C23 H21 Au Cl3 O P S -","- C92 H84 Au4 Cl12 O4 P4 S4 -","4","1","","Preisenberger, Max; Schier, Annette; Schmidbaur, Hubert","(Phosphine)gold(I) trifluoromethanesulfonates, trifluoroacetates and trichlorothioacetates †","Journal of the Chemical Society, Dalton Transactions","1999","","10","1645","","10.1039/a809714c","","","0.71073","MoKα","","0.0537","0.0304","","0.081","0.0717","","","","1.058","1.11","1.11","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027226","10.9768","0.0003","11.4017","0.0003","5.4032","0.0001","90","","90","","90","","676.23","0.03","293","2","293","2","","","","","","","","5","I m m 2","I 2 -2","44","","","","- C12 H8 Co N2 O4 -","- C12 H8 Co N2 O4 -","- C24 H16 Co2 N4 O8 -","2","0.25","","Zheng, Li-Min; Fang, Xia; Lii, Kwang-Hwa; Song, Hui-Hua; Xin, Xin-Quan; Fun, Hoong-Kun; Chinnakali, Kandasamy; Razak, Ibrahim Abdul","Syntheses, crystal structures and magnetic properties of two novel layered compounds: [Fe3(C2O4)3(4,4′-bpy)4] and [Co(C2O4)(4,4′-bpy)] (4,4′-bpy = 4,4′-bipyridine) †","Journal of the Chemical Society, Dalton Transactions","1999","","14","2311","","10.1039/a809738k","","","0.71073","MoKα","","0.0267","0.0257","","0.0671","0.0666","","","","1.119","1.132","1.132","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027227","16.2475","0.0002","15.984","0.0002","16.3856","0.0001","90","","94.2776","0.0003","90","","4243.49","0.08","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H32 Fe3 N8 O12 -","- C46 H32 Fe3 N8 O12 -","- C184 H128 Fe12 N32 O48 -","4","1","","Zheng, Li-Min; Fang, Xia; Lii, Kwang-Hwa; Song, Hui-Hua; Xin, Xin-Quan; Fun, Hoong-Kun; Chinnakali, Kandasamy; Razak, Ibrahim Abdul","Syntheses, crystal structures and magnetic properties of two novel layered compounds: [Fe3(C2O4)3(4,4′-bpy)4] and [Co(C2O4)(4,4′-bpy)] (4,4′-bpy = 4,4′-bipyridine) †","Journal of the Chemical Society, Dalton Transactions","1999","","14","2311","","10.1039/a809738k","","","0.71073","MoKα","","0.1113","0.0493","","0.1127","0.0887","","","","1.023","1.073","1.073","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027228","10.5077","0.0006","17.108","0.001","15.7022","0.0006","90","","90","","90","","2822.7","0.3","296","","296","","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C6 H20 Cl Co N4 O4 S2 -","- C6 H20 Cl Co N4 O4 S2 -","- C48 H160 Cl8 Co8 N32 O32 S16 -","8","0.5","","Yonemura, Toshiaki; Bai, Zhi-Ping; Okamoto, Ken-ichi; Ama, Tomoharu; Kawaguchi, Hiroshi; Yasui, Takaji; Hidaka, Jinsai","Synthesis, characterisation and polynuclearisation reaction of trans(S)-[Co(aminothiolate-N,S )2(en)]-type cobalt(III) complexes with 2-aminoethanethiolate, L-cysteinate and D-penicillaminate","Journal of the Chemical Society, Dalton Transactions","1999","","13","2151","","10.1039/a809753d","","","0.7107","MoKα","","0.0395","0.0395","","","0.0644","0.0644","","","","","","1.962","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027229","9.4314","0.0003","11.7824","0.0003","14.6793","0.0004","90","","91.931","0.001","90","","1630.3","0.08","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H18 Cl3 N6 P -","- C10 H18 Cl3 N6 P -","- C40 H72 Cl12 N24 P4 -","4","1","","Dastagiri Reddy, N.; J. Elias, Anil; Vij, Ashwani","Ring opening of bicyclic tertiary amines with cyclic chlorocarbaphosphazenes: reactions of (ClCN)2(Cl2PN) with 1,4-diazabicyclo[2.2.2]octane and quinuclidine †","Journal of the Chemical Society, Dalton Transactions","1999","","9","1515","","10.1039/a809788g","","","0.71073","MoKα","","0.0591","0.0391","","0.1017","0.0938","","","","1.027","1.089","1.089","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027230","12.274","0.001","12.684","0.001","8.611","0.001","90","","90","","90","","1340.6","0.2","423.2","","423.2","","","","","","","","CHCl~3~/hexane solution at -18oC","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H12 Br Mn O3 Se2 -","- C9 H12 Br Mn O3 Se2 -","- C36 H48 Br4 Mn4 O12 Se8 -","4","1","","Davies, Maxwell K.; Durrant, Marcus C.; Levason, William; Reid, Gillian; Richards, Raymond L.","Synthesis, spectroscopic and structural studies on transition metal carbonyl complexes of cyclic di- and tetra-selenoether ligands","Journal of the Chemical Society, Dalton Transactions","1999","","7","1077","","10.1039/a809853k","","","0.7107","MoKalpha","","","0.021","","","0.0223","","","","","1.461","1.461","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027231","12.302","0.002","12.726","0.001","8.656","0.002","90","","90.02","0.01","90","","1355.1","0.4","423.2","","423.2","","","","","","","","cooling a CHCl~3~/hexane mixture","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H12 Br O3 Re Se2 -","- C9 H12 Br O3 Re Se2 -","- C36 H48 Br4 O12 Re4 Se8 -","4","1","","Davies, Maxwell K.; Durrant, Marcus C.; Levason, William; Reid, Gillian; Richards, Raymond L.","Synthesis, spectroscopic and structural studies on transition metal carbonyl complexes of cyclic di- and tetra-selenoether ligands","Journal of the Chemical Society, Dalton Transactions","1999","","7","1077","","10.1039/a809853k","","","0.7107","MoKalpha","","","0.0325","","","0.0425","","","","","1.3","1.3","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027232","12.861","0.002","9.978","0.001","10.715","0.002","90","","90","","90","","1375","0.4","150","","150","","","","","","","","cooling a CHCl~3~/hexane mixture","5","P n m a","-P 2ac 2n","62","","","","- C10 H12 O4 Se2 W -","- C10 H12 O4 Se2 W -","- C40 H48 O16 Se8 W4 -","4","0.5","","Davies, Maxwell K.; Durrant, Marcus C.; Levason, William; Reid, Gillian; Richards, Raymond L.","Synthesis, spectroscopic and structural studies on transition metal carbonyl complexes of cyclic di- and tetra-selenoether ligands","Journal of the Chemical Society, Dalton Transactions","1999","","7","1077","","10.1039/a809853k","","","0.71073","MoKalpha","","","0.0352","","","0.0398","","","","","1.976","1.976","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027233","18.943","0.002","12.397","0.001","20.508","0.002","90","","91.138","0.007","90","","4815.1","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C57 H53 B Mo P2 S2 -","- C57 H53 B Mo P2 S2 -","- C228 H212 B4 Mo4 P8 S8 -","4","1","","Morales, Dolores; Poli, Rinaldo; Richard, Philippe; Andrieu, Jacques; Collange, Edmond","Half-sandwich molybdenum compounds with phosphine‒alkylthiolate and phosphine‒thioether ligands. Crystal structure of [CpMo(SCH2CH2PPh2)2][BPh4]","Journal of the Chemical Society, Dalton Transactions","1999","","6","867","","10.1039/a809903k","","","0.71073","MoKα","","0.0987","0.0336","","0.0885","0.0736","","","","1.043","1.094","1.094","","","","","has coordinates,has disorder","179978","2020-10-21","18:00:00",""
"7027234","8.103","0.001","13.576","0.002","13.987","0.002","111.59","0.01","105.18","0.01","95.82","0.01","1346.8","0.4","296.2","","296.2","","","","","","","","","8","P -1","-P 1","2","","","","- C42 H64 Br2 Cl2 N10 O10 S2 Zn2 -","- C42 H52 Br2 Cl2 N10 O10 S2 Zn2 -","- C42 H52 Br2 Cl2 N10 O10 S2 Zn2 -","1","0.5","","J. Brudenell, Suzanne; Spiccia, Leone; C. R. Hockless, David; R. T. Tiekink, Edward","Solution and solid state structures of binuclear zinc(II) complexes of bis(pentadentate) ligands derived from bis(1,4,7-triazacyclononane) macrocycles","Journal of the Chemical Society, Dalton Transactions","1999","","9","1475","","10.1039/a809946d","","","0.7107","MoKα","","0.0864","0.0546","","0.0723","","0.0702","","","2.96","","","3.449","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027235","18.863","0.009","19.011","0.005","12.663","0.006","90","","90","","90","","4541","3","220","","220","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C39 H54 Cl3 N10 O13.5 Zn2 -","- C39 H53 Cl3 N10 O17 Zn2 -","- C156 H212 Cl12 N40 O68 Zn8 -","4","1","","J. Brudenell, Suzanne; Spiccia, Leone; C. R. Hockless, David; R. T. Tiekink, Edward","Solution and solid state structures of binuclear zinc(II) complexes of bis(pentadentate) ligands derived from bis(1,4,7-triazacyclononane) macrocycles","Journal of the Chemical Society, Dalton Transactions","1999","","9","1475","","10.1039/a809946d","","","0.7107","MoKalpha","","","0.0715","","","0.0665","","","","","2.107","2.107","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027236","47.493","0.013","12.601","0.003","24.635","0.007","90","","96.442","0.014","90","","14650","7","173","2","173","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C81 H69 B2 Cl2 O4 P5 Pt2 -","- C81 H67 B2 Cl2 O4 P5 Pt2 -","- C648 H536 B16 Cl16 O32 P40 Pt16 -","8","1","","Curtis, David; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Jonathan","Phosphine exchange reactions involving cis-[Pt(PPh3)2(Bcat)2] (cat = 1,2-O2C6H4) and the oxidative addition of 1,2-B2Cl2(NMe2)2 to Pt0","Journal of the Chemical Society, Dalton Transactions","1999","","10","1687","","10.1039/a810006c","","","0.71073","MoKα","","0.2074","0.0823","","0.1812","0.1354","","","","1.003","1.189","1.189","","","","","has coordinates,has disorder","179978","2020-10-21","18:00:00",""
"7027237","22.88","0.004","14.21","0.002","26.731","0.004","90","","114.248","0.01","90","","7924","2","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C88.61 H77.54 B2 Cl1.38 O4 P6 Pt2 -","- C88.614 H77.535 B2 Cl1.386 O4 P6 Pt2 -","- C354.456 H310.14 B8 Cl5.544 O16 P24 Pt8 -","4","1","","Curtis, David; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Jonathan","Phosphine exchange reactions involving cis-[Pt(PPh3)2(Bcat)2] (cat = 1,2-O2C6H4) and the oxidative addition of 1,2-B2Cl2(NMe2)2 to Pt0","Journal of the Chemical Society, Dalton Transactions","1999","","10","1687","","10.1039/a810006c","","","0.71073","MoKα","","0.1267","0.0656","","0.1418","0.1171","","","","1.065","1.152","1.152","","","","","has coordinates,has disorder","179978","2020-10-21","18:00:00",""
"7027238","16.752","0.003","12.174","0.002","22.85","0.002","90","","111.428","0.01","90","","4337.9","1.2","173","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C48 H56 B2 O4 P2 Pt -","- C48 H56 B2 O4 P2 Pt -","- C192 H224 B8 O16 P8 Pt4 -","4","1","","Curtis, David; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Jonathan","Phosphine exchange reactions involving cis-[Pt(PPh3)2(Bcat)2] (cat = 1,2-O2C6H4) and the oxidative addition of 1,2-B2Cl2(NMe2)2 to Pt0","Journal of the Chemical Society, Dalton Transactions","1999","","10","1687","","10.1039/a810006c","","","0.71073","MoKα","","0.0652","0.0356","","0.0608","0.053","","","","0.987","1.034","1.034","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027239","11.2268","0.001","12.0715","0.0014","17.349","0.003","85.897","0.008","72.861","0.01","69.461","0.008","2102.6","0.5","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C43.5 H45.5 B2 Cl2 N2 P2 Pt -","- C43.5 H45.5 B2 Cl2 N2 P2 Pt -","- C87 H91 B4 Cl4 N4 P4 Pt2 -","2","1","","Curtis, David; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Jonathan","Phosphine exchange reactions involving cis-[Pt(PPh3)2(Bcat)2] (cat = 1,2-O2C6H4) and the oxidative addition of 1,2-B2Cl2(NMe2)2 to Pt0","Journal of the Chemical Society, Dalton Transactions","1999","","10","1687","","10.1039/a810006c","","","0.71073","MoKα","","0.0333","0.024","","0.0464","0.0446","","","","0.943","0.987","0.987","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027240","10.865","0.005","12.093","0.006","14.228","0.005","95.819","0.006","92.523","0.01","105.637","0.006","1786","1.4","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H36 B Cl2 N P2 Pt -","- C38 H36 B Cl2 N P2 Pt -","- C76 H72 B2 Cl4 N2 P4 Pt2 -","2","1","","Curtis, David; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Jonathan","Phosphine exchange reactions involving cis-[Pt(PPh3)2(Bcat)2] (cat = 1,2-O2C6H4) and the oxidative addition of 1,2-B2Cl2(NMe2)2 to Pt0","Journal of the Chemical Society, Dalton Transactions","1999","","10","1687","","10.1039/a810006c","","","0.71073","MoKα","","0.0418","0.0307","","0.0616","0.0585","","","","1.004","1.047","1.047","","","","","has coordinates,has disorder","179978","2020-10-21","18:00:00",""
"7027241","9.216","0.006","12.072","0.004","14.533","0.003","90","","96.57","0.03","90","","1606.3","1.2","193.2","","193.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H44 O2 P2 Pt Te2 -","- C28 H44 O2 P2 Pt Te2 -","- C56 H88 O4 P4 Pt2 Te4 -","2","0.5","","Kato, Shinzi; Niyomura, Osamu; Kawahara, Yasuyuki; Kanda, Takahiro","Bis(phosphine)bis(tellurocarboxylato)-palladium(II) and -platinum(II) complexes: synthesis and crystal structure","Journal of the Chemical Society, Dalton Transactions","1999","","10","1677","","10.1039/a810015b","","","0.7107","MoKα","","0.0536","0.0536","","","0.0514","0.0514","","","","","","1.235","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027242","9.523","0.001","11.902","0.001","14.5038","0.0008","90","","102.347","0.005","90","","1605.9","0.2","296.2","","296.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H44 O2 P2 Pt S2 -","- C28 H44 O2 P2 Pt S2 -","- C56 H88 O4 P4 Pt2 S4 -","2","0.5","","Kato, Shinzi; Niyomura, Osamu; Kawahara, Yasuyuki; Kanda, Takahiro","Bis(phosphine)bis(tellurocarboxylato)-palladium(II) and -platinum(II) complexes: synthesis and crystal structure","Journal of the Chemical Society, Dalton Transactions","1999","","10","1677","","10.1039/a810015b","","","0.7107","MoKα","","0.0308","0.0308","","","0.0408","0.0408","","","","","","1.329","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027243","19.077","0.004","9.995","0.003","14.588","0.004","90","0.02","110.23","0.03","90","0.03","2610","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H12 Fe0.5 N3 S -","- C13 H12 Fe0.5 N3 S -","- C104 H96 Fe4 N24 S8 -","8","1","","Hernández, Margarita L.; Barandika, M. Gotzone; Urtiaga, M. Karmele; Cortés, Roberto; Lezama, Luis; Arriortua, M. Isabel; Rojo, Teófilo","Structural analysis and magnetic properties of the 1-D compounds [M(NCS)2bpa2] [M = Fe, Co, Ni and bpa = 1,2-bis(4-pyridyl)ethane]","Journal of the Chemical Society, Dalton Transactions","1999","","9","1401","","10.1039/a900096h","","","0.7107","MoKα","","0.052","0.0355","","","0.0927","0.1066","","","","","","1.062","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027244","17.143","0.003","16.135","0.003","16.239","0.003","90","","93.95","0.03","90","","4481.1","1.4","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C44.6 H45.2 Cl1.2 N8 Yb -","- C44.6 H44 Cl1.2 N8 Yb -","- C178.4 H176 Cl4.8 N32 Yb4 -","4","0.5","","Wang, Zenglin; Hu, Ninghai; Sakata, Kazunori; Hashimoto, Mamoru","Syntheses, characterization and crystal structures of 5,14-dihydro-6,8,15,17-tetramethyldibenzo[b,i][1,4,8,11]tetraazacyclotetradecine rare earth(III) complexes","Journal of the Chemical Society, Dalton Transactions","1999","","10","1695","","10.1039/a900100j","","","0.71073","MoKα","","0.1035","0.0705","","0.2379","0.1856","","","","1.118","1.254","1.254","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027245","17.647","0.004","16.102","0.003","16.183","0.003","90","","94.63","0.02","90","","4583.4","1.6","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C44.6 H45.2 Cl1.2 N8 Sm -","- C44.6 H44 Cl1.2 N8 Sm -","- C178.4 H176 Cl4.8 N32 Sm4 -","4","0.5","","Wang, Zenglin; Hu, Ninghai; Sakata, Kazunori; Hashimoto, Mamoru","Syntheses, characterization and crystal structures of 5,14-dihydro-6,8,15,17-tetramethyldibenzo[b,i][1,4,8,11]tetraazacyclotetradecine rare earth(III) complexes","Journal of the Chemical Society, Dalton Transactions","1999","","10","1695","","10.1039/a900100j","","","0.71073","MoKα","","0.106","0.0694","","0.2376","0.191","","","","1.113","1.283","1.283","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027246","17.51","0.004","16.151","0.003","16.206","0.003","90","","94.39","0.02","90","","4569.7","1.6","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C44.6 H45.2 Cl1.2 N8 Tb -","- C44.6 H44 Cl1.2 N8 Tb -","- C178.4 H176 Cl4.8 N32 Tb4 -","4","0.5","","Wang, Zenglin; Hu, Ninghai; Sakata, Kazunori; Hashimoto, Mamoru","Syntheses, characterization and crystal structures of 5,14-dihydro-6,8,15,17-tetramethyldibenzo[b,i][1,4,8,11]tetraazacyclotetradecine rare earth(III) complexes","Journal of the Chemical Society, Dalton Transactions","1999","","10","1695","","10.1039/a900100j","","","0.71073","MoKα","","0.093","0.0695","","0.2207","0.1902","","","","1.169","1.31","1.31","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027247","13.645","0.005","18.382","0.004","17.243","0.008","90","","102.73","0.02","90","","4219","3","203","2","203","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C46 H64 Cr N2 O2 -","- C46 H64 Cr N2 O2 -","- C184 H256 Cr4 N8 O8 -","4","0.5","","Gibson, Vernon C.; Newton, Claire; Redshaw, Carl; Solan, Gregory A.; White, Andrew J. P.; Williams, David J.","Chromium ethylene polymerisation catalysts bearing reduced Schiff-base N,O-chelate ligands","Journal of the Chemical Society, Dalton Transactions","1999","","6","827","","10.1039/a900118b","","","0.71073","MoKα","","0.1238","0.0603","","0.158","0.1253","","","","1.041","1.097","1.097","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027248","9.5664","0.0014","13.048","0.002","23.432","0.004","90","","95.832","0.013","90","","2909.7","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C27 H38 Cl2 Cr N3 O -","- C27 H38 Cl2 Cr N3 O -","- C108 H152 Cl8 Cr4 N12 O4 -","4","1","","Gibson, Vernon C.; Newton, Claire; Redshaw, Carl; Solan, Gregory A.; White, Andrew J. P.; Williams, David J.","Chromium ethylene polymerisation catalysts bearing reduced Schiff-base N,O-chelate ligands","Journal of the Chemical Society, Dalton Transactions","1999","","6","827","","10.1039/a900118b","","","1.54178","CuKα","","0.091","0.0565","","0.1464","0.1267","","","","1.018","1.087","1.087","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027249","10.087","0.007","17.602","0.005","13.092","0.003","90","","108.78","0.03","90","","2200.8","1.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[{Au[mu-N(SiMe3)C(Ph)C(SiMe3)2]}2]","","","- C34 H64 Au2 N2 Si6 -","- C34 H64 Au2 N2 Si6 -","- C68 H128 Au4 N4 Si12 -","2","0.5","","Hitchcock, Peter B.; Lappert, Michael F.; Layh, Marcus; Klein, Axel","Spectroscopic and electronic properties of 1-azaallylmetal(I) (M = Cu or Au) complexes; molecular structure of [{Au[μ-N(R)C(Ph)CR2]}2] (R = SiMe3)","Journal of the Chemical Society, Dalton Transactions","1999","","9","1455","","10.1039/a900299e","","","0.71073","MoKα","","0.0578","0.034","","0.0717","0.0639","","","","0.997","1.029","1.029","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027250","8.586","0.001","10.256","0.001","16.422","0.003","78.4","0.01","83.36","0.01","70.11","0.01","1330.3","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","Thallium(I) [N1-{[{[(2-hydroxyiminopropanoyl)amino]-methyl}(methyl)amino] methyl}-2-hydroxyiminopropanamide(3-) nickolate(II)]","","- C9 H14 N5 Ni O4 Tl -","- C9 H14 N5 Ni O4 Tl -","- C36 H56 N20 Ni4 O16 Tl4 -","4","2","","Fritsky, Igor O.","New ring-closure reaction involving co-ordinated amide groups","Journal of the Chemical Society, Dalton Transactions","1999","","6","825","","10.1039/a900349e","","","0.71073","MoKα","","0.0367","0.0274","","0.0723","0.0658","","","","1.015","1.061","1.061","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027251","11.5","0.003","20.814","0.006","21.055","0.006","90","","97.92","0.02","90","","4992","2","294","","294","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C51 H47 Cl F6 O P4 Pd -","- C51 H39 Cl F6 O P4 Pd -","- C204 H156 Cl4 F24 O4 P16 Pd4 -","4","1","","Blin, Joël; Braunstein, Pierre; Fischer, Jean; Kickelbick, Guido; Knorr, Michael; Morise, Xavier; Wirth, Tobias","Heterobimetallic alkoxysilyl cationic complexes: investigations into the displacement of a μ-η2-Si,O bridge by functional phosphine ligands","Journal of the Chemical Society, Dalton Transactions","1999","","13","2159","","10.1039/a900390h","","","0.71073","Mo-Kα","","0.127","0.051","","0.139","","0.08","","","2.681","","","1.528","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027252","21.171","0.006","21.171","0.006","14.309","0.004","90","","90","","90","","6413","3","173","","173","","","","","","","","","6","P 41","P 4w","76","","","","- C54 H54 Cl8 O3 P4 Pd2 -","- C54 H50 Cl8 O3 P4 Pd2 -","- C216 H200 Cl32 O12 P16 Pd8 -","4","1","","Blin, Joël; Braunstein, Pierre; Fischer, Jean; Kickelbick, Guido; Knorr, Michael; Morise, Xavier; Wirth, Tobias","Heterobimetallic alkoxysilyl cationic complexes: investigations into the displacement of a μ-η2-Si,O bridge by functional phosphine ligands","Journal of the Chemical Society, Dalton Transactions","1999","","13","2159","","10.1039/a900390h","","","0.71073","Mo-Kα","","0.046","0.036","","0.073","","0.054","","","1.607","","","1.181","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027253","11.2139","0.0004","12.2698","0.0009","12.6138","0.0011","60.275","0.006","67.096","0.004","88.802","0.005","1355.9","0.2","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H26 Ag N O P2 S -","- C30 H26 Ag N O P2 S -","- C60 H52 Ag2 N2 O2 P4 S2 -","2","1","","Lobana, Tarlok S.; Paul, Seema; Castineiras, Alfonso","Pyridine-2-thione derivatives of silver(I) and mercury(II): crystal structures of dimeric [bis(diphenylphosphino)methane][(1-oxo-pyridine-2-thionato)silver(I), [2-(benzylsulfanyl)pyridine 1-oxide]dichloromercury(II) and phenyl(pyridine-2-thionato)mercury(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","11","1819","","10.1039/a900405j","","","1.54184","CuKα","","0.0657","0.0396","","","0.1008","0.1116","","","","","","1.112","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027254","6.4265","0.0005","11.1825","0.0011","11.7128","0.0009","112.297","0.006","99.68","0.006","105.797","0.006","713.7","0.12","291","2","291","2","","","","","","","","7","P -1","-P 1","2","","","","- C12 H11 Cl2 Hg N O S -","- C12 H11 Cl2 Hg N O S -","- C24 H22 Cl4 Hg2 N2 O2 S2 -","2","1","","Lobana, Tarlok S.; Paul, Seema; Castineiras, Alfonso","Pyridine-2-thione derivatives of silver(I) and mercury(II): crystal structures of dimeric [bis(diphenylphosphino)methane][(1-oxo-pyridine-2-thionato)silver(I), [2-(benzylsulfanyl)pyridine 1-oxide]dichloromercury(II) and phenyl(pyridine-2-thionato)mercury(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","11","1819","","10.1039/a900405j","","","0.71073","MoKα","","0.0469","0.0259","","","0.0596","0.065","","","","","","1.049","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027255","30.135","0.003","6.7304","0.0011","23.061","0.003","90","","111.371","0.009","90","","4355.6","1","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C11 H9 Hg N S -","- C11 H9 Hg N S -","- C176 H144 Hg16 N16 S16 -","16","2","","Lobana, Tarlok S.; Paul, Seema; Castineiras, Alfonso","Pyridine-2-thione derivatives of silver(I) and mercury(II): crystal structures of dimeric [bis(diphenylphosphino)methane][(1-oxo-pyridine-2-thionato)silver(I), [2-(benzylsulfanyl)pyridine 1-oxide]dichloromercury(II) and phenyl(pyridine-2-thionato)mercury(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","11","1819","","10.1039/a900405j","","","0.71073","MoKα","","0.1953","0.0427","","","0.0728","0.0971","","","","","","0.946","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027256","19.401","0.009","8.5915","0.0009","15.175","0.007","90","","112.594","0.014","90","","2335.3","1.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H46 F P2 Rh -","- C20 H46 F P2 Rh -","- C80 H184 F4 P8 Rh4 -","4","1","","Gil-Rubio, Juan; Weberndörfer, Birgit; Werner, Helmut","A series of new fluororhodium(I) complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","9","1437","","10.1039/a900440h","","","0.71073","MoKα","","0.0724","0.0405","","0.1129","","0.0924","","","1.096","","","1.061","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027257","14.9973","0.0003","8.5722","0.0001","11.1352","0.0002","90","","126.769","0.001","90","","1146.74","0.04","293","2","293","2","","","","","","","see text","6","C 1 2/c 1","-C 2yc","15","","","","- C4 H14 Cl2 N2 O5 Pt -","- C4 H14 Cl2 N2 O5 Pt -","- C16 H56 Cl8 N8 O20 Pt4 -","4","0.5","","Chen, Lie; Lee, Peng Foo; Ranford, John D.; Vittal, Jagadese J.; Wong, Siew Ying","Reduction of the anti-cancer drug analogue cis,trans,cis-[PtCl2(OCOCH3)2(NH3)2] by L-cysteine and L-methionine and its crystal structure †","Journal of the Chemical Society, Dalton Transactions","1999","","8","1209","","10.1039/a900441f","","","0.71073","MoKα","","0.0391","0.0386","","0.0967","0.0965","","","","1.114","1.126","1.126","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027258","8.599","0.003","21.03","0.004","9.69","0.003","90","","95.16","0.03","90","","1745.2","0.9","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H18 Br N2 P -","- C17 H18 Br N2 P -","- C68 H72 Br4 N8 P4 -","4","1","","Jalil, M. Abdul; Fujinami, Shuhei; Senda, Hitoshi; Nishikawa, Hiroaki","Syntheses of new P–N ligands containing an imidazolyl group and their co-ordination behaviors toward nickel(II), cobalt-(II) and -(III)","Journal of the Chemical Society, Dalton Transactions","1999","","10","1655","","10.1039/a900450e","","","0.7107","MoKalpha","","","0.0315","","","0.0516","","","","","1.073","1.073","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027259","13.674","0.005","16.03","0.01","9.405","0.007","104.21","0.06","109.78","0.04","89.68","0.04","1874","2","297.2","","297.2","","","","","","","","","7","P -1","-P 1","2","","","","- C34 H34 B2 F8 N4 Ni P2 -","- C34 H34 B2 F8 N4 Ni P2 -","- C68 H68 B4 F16 N8 Ni2 P4 -","2","1","","Jalil, M. Abdul; Fujinami, Shuhei; Senda, Hitoshi; Nishikawa, Hiroaki","Syntheses of new P–N ligands containing an imidazolyl group and their co-ordination behaviors toward nickel(II), cobalt-(II) and -(III)","Journal of the Chemical Society, Dalton Transactions","1999","","10","1655","","10.1039/a900450e","","","0.7107","MoKalpha","","","0.072","","","0.1086","","","","","1.926","1.926","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027260","20.688","0.008","9.975","0.002","17.1","0.004","90","","104.7","0.04","90","","3413.3","1.8","296","","296","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H45 B2 F8 N5 Ni P2 -","- C24 H42 B2 F8 N5 Ni P2 -","- C96 H168 B8 F32 N20 Ni4 P8 -","4","1","","Jalil, M. Abdul; Fujinami, Shuhei; Senda, Hitoshi; Nishikawa, Hiroaki","Syntheses of new P‒N ligands containing an imidazolyl group and their co-ordination behaviors toward nickel(II), cobalt-(II) and -(III)","Journal of the Chemical Society, Dalton Transactions","1999","","10","1655","","10.1039/a900450e","","","0.7107","MoKα","","","0.059","","","0.0715","","","","","1.194","1.194","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027261","14.067","0.003","18.07","0.004","15.153","0.003","90","","108.34","0.03","90","","3656.1","1.5","130","2","130","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C66 H86 Ba2 Cl6 N8 O12 -","- C66 H86 Ba2 Cl6 N8 O12 -","- C132 H172 Ba4 Cl12 N16 O24 -","2","0.5","","Pettinari, Claudio; Marchetti, Fabio; Cingolani, Augusto; Leonesi, Dante; Troyanov, Sergei; Drozdov, Andrei","New co-ordination compounds derived from barium(II) and the anionic 4-tert-butylacetyl-3-methyl-1-phenylpyrazol-5-onate ligand (Q−). Crystal and molecular structure of [Ba2Q4(H2O)4], [Ba2Q4(Him)4], [BaQ2(tetraglyme)] (tetraglyme = 2,5,8,11,14-pentaoxapentadecane) and [BaQ2(phen)2]","Journal of the Chemical Society, Dalton Transactions","1999","","10","1555","","10.1039/a900463g","","","0.71073","MoKα","","0.0635","0.0519","","","0.1091","0.1131","","","","","","1.087","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027262","7.955","0.002","13.973","0.003","20.565","0.005","78.21","0.03","87.52","0.02","77.08","0.02","2181","0.9","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H60 Ba N4 O9 -","- C42 H60 Ba N4 O9 -","- C84 H120 Ba2 N8 O18 -","2","1","","Pettinari, Claudio; Marchetti, Fabio; Cingolani, Augusto; Leonesi, Dante; Troyanov, Sergei; Drozdov, Andrei","New co-ordination compounds derived from barium(II) and the anionic 4-tert-butylacetyl-3-methyl-1-phenylpyrazol-5-onate ligand (Q−). Crystal and molecular structure of [Ba2Q4(H2O)4], [Ba2Q4(Him)4], [BaQ2(tetraglyme)] (tetraglyme = 2,5,8,11,14-pentaoxapentadecane) and [BaQ2(phen)2]","Journal of the Chemical Society, Dalton Transactions","1999","","10","1555","","10.1039/a900463g","","","0.71073","MoKα","","0.0695","0.0366","","0.0703","0.0617","","","","0.667","0.736","0.736","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027263","22.025","0.006","13.83","0.004","18.302","0.005","90","","102.42","0.03","90","","5444","3","180","2","180","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C62 H60 Ba N8 O4 -","- C62 H60 Ba N8 O4 -","- C248 H240 Ba4 N32 O16 -","4","0.5","","Pettinari, Claudio; Marchetti, Fabio; Cingolani, Augusto; Leonesi, Dante; Troyanov, Sergei; Drozdov, Andrei","New co-ordination compounds derived from barium(II) and the anionic 4-tert-butylacetyl-3-methyl-1-phenylpyrazol-5-onate ligand (Q−). Crystal and molecular structure of [Ba2Q4(H2O)4], [Ba2Q4(Him)4], [BaQ2(tetraglyme)] (tetraglyme = 2,5,8,11,14-pentaoxapentadecane) and [BaQ2(phen)2]","Journal of the Chemical Society, Dalton Transactions","1999","","10","1555","","10.1039/a900463g","","","0.71073","MoKα","","0.0609","0.034","","0.078","0.0634","","","","0.817","0.901","0.901","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027264","13.467","0.002","16.232","0.002","18.73","0.003","90","","98.09","0.02","90","","4053.6","1","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H49 Ba N8 O4 -","- C41 H49 Ba N8 O4 -","- C164 H196 Ba4 N32 O16 -","4","1","","Pettinari, Claudio; Marchetti, Fabio; Cingolani, Augusto; Leonesi, Dante; Troyanov, Sergei; Drozdov, Andrei","New co-ordination compounds derived from barium(II) and the anionic 4-tert-butylacetyl-3-methyl-1-phenylpyrazol-5-onate ligand (Q−). Crystal and molecular structure of [Ba2Q4(H2O)4], [Ba2Q4(Him)4], [BaQ2(tetraglyme)] (tetraglyme = 2,5,8,11,14-pentaoxapentadecane) and [BaQ2(phen)2]","Journal of the Chemical Society, Dalton Transactions","1999","","10","1555","","10.1039/a900463g","","","0.71073","MoKα","","0.0388","0.0295","","0.0823","0.0754","","","","1.045","1.099","1.099","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027265","10.31","0.002","8.339","0.002","17.935","0.003","90","","102.43","0.02","90","","1505.8","0.5","301.2","","301.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 N3 O4 Zn -","- C14 H15 N3 O4 Zn -","- C56 H60 N12 O16 Zn4 -","4","1","","Ho, Kin-Ying; Yu, Wing-Yiu; Cheung, Kung-Kai; Che, Chi-Ming","Blue luminescent zinc(II) complexes with polypyridylamine ligands: crystal structures and luminescence properties","Journal of the Chemical Society, Dalton Transactions","1999","","10","1581","","10.1039/a900504h","","","0.7107","MoKalpha","","","0.036","","","0.0557","","","","","1.935","1.935","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027266","7.439","0.002","8.669","0.002","9.409","0.002","75.28","0.02","89.32","0.02","86.11","0.02","585.5","0.2","301.2","","301.2","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H9 Cl2 N3 Zn -","- C10 H9 Cl2 N3 Zn -","- C20 H18 Cl4 N6 Zn2 -","2","1","","Ho, Kin-Ying; Yu, Wing-Yiu; Cheung, Kung-Kai; Che, Chi-Ming","Blue luminescent zinc(II) complexes with polypyridylamine ligands: crystal structures and luminescence properties","Journal of the Chemical Society, Dalton Transactions","1999","","10","1581","","10.1039/a900504h","","","0.7107","MoKalpha","","","0.0492","","","0.0659","","","","","1.946","1.946","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027267","8.637","0.002","11.018","0.002","12.138","0.002","86.55","0.02","86.59","0.02","80.74","0.02","1136.5","0.4","301.2","","301.2","","","","","","","","","5","P -1","-P 1","2","","","","- C24 H23 N3 S2 Zn -","- C24 H23 N3 S2 Zn -","- C48 H46 N6 S4 Zn2 -","2","1","","Ho, Kin-Ying; Yu, Wing-Yiu; Cheung, Kung-Kai; Che, Chi-Ming","Blue luminescent zinc(II) complexes with polypyridylamine ligands: crystal structures and luminescence properties","Journal of the Chemical Society, Dalton Transactions","1999","","10","1581","","10.1039/a900504h","","","0.7107","MoKalpha","","","0.0423","","","0.0642","","","","","1.634","1.634","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027268","16.393","0.003","8.897","0.002","19.61","0.003","90","","103.05","0.02","90","","2786.2","0.9","301.2","","301.2","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H18 F6 N6 O6 S2 Zn -","- C22 H18 F6 N6 O6 S2 Zn -","- C88 H72 F24 N24 O24 S8 Zn4 -","4","0.5","","Ho, Kin-Ying; Yu, Wing-Yiu; Cheung, Kung-Kai; Che, Chi-Ming","Blue luminescent zinc(II) complexes with polypyridylamine ligands: crystal structures and luminescence properties","Journal of the Chemical Society, Dalton Transactions","1999","","10","1581","","10.1039/a900504h","","","0.7107","MoKalpha","","","0.0543","","","0.0824","","","","","2.9","2.9","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027269","9.662","0.002","8.016","0.002","24.566","0.004","90","","92.16","0.02","90","","1901.3","0.7","301.2","","301.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H19 N5 O4 Zn -","- C19 H19 N5 O4 Zn -","- C76 H76 N20 O16 Zn4 -","4","1","","Ho, Kin-Ying; Yu, Wing-Yiu; Cheung, Kung-Kai; Che, Chi-Ming","Blue luminescent zinc(II) complexes with polypyridylamine ligands: crystal structures and luminescence properties","Journal of the Chemical Society, Dalton Transactions","1999","","10","1581","","10.1039/a900504h","","","0.7107","MoKalpha","","","0.0395","","","0.0541","","","","","1.53","1.53","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027270","7.519","0.002","17.202","0.002","12.869","0.002","90","","103.96","0.01","90","","1615.3","0.5","301.2","","301.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H13 Cl2 N5 Zn -","- C15 H13 Cl2 N5 Zn -","- C60 H52 Cl8 N20 Zn4 -","4","0.5","","Ho, Kin-Ying; Yu, Wing-Yiu; Cheung, Kung-Kai; Che, Chi-Ming","Blue luminescent zinc(II) complexes with polypyridylamine ligands: crystal structures and luminescence properties","Journal of the Chemical Society, Dalton Transactions","1999","","10","1581","","10.1039/a900504h","","","0.7107","MoKalpha","","","0.022","","","0.03","","","","","1.605","1.605","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027271","9.399","0.004","17.59","0.03","34.22","0.02","90","","90.15","0.03","90","","5658","10","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,5,9-triphenyl-1,5,9-triphosphacyclododecane molybdenum tricarbonyl complex","","- C30 H33 Mo O3 P3 -","- C30 H33 Mo O3 P3 -","- C240 H264 Mo8 O24 P24 -","8","2","","Jones, David J.; Edwards, Peter G.; Tooze, Robert P.; Albers, Thomas","The template synthesis of triaryl functionalised 1,5,9-triphosphacyclododecane on molybdenum using organocopper reagents †","Journal of the Chemical Society, Dalton Transactions","1999","","7","1045","","10.1039/a900509i","","","0.71073","MoKα","","0.0833","0.0484","","","0.085","0.0924","","","","","","0.805","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027272","13.8454","0.001","15.9185","0.0015","19.7817","0.0013","90","","95.472","0.007","90","","4340","0.6","180","2","180","2","","","","","","","synthetis as described","7","C 1 2/c 1","-C 2yc","15","","","","- C16 H20 F6 O3.5 P Pd0.5 Se2 -","- C32 H40 F12 O7 P2 Pd Se4 -","- C128 H160 F48 O28 P8 Pd4 Se16 -","4","0.5","","Bornet, C.; Amardeil, R.; Meunier, P.; Daran, J. C.","Structural and complexation properties of diselenacrown ethers. Synthesis and crystal structure of a novel cationic palladium tetraselena complex","Journal of the Chemical Society, Dalton Transactions","1999","","7","1039","","10.1039/a900545e","","","0.71073","MoKα","","","0.0414","","","0.0489","","","","","1.0725","1.0725","","","","","has coordinates","288252","2023-12-12","14:26:25",""
"7027273","9.958","0.008","14.336","0.014","15.438","0.009","101.4","0.04","93.85","0.04","108.79","0.03","2025","3","294","","","","","","","","","","","6","P -1","-P 1","2","","","","- C44 H46 N2 O6 P2 Pt -","- C44 H46 N2 O6 P2 Pt -","- C88 H92 N4 O12 P4 Pt2 -","2","1","","Sembiring, Seri Bima; Colbran, Stephen B.; Craig, Donald C.","Synthesis and electrochemistry of platinum complexes of hydroquinon-2-ylmethyl- and p-benzoquinon-2-ylmethyl-diphenylphosphine","Journal of the Chemical Society, Dalton Transactions","1999","","10","1543","","10.1039/a900610i","","","0.71073","MoKα","","","0.023","","","","0.032","","","","","","1.19","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027274","10.908","0.005","17.329","0.005","20.523","0.01","90","","105.06","0.02","90","","3746","3","294","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38.5 H31 Br2 Cl O4 P2 Pt -","- C40 H34 Br2 Cl4 O4 P2 Pt -","- C160 H136 Br8 Cl16 O16 P8 Pt4 -","4","1","","Sembiring, Seri Bima; Colbran, Stephen B.; Craig, Donald C.","Synthesis and electrochemistry of platinum complexes of hydroquinon-2-ylmethyl- and p-benzoquinon-2-ylmethyl-diphenylphosphine","Journal of the Chemical Society, Dalton Transactions","1999","","10","1543","","10.1039/a900610i","","","0.71073","MoKα","","","0.024","","","","0.031","","","","","","1","","","","has coordinates","296815","2024-12-10","09:29:12",""
"7027275","13.03","0.009","30.701","0.013","12.46","0.009","90","","113.81","0.03","90","","4560","5","294","","","","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C44 H46 Br2 N2 O6 P2 Pt Zn -","- C44 H46 Br2 N2 O6 P2 Pt Zn -","- C176 H184 Br8 N8 O24 P8 Pt4 Zn4 -","4","1","","Sembiring, Seri Bima; Colbran, Stephen B.; Craig, Donald C.","Synthesis and electrochemistry of platinum complexes of hydroquinon-2-ylmethyl- and p-benzoquinon-2-ylmethyl-diphenylphosphine","Journal of the Chemical Society, Dalton Transactions","1999","","10","1543","","10.1039/a900610i","","","0.71073","MoKα","","","0.033","","","","0.042","","","","","","1.41","","","","has coordinates","296815","2024-12-10","09:29:12",""
"7027276","8.989","0.003","10.033","0.002","12.086","0.002","90","","104.85","0.01","90","","1053.6","0.4","150","","150","","","","","","","","CH~2~Cl~2~/petroleum ether","7","P 1 21/m 1","-P 2yb","11","","","","- C12 H18 F3 Mn O6 S Te3 -","- C16 H31 F5 Mn O8 S Te3 -","- C32 H62 F10 Mn2 O16 S2 Te6 -","2","0.5","","Levason, William; Orchard, Simon D.; Reid, Gillian","Spectroscopic and structural characterisation of fac-[Mn(CO)3{MeC(CH2TeMe)3}]CF3SO3: the first transition metal complex of a tritelluroether","Journal of the Chemical Society, Dalton Transactions","1999","","6","823","","10.1039/a900615j","","","0.7107","MoKalpha","","","0.0255","","","0.0337","","","","","1.079","1.079","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027277","8.4444","0.0015","11.1376","0.0013","9.994","0.002","90","","98.48","0.02","90","","929.7","0.3","293","2","293","2","","","","","","","synthesis","4","P 1 21/c 1","-P 2ybc","14","","","","- C2 H4 Cu1.5 N13 -","- C2 H4 Cu1.5 N13 -","- C8 H16 Cu6 N52 -","4","1","","Liu, Jia-Cheng; Fu, De-Gang; Zhuang, Jin-Zhong; Duan, Chun-Ying; You, Xiao-Zeng","Linear trinuclear and one-dimensional copper(II) complexes containing co-bridging end-on azido and triazole ligands. Crystal structures and magnetic properties of [Cu3(atrz)2(N3)6] and [Cu(atrz)2(N3)]NO3 (atrz = 4-amino-1,2,4-triazole)","Journal of the Chemical Society, Dalton Transactions","1999","","14","2337","","10.1039/a900619b","","","0.71073","MoKα","","0.0531","0.0374","","0.0976","0.0882","","","","1.058","1.078","1.078","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027278","7.0069","0.0011","8.533","0.002","11.013","0.002","70.95","0.02","84.824","0.013","74.253","0.015","599","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C8 H16 Cu2 N24 O6 -","- C8 H16 Cu2 N24 O6 -","- C8 H16 Cu2 N24 O6 -","1","0.5","","Liu, Jia-Cheng; Fu, De-Gang; Zhuang, Jin-Zhong; Duan, Chun-Ying; You, Xiao-Zeng","Linear trinuclear and one-dimensional copper(II) complexes containing co-bridging end-on azido and triazole ligands. Crystal structures and magnetic properties of [Cu3(atrz)2(N3)6] and [Cu(atrz)2(N3)]NO3 (atrz = 4-amino-1,2,4-triazole)","Journal of the Chemical Society, Dalton Transactions","1999","","14","2337","","10.1039/a900619b","","","0.71073","MoKα","","0.0489","0.0466","","0.1352","0.1312","","","","1.051","1.063","1.063","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027279","37.95","0.008","11.286","0.002","27.859","0.006","90","","104.7","0.03","90","","11542","4","294","2","294","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H49 Cl5 Cu La N5 O37 -","- C35 H49 Cl5 Cu La N5 O37 -","- C280 H392 Cl40 Cu8 La8 N40 O296 -","8","1","","Yang, Yang-Yi; Wu, Yu-Luan; Long, La-Sheng; Chen, Xiao-Ming","Synthesis and structures of carboxylate-bridged polynuclear copper(II)‒lanthanide(III) complexes [CuLn(C5H5N+CH2CO2−)5(H2O)5][ClO4]5·2H2O (Ln = La or Nd) and [Cu3Nd2(C5H5N+CH2CO2−)10(NO3)2(H2O)8][ClO4]10·4H2O","Journal of the Chemical Society, Dalton Transactions","1999","","12","2005","","10.1039/a900647h","","","0.71073","MoKα","","0.0943","0.0513","","","0.141","0.1661","","","","","","1.04","","","","has coordinates,has disorder","179978","2020-10-21","18:00:00",""
"7027280","37.51","0.02","11.172","0.003","27.557","0.014","90","","104.81","0.01","90","","11164","9","294","2","294","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C35 H49 Cl5 Cu N5 Nd O37 -","- C35 H49 Cl5 Cu N5 Nd O37 -","- C280 H392 Cl40 Cu8 N40 Nd8 O296 -","8","1","","Yang, Yang-Yi; Wu, Yu-Luan; Long, La-Sheng; Chen, Xiao-Ming","Synthesis and structures of carboxylate-bridged polynuclear copper(II)‒lanthanide(III) complexes [CuLn(C5H5N+CH2CO2−)5(H2O)5][ClO4]5·2H2O (Ln = La or Nd) and [Cu3Nd2(C5H5N+CH2CO2−)10(NO3)2(H2O)8][ClO4]10·4H2O","Journal of the Chemical Society, Dalton Transactions","1999","","12","2005","","10.1039/a900647h","","","0.71073","MoKα","","0.116","0.0457","","","0.156","0.1843","","","","","","1.024","","","","has coordinates,has disorder","179978","2020-10-21","18:00:00",""
"7027281","11.41","0.004","14.992","0.006","18.447","0.007","73.38","0.01","72.14","0.01","88.9","0.01","2869.8","1.9","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C70 H94 Cl10 Cu3 N12 Nd2 O78 -","- C70 H94 Cl10 Cu3 N12 Nd2 O78 -","- C70 H94 Cl10 Cu3 N12 Nd2 O78 -","1","0.5","","Yang, Yang-Yi; Wu, Yu-Luan; Long, La-Sheng; Chen, Xiao-Ming","Synthesis and structures of carboxylate-bridged polynuclear copper(II)‒lanthanide(III) complexes [CuLn(C5H5N+CH2CO2−)5(H2O)5][ClO4]5·2H2O (Ln = La or Nd) and [Cu3Nd2(C5H5N+CH2CO2−)10(NO3)2(H2O)8][ClO4]10·4H2O","Journal of the Chemical Society, Dalton Transactions","1999","","12","2005","","10.1039/a900647h","","","0.71073","MoKα","","0.0733","0.0502","","","0.1212","0.1344","","","","","","1.032","","","","has coordinates,has disorder","179978","2020-10-21","18:00:00",""
"7027282","12.828","0.003","13.962","0.007","9.859","0.003","94.71","0.03","90.39","0.02","81.77","0.03","1741.7","1.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","[2-Hydroxy-5-methyl-benzaldehydo][hydrido-tris-{3-phenylpyrazol-1-yl}borato] copper(II) dichloromethane solvate","","- C36 H31 B Cl2 Cu N6 O2 -","- C36 H31 B Cl2 Cu N6 O2 -","- C72 H62 B2 Cl4 Cu2 N12 O4 -","2","1","","Halcrow, Malcolm A.; LindyChia, Li Mei; Liu, Xiaoming; McInnes, Eric J. L.; Yellowlees, Lesley J.; Mabbs, Frank E.; Scowen, Ian J.; McPartlin, Mary; Davies, John E.","Syntheses, structures and electrochemistry of copper(II) salicylaldehyde/tris(3-phenylpyrazolyl)borate complexes as models for the radical copper oxidases","Journal of the Chemical Society, Dalton Transactions","1999","","11","1753","","10.1039/a900741e","","","0.71069","MoKα","","0.2173","0.0735","","0.2489","0.1783","","","","1.068","1.172","1.172","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027283","12.203","0.003","13.957","0.005","11.703","0.005","114.02","0.03","93.03","0.03","98.48","0.03","1786.6","1.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","[N-methyl-2-hydroxy-5-methylbenzaldimino][hydrido-tris-{3-phenylpyrazol-1-yl}- borato]copper(II) dichloromethane solvate","","- C37 H34 B Cl2 Cu N7 O -","- C37 H34 B Cl2 Cu N7 O -","- C74 H68 B2 Cl4 Cu2 N14 O2 -","2","1","","Halcrow, Malcolm A.; LindyChia, Li Mei; Liu, Xiaoming; McInnes, Eric J. L.; Yellowlees, Lesley J.; Mabbs, Frank E.; Scowen, Ian J.; McPartlin, Mary; Davies, John E.","Syntheses, structures and electrochemistry of copper(II) salicylaldehyde/tris(3-phenylpyrazolyl)borate complexes as models for the radical copper oxidases","Journal of the Chemical Society, Dalton Transactions","1999","","11","1753","","10.1039/a900741e","","","0.71069","MoKα","","0.0493","0.0403","","","0.1047","0.1103","","","","","","1.043","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027284","12.68","0.002","18.89","0.003","15.5439","0.0014","90","","110.412","0.012","90","","3489.4","0.9","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[N-Phenyl-2-hydroxy-5-methylbenzaldimino][hydrido-tris-{3-phenylpyrazol-1-yl}- borato]copper(II)","","- C41 H34 B Cu N7 O -","- C41 H34 B Cu N7 O -","- C164 H136 B4 Cu4 N28 O4 -","4","1","","Halcrow, Malcolm A.; LindyChia, Li Mei; Liu, Xiaoming; McInnes, Eric J. L.; Yellowlees, Lesley J.; Mabbs, Frank E.; Scowen, Ian J.; McPartlin, Mary; Davies, John E.","Syntheses, structures and electrochemistry of copper(II) salicylaldehyde/tris(3-phenylpyrazolyl)borate complexes as models for the radical copper oxidases","Journal of the Chemical Society, Dalton Transactions","1999","","11","1753","","10.1039/a900741e","","","0.71073","MoKα","","0.0957","0.0483","","0.1302","0.1038","","","","1.014","1.065","1.065","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027285","23.41","0.004","16.013","0.007","15.006","0.008","90","","108.23","0.03","90","","5343","4","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H23.6 N6 O7.8 Rh -","- C24 H16 N6 O7.09 Rh -","- C192 H128 N48 O56.72 Rh8 -","8","1","","Paul, Parimal; Tyagi, Beena; Bilakhiya, Anvarhusen K.; Bhadbhade, Mohan M.; Suresh, E.","Stable mononuclear rhodium(II) polypyridyl complexes: synthesis, spectroscopic and structural characterisation","Journal of the Chemical Society, Dalton Transactions","1999","","12","2009","","10.1039/a900757a","","","0.7093","","","0.0734","0.0594","","","0.1871","0.1957","","","","","","1.073","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027286","9.072","0.004","11.749","0.003","16.605","0.005","75.09","0.02","77.14","0.03","89.52","0.03","1665.1","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H35 Cl N6 O10 Rh -","- C27 H34.5 Cl N6 O10 Rh -","- C54 H69 Cl2 N12 O20 Rh2 -","2","1","","Paul, Parimal; Tyagi, Beena; Bilakhiya, Anvarhusen K.; Bhadbhade, Mohan M.; Suresh, E.","Stable mononuclear rhodium(II) polypyridyl complexes: synthesis, spectroscopic and structural characterisation","Journal of the Chemical Society, Dalton Transactions","1999","","12","2009","","10.1039/a900757a","","","0.7107","MoKα","","0.0489","0.0447","","","0.141","0.1438","","","","","","1.061","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027287","15.743","0.004","15.694","0.003","13.584","0.002","73.46","0.01","79.01","0.02","84.68","0.02","3155.7","1.1","296.2","","296.2","","","","","","","","","7","P -1","-P 1","2","","","","- C39 H58 Ag3 Cl3 N4 O13 S16 -","- C39.54 H52 Ag3 Cl3 N4 O13 S16 -","- C79.08 H104 Ag6 Cl6 N8 O26 S32 -","2","1","","Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Munakata, Megumu","Two-dimensional supramolecular co-ordination compounds of silver(I) with box structures","Journal of the Chemical Society, Dalton Transactions","1999","","16","2737","","10.1039/a900789j","","","0.7107","MoKα","","0.1985","0.0836","","","0.1754","0.2085","","","","","","1.242","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027288","15.894","0.005","8.523","0.002","16.078","0.001","90","","110.779","0.002","90","","2036.3","0.8","273.2","","273.2","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C12 H13 Ag F5 N O2 S4 -","- C12 H13 Ag F5 N O2 S4 -","- C48 H52 Ag4 F20 N4 O8 S16 -","4","1","","Suenaga, Yusaku; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Munakata, Megumu","Two-dimensional supramolecular co-ordination compounds of silver(I) with box structures","Journal of the Chemical Society, Dalton Transactions","1999","","16","2737","","10.1039/a900789j","","","0.7107","MoKα","","0.1001","0.0686","","","0.1599","0.1731","","","","","","1.851","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027289","19.62","0.003","7.576","0.001","25.074","0.003","90","0","102.4","0.01","90","0","3640.1","0.9","295","","295","","","","","","","","?","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H24 Cl2 N11 O Tc -","- C8 H24 Cl2 N11 O Tc -","- C64 H192 Cl16 N88 O8 Tc8 -","8","1","","Marchi, Andrea; Marvelli, Lorenza; Cattabriga, Michela; Rossi, Roberto; Neves, Maria; Bertolasi, Valerio; Ferretti, Valeria","Technetium(V) and rhenium(V) complexes of biguanide derivatives. Crystal structures","Journal of the Chemical Society, Dalton Transactions","1999","","12","1937","","10.1039/a900798i","","","0.71069","MoKα","","","0.021","","","","0.027","","","","","","2.34","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027290","11.589","0.002","15.918","0.002","18.962","0.004","90","0","96.97","0.01","90","0","3472.1","1","295","","295","","","","","","","","?","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H44 B N10 O2 Tc -","- C33 H44 B N10 O2 Tc -","- C132 H176 B4 N40 O8 Tc4 -","4","1","","Marchi, Andrea; Marvelli, Lorenza; Cattabriga, Michela; Rossi, Roberto; Neves, Maria; Bertolasi, Valerio; Ferretti, Valeria","Technetium(V) and rhenium(V) complexes of biguanide derivatives. Crystal structures","Journal of the Chemical Society, Dalton Transactions","1999","","12","1937","","10.1039/a900798i","","","0.71069","MoKα","","","0.042","","","","0.062","","","","","","2.23","","","","has coordinates","191973","2020-10-21","18:00:00",""
"7027291","11.24","0.002","12.224","0.003","12.359","0.003","62.36","0.02","77.69","0.02","85.73","0.02","1469.1","0.6","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C25 H21 B Cl2 Co F6 N9 P -","- C25 H21 B Cl2 Co F6 N9 P -","- C50 H42 B2 Cl4 Co2 F12 N18 P2 -","2","1","","Paul, Rowena L.; Amoroso, Angelo J.; Jones, Peter L.; Couchman, Samantha M.; Reeves, Zoe R.; Rees, Leigh H.; Jeffery, John C.; McCleverty, Jon A.; Ward, Michael D.","Effects of metal co-ordination geometry on self-assembly: a monomeric complex with trigonal prismatic metal co-ordination vs. tetrameric complexes with octahedral metal co-ordination","Journal of the Chemical Society, Dalton Transactions","1999","","10","1563","","10.1039/a900805e","","","0.71073","MoKα","","0.1372","0.0737","","0.2078","0.1733","","","","1.009","1.13","1.13","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027292","21.778","0.008","20.352","0.006","28.898","0.009","90","","103.83","0.03","90","","12437","7","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C108 H98 B4 F24 Mn4 N40 O P4 -","- C108 H98 B4 F24 Mn4 N39.7 O P4 -","- C432 H392 B16 F96 Mn16 N158.8 O4 P16 -","4","1","","Paul, Rowena L.; Amoroso, Angelo J.; Jones, Peter L.; Couchman, Samantha M.; Reeves, Zoe R.; Rees, Leigh H.; Jeffery, John C.; McCleverty, Jon A.; Ward, Michael D.","Effects of metal co-ordination geometry on self-assembly: a monomeric complex with trigonal prismatic metal co-ordination vs. tetrameric complexes with octahedral metal co-ordination","Journal of the Chemical Society, Dalton Transactions","1999","","10","1563","","10.1039/a900805e","","","0.71073","MoKα","","0.0857","0.0643","","0.169","0.1529","","","","1.092","1.135","1.135","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027293","26.528","0.006","26.528","0.006","36.863","0.013","90","","90","","120","","22466","11","293","2","293","2","","","","","","","","8","R -3 :H","-R 3","148","","","","- C120 H149 B4 F18 N36 O13 P3 Zn4 -","- C132 H76 B4 F18 N36 P3 Zn4 -","- C792 H456 B24 F108 N216 P18 Zn24 -","6","0.333333","","Paul, Rowena L.; Amoroso, Angelo J.; Jones, Peter L.; Couchman, Samantha M.; Reeves, Zoe R.; Rees, Leigh H.; Jeffery, John C.; McCleverty, Jon A.; Ward, Michael D.","Effects of metal co-ordination geometry on self-assembly: a monomeric complex with trigonal prismatic metal co-ordination vs. tetrameric complexes with octahedral metal co-ordination","Journal of the Chemical Society, Dalton Transactions","1999","","10","1563","","10.1039/a900805e","","","0.71073","MoKα","","0.1281","0.0828","","0.2662","0.2166","","","","1.047","1.111","1.111","","","","","has coordinates","179978","2020-10-21","18:00:00",""
"7027294","18.291","0.002","22.321","0.003","24.103","0.003","90","","104.946","0.013","90","","9508","2","173","2","173","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C78 H84 B2 F18 N24 O8 P4 Zn4 -","- C78 H84 B2 F18 N24 O8 P4 Zn4 -","- C312 H336 B8 F72 N96 O32 P16 Zn16 -","4","0.5","","Paul, Rowena L.; Amoroso, Angelo J.; Jones, Peter L.; Couchman, Samantha M.; Reeves, Zoe R.; Rees, Leigh H.; Jeffery, John C.; McCleverty, Jon A.; Ward, Michael D.","Effects of metal co-ordination geometry on self-assembly: a monomeric complex with trigonal prismatic metal co-ordination vs. tetrameric complexes with octahedral metal co-ordination","Journal of the Chemical Society, Dalton Transactions","1999","","10","1563","","10.1039/a900805e","","","0.71073","MoKα","","0.1106","0.0592","","0.1643","0.1382","","","","1.025","1.118","1.118","","","","","has coordinates","187625","2020-10-21","18:00:00",""
"7027295","20.998","0.001","15.341","0.002","21.779","0.002","90","","90","","90","","7015.7","1.2","298.2","","298.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C25 H20 O15 Os6 S2 -","- C25 H20 O15 Os6 S2 -","- C200 H160 O120 Os48 S16 -","8","1","","Leung, Kelvin Sze-Yin; Wong, Wing-Tak","Synthesis, structural characterization and reactivities of hexaosmium carbonyl clusters with six-membered cyclic thioether and thioxane ligands","Journal of the Chemical Society, Dalton Transactions","1999","","12","2077","","10.1039/a900808j","","","0.7107","MoKalpha","","","0.0502","","","0.0511","","","","","1.495","1.495","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027296","9.062","0.001","16.484","0.002","18.892","0.002","90","","94.76","0.01","90","","2812.3","0.6","298.2","","298.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H10 O15 Os5 S -","- C20 H10 O15 Os5 S -","- C80 H40 O60 Os20 S4 -","4","1","","Leung, Kelvin Sze-Yin; Wong, Wing-Tak","Synthesis, structural characterization and reactivities of hexaosmium carbonyl clusters with six-membered cyclic thioether and thioxane ligands","Journal of the Chemical Society, Dalton Transactions","1999","","12","2077","","10.1039/a900808j","","","0.7107","MoKalpha","","","0.0453","","","0.0528","","","","","1.489","1.489","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027297","11.976","0.003","13.059","0.004","9.823","0.002","90.43","0.02","90.44","0.02","87.36","0.02","1534.5","0.7","298.2","","298.2","","","","","","","","","5","P -1","-P 1","2","","","","- C20 H8 O16 Os6 S2 -","- C20 H8 O16 Os6 S2 -","- C40 H16 O32 Os12 S4 -","2","1","","Leung, Kelvin Sze-Yin; Wong, Wing-Tak","Synthesis, structural characterization and reactivities of hexaosmium carbonyl clusters with six-membered cyclic thioether and thioxane ligands","Journal of the Chemical Society, Dalton Transactions","1999","","12","2077","","10.1039/a900808j","","","0.7107","MoKalpha","","","0.0665","","","0.0665","","","","","1.708","1.708","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027298","9.181","0.001","28.787","0.001","16.533","0.001","90","","102.38","0.01","90","","4268","0.6","298.2","","298.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27.5 H20 O16 Os6 S4 -","- C31 H24 O16 Os6 S4 -","- C124 H96 O64 Os24 S16 -","4","1","","Leung, Kelvin Sze-Yin; Wong, Wing-Tak","Synthesis, structural characterization and reactivities of hexaosmium carbonyl clusters with six-membered cyclic thioether and thioxane ligands","Journal of the Chemical Society, Dalton Transactions","1999","","12","2077","","10.1039/a900808j","","","0.7107","MoKalpha","","","0.0651","","","0.0703","","","","","0.97","0.97","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027299","10.12","0.001","11.17","0.001","29.792","0.003","90","","90","","90","","3367.7","0.6","298.2","","298.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21.5 H10 O15 Os6 S3 -","- C25 H14 O15 Os6 S3 -","- C100 H56 O60 Os24 S12 -","4","1","","Leung, Kelvin Sze-Yin; Wong, Wing-Tak","Synthesis, structural characterization and reactivities of hexaosmium carbonyl clusters with six-membered cyclic thioether and thioxane ligands","Journal of the Chemical Society, Dalton Transactions","1999","","12","2077","","10.1039/a900808j","","","0.7107","MoKalpha","","","0.062","","","0.0499","","","","","1.554","1.554","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027300","10.314","0.001","12.16","0.002","14.42","0.002","108.01","0.02","92.8","0.01","102.84","0.02","1663.4","0.5","298.2","","298.2","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H16 O17 Os6 S2 -","- C23 H16 O17 Os6 S2 -","- C46 H32 O34 Os12 S4 -","2","1","","Leung, Kelvin Sze-Yin; Wong, Wing-Tak","Synthesis, structural characterization and reactivities of hexaosmium carbonyl clusters with six-membered cyclic thioether and thioxane ligands","Journal of the Chemical Society, Dalton Transactions","1999","","12","2077","","10.1039/a900808j","","","0.7107","MoKalpha","","","0.0478","","","0.0621","","","","","1.397","1.397","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027301","15.251","0.001","12.358","0.001","16.422","0.002","90","","102.29","0.01","90","","3024.2","0.5","298.2","","298.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H8 O17 Os6 S -","- C20 H8 O17 Os6 S -","- C80 H32 O68 Os24 S4 -","4","1","","Leung, Kelvin Sze-Yin; Wong, Wing-Tak","Synthesis, structural characterization and reactivities of hexaosmium carbonyl clusters with six-membered cyclic thioether and thioxane ligands","Journal of the Chemical Society, Dalton Transactions","1999","","12","2077","","10.1039/a900808j","","","0.7107","MoKalpha","","","0.0525","","","0.0633","","","","","0.935","0.935","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027302","8.992","0.001","10.348","0.002","18.637","0.002","99","0.02","94.67","0.01","104.25","0.01","1647","0.4","298.2","","298.2","","","","","","","","","5","P -1","-P 1","2","","","","- C23 H18 O17 Os6 S2 -","- C23 H18 O17 Os6 S2 -","- C46 H36 O34 Os12 S4 -","2","1","","Leung, Kelvin Sze-Yin; Wong, Wing-Tak","Synthesis, structural characterization and reactivities of hexaosmium carbonyl clusters with six-membered cyclic thioether and thioxane ligands","Journal of the Chemical Society, Dalton Transactions","1999","","12","2077","","10.1039/a900808j","","","0.7107","MoKalpha","","","0.0605","","","0.0654","","","","","0.979","0.979","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027303","18.4057","0.0001","12.6864","0.001","18.3183","0.0001","90","","107.477","0.005","90","","4079.9","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H40 Fe3 O6 S2 W2 -","- C42 H40 Fe3 O6 S2 W2 -","- C168 H160 Fe12 O24 S8 W8 -","4","1","","Mathur, Pradeep; Ahmed, Moawia O.; Dash, Aswini K.; Walawalkar, Mrinalini G.","Tail-to-tail carbon‒carbon bond coupling of acetylides on chalcogen-bridged Fe/W mixed-metal clusters","Journal of the Chemical Society, Dalton Transactions","1999","","11","1795","","10.1039/a900828d","","","0.71073","MoKα","","0.0356","0.0291","","","0.061","0.0645","","","","","","1.244","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027304","28.2861","0.0013","40.881","0.003","29.318","0.002","90","","96.882","0.004","90","","33658","4","123","2","123","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C243 H429 Cl15 N8 O94 U8 -","- C249 Cl15 N8 O88 U8 -","- C996 Cl60 N32 O352 U32 -","4","1","","Thuéry, Pierre; Nierlich, Martine; Baldwin, Bruce W.; Komatsuzaki, Nobuko; Hirose, Takuji","A metal-organic molecular box obtained from self-assembling around uranyl ions","Journal of the Chemical Society, Dalton Transactions","1999","","7","1047","","10.1039/a900845d","","","0.71073","MoKα","","","0.1465","","","0.2823","","","","1.623","","","","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027305","11.0847","0.0015","15.223","0.002","17.755","0.003","95.503","0.003","90.037","0.004","99.812","0.004","2938.1","0.7","160","2","160","2","","","","","","","","7","P -1","-P 1","2","","","","- C24 H47 Li N O2 P Si2 -","- C24 H47 Li N O2 P Si2 -","- C96 H188 Li4 N4 O8 P4 Si8 -","4","2","","Clegg, William; Doherty, Simon; Izod, Keith; Kagerer, Hartmut; O’Shaughnessy, Paul; Sheffield, Joanne M.","Monomeric alkali metal complexes of a sterically demanding, donor-functionalised secondary phosphide ligand","Journal of the Chemical Society, Dalton Transactions","1999","","11","1825","","10.1039/a900869a","","","0.71073","MoKα","","0.1819","0.0884","","","0.2015","0.245","","","","","","0.917","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027306","9.5849","0.0015","11.8767","0.0018","14.424","0.002","67.669","0.004","87.913","0.004","71.329","0.003","1432.1","0.4","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C22 H47 N3 Na P Si2 -","- C22 H47 N3 Na P Si2 -","- C44 H94 N6 Na2 P2 Si4 -","2","1","","Clegg, William; Doherty, Simon; Izod, Keith; Kagerer, Hartmut; O’Shaughnessy, Paul; Sheffield, Joanne M.","Monomeric alkali metal complexes of a sterically demanding, donor-functionalised secondary phosphide ligand","Journal of the Chemical Society, Dalton Transactions","1999","","11","1825","","10.1039/a900869a","","","0.71073","MoKα","","0.0685","0.0439","","","0.1057","0.1164","","","","","","1.011","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027307","10.174","0.0002","28.7226","0.0006","12.1761","0.0003","90","","108.877","0.001","90","","3366.77","0.13","160","2","160","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H54 K N4 P Si2 -","- C25 H54 K N4 P Si2 -","- C100 H216 K4 N16 P4 Si8 -","4","1","","Clegg, William; Doherty, Simon; Izod, Keith; Kagerer, Hartmut; O’Shaughnessy, Paul; Sheffield, Joanne M.","Monomeric alkali metal complexes of a sterically demanding, donor-functionalised secondary phosphide ligand","Journal of the Chemical Society, Dalton Transactions","1999","","11","1825","","10.1039/a900869a","","","0.71073","MoKα","","0.0815","0.0447","","","0.0921","0.1058","","","","","","1.016","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027308","13.7111","0.0009","7.5225","0.0005","10.5662","0.0007","90","","107.448","0.005","90","","1039.67","0.12","168","2","168","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H13 Fe P -","- C11 H13 Fe P -","- C44 H52 Fe4 P4 -","4","1","","Goodwin, Nicholas J.; Henderson, William; Nicholson, Brian K.; Fawcett, John; Russell, David R.","(Ferrocenylmethyl)phosphine, an air-stable primary phosphine","Journal of the Chemical Society, Dalton Transactions","1999","","11","1785","","10.1039/a901036j","","","0.71073","MoKα","","0.0594","0.0417","","","0.0996","0.1187","","","","","","1.146","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027309","20.626","0.003","10.426","0.002","12.324","0.001","90","","90.95","0.01","90","","2649.9","0.7","168","2","168","2","","","","","","","inorganic synthesis","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H26 Fe2 Mo O4 P2 -","- C26 H26 Fe2 Mo O4 P2 -","- C104 H104 Fe8 Mo4 O16 P8 -","4","0.5","","Goodwin, Nicholas J.; Henderson, William; Nicholson, Brian K.; Fawcett, John; Russell, David R.","(Ferrocenylmethyl)phosphine, an air-stable primary phosphine","Journal of the Chemical Society, Dalton Transactions","1999","","11","1785","","10.1039/a901036j","","","0.71073","MoKα","","0.1255","0.0621","","0.1495","0.1237","","","","1.067","1.173","1.173","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027310","9.961","0.001","15.506","0.003","16.496","0.002","83.96","0.01","88.72","0.01","80.79","0.01","2501","0.6","200","2","200","2","","","","","","","","6","P -1","-P 1","2","","","","- C20 H13 Fe O9 P Ru3 -","- C20 H13 Fe O9 P Ru3 -","- C80 H52 Fe4 O36 P4 Ru12 -","4","2","","Goodwin, Nicholas J.; Henderson, William; Nicholson, Brian K.; Fawcett, John; Russell, David R.","(Ferrocenylmethyl)phosphine, an air-stable primary phosphine","Journal of the Chemical Society, Dalton Transactions","1999","","11","1785","","10.1039/a901036j","","","0.71073","MoKα","","0.0263","0.022","","0.0493","0.048","","","","1.079","1.106","1.106","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027311","7.4816","0.0001","10.4412","0.0001","11.5305","0.0001","90","","96.78","0.001","90","","894.428","0.017","203","2","203","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C16 H13 Fe Mo O5 P -","- C16 H13 Fe Mo O5 P -","- C32 H26 Fe2 Mo2 O10 P2 -","2","1","","Goodwin, Nicholas J.; Henderson, William; Nicholson, Brian K.; Fawcett, John; Russell, David R.","(Ferrocenylmethyl)phosphine, an air-stable primary phosphine","Journal of the Chemical Society, Dalton Transactions","1999","","11","1785","","10.1039/a901036j","","","0.71073","MoKα","","0.023","0.0213","","","0.0469","0.0476","","","","","","1.037","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027312","13.926","0.003","14.593","0.003","14.631","0.005","88.9","0.02","88.7","0.02","62.674","0.014","2640.7","1.2","220","2","220","2","","","","","","","","6","P -1","-P 1","2","Tetrazinc N-bis(mercaptoethyl)benzylamine","","","- C46 H65 N4 O0.5 S8 Zn4 -","- C46 H60 N4 O0.5 S8 Zn4 -","- C92 H120 N8 O S16 Zn8 -","2","1","","Spencer, Douglas J. E.; Blake, Alexander J.; Parsons, Simon; Schröder, Martin","The synthesis and structure of a neutral tetranuclear zinc(II) complex [Zn4(L)4] [LH2 = N,N-bis(2-mercaptoethyl)benzylamine]","Journal of the Chemical Society, Dalton Transactions","1999","","7","1041","","10.1039/a901251f","","","1.54184","CuKα","","0.0777","0.0448","","","0.0945","0.1039","","","","","","0.921","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027313","25.06","0.007","13.434","0.003","19.625","0.005","90","","104.95","0.04","90","","6383","3","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C33.5 H29 Cl3 Ir O0.5 P2 S -","- C33.5 H29 Cl3 Ir O0.5 P2 S -","- C268 H232 Cl24 Ir8 O4 P16 S8 -","8","1","","Dilworth, Jonathan R.; Zheng, Yifan; Vaughan Griffiths, D.","Binuclear complexes with ligands based on the 2,6-bis(diphenylphosphinomethyl)benzene framework. Syntheses and crystal structures of [Ir2Cl2(μ-CO){2,6-(Ph2PCH2)2C6H3S}2]·2CH2Cl2, [Ni2{2,6-(Ph2PCH2)2C6H4S}2][PF6]2·Et2O·0.5CH2Cl2 and [Rh2Cl2(CO)2{1,3-(Ph2PCH2)2C6H4}2]","Journal of the Chemical Society, Dalton Transactions","1999","","11","1877","","10.1039/a901291e","","","0.71073","MoKα","","0.1436","0.085","","0.2294","0.2062","","","","0.962","1.085","1.085","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027314","38.985","0.012","22.435","0.005","16.46","0.002","90","","105.56","0.02","90","","13869","6","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C68.5 H65 Cl F12 Ni2 O P6 S2 -","- C68.5 H65 Cl F12 Ni2 O P6 S2 -","- C548 H520 Cl8 F96 Ni16 O8 P48 S16 -","8","1","","Dilworth, Jonathan R.; Zheng, Yifan; Vaughan Griffiths, D.","Binuclear complexes with ligands based on the 2,6-bis(diphenylphosphinomethyl)benzene framework. Syntheses and crystal structures of [Ir2Cl2(μ-CO){2,6-(Ph2PCH2)2C6H3S}2]·2CH2Cl2, [Ni2{2,6-(Ph2PCH2)2C6H4S}2][PF6]2·Et2O·0.5CH2Cl2 and [Rh2Cl2(CO)2{1,3-(Ph2PCH2)2C6H4}2]","Journal of the Chemical Society, Dalton Transactions","1999","","11","1877","","10.1039/a901291e","","","0.71073","MoKα","","0.1382","0.0616","","0.1899","0.1666","","","","0.951","1.136","1.136","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027315","12.094","0.005","16.45","0.003","14.604","0.005","90","","90.2","0.02","90","","2905.4","1.6","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C33 H28 Cl O P2 Rh -","- C33 H28 Cl O P2 Rh -","- C132 H112 Cl4 O4 P8 Rh4 -","4","1","","Dilworth, Jonathan R.; Zheng, Yifan; Vaughan Griffiths, D.","Binuclear complexes with ligands based on the 2,6-bis(diphenylphosphinomethyl)benzene framework. Syntheses and crystal structures of [Ir2Cl2(μ-CO){2,6-(Ph2PCH2)2C6H3S}2]·2CH2Cl2, [Ni2{2,6-(Ph2PCH2)2C6H4S}2][PF6]2·Et2O·0.5CH2Cl2 and [Rh2Cl2(CO)2{1,3-(Ph2PCH2)2C6H4}2]","Journal of the Chemical Society, Dalton Transactions","1999","","11","1877","","10.1039/a901291e","","","0.71073","MoKα","","0.1729","0.0609","","0.1934","0.1496","","","","0.957","1.09","1.09","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027316","22.28","0.004","20.665","0.004","16.909","0.003","90","","90","","90","","7785","2","213","2","213","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C79 H78 F12 Hg3 O4 P6 Si2 -","- C79 H66 F12 Hg3 O4 P6 Si2 -","- C316 H264 F48 Hg12 O16 P24 Si8 -","4","1","","Knoepfler-Mühlecker, Anna; Scheffter, Birgit; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Host‒guest chemistry of the cluster [Hg3(μ-dppm)3]4+ [dppm = bis(diphenylphosphino)methane] with oxo- and fluoro-anions","Journal of the Chemical Society, Dalton Transactions","1999","","15","2525","","10.1039/a901327j","","","0.71073","MoKa","","0.0833","0.0478","","0.1133","0.0985","","","","1.054","1.099","1.099","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027317","14.559","0.004","44.421","0.011","15.113","0.003","90","","115.12","0.02","90","","8850","4","213","2","213","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C77 H70 Cl4 F24 Hg3 P10 -","- C77 H70 Cl4 F24 Hg3 P10 -","- C308 H280 Cl16 F96 Hg12 P40 -","4","1","","Knoepfler-Mühlecker, Anna; Scheffter, Birgit; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Host‒guest chemistry of the cluster [Hg3(μ-dppm)3]4+ [dppm = bis(diphenylphosphino)methane] with oxo- and fluoro-anions","Journal of the Chemical Society, Dalton Transactions","1999","","15","2525","","10.1039/a901327j","","","0.71073","MoKa","","0.1153","0.0646","","0.253","0.1438","","","","1.142","1.221","1.221","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027318","14.831","0.005","15.045","0.005","23.19","0.005","100.74","0.03","96.81","0.04","112.99","0.04","4574","3","188","2","188","2","","","","","","","","7","P -1","-P 1","2","","","","- C80 H70 F12 Hg3 O13 P6 S4 -","- C80 H66 F12 Hg3 O13 P6 S4 -","- C160 H132 F24 Hg6 O26 P12 S8 -","2","1","","Knoepfler-Mühlecker, Anna; Scheffter, Birgit; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Host‒guest chemistry of the cluster [Hg3(μ-dppm)3]4+ [dppm = bis(diphenylphosphino)methane] with oxo- and fluoro-anions","Journal of the Chemical Society, Dalton Transactions","1999","","15","2525","","10.1039/a901327j","","","0.71073","MoKα","","0.1017","0.069","","0.2137","0.1473","","","","1.104","1.158","1.158","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027319","14.392","0.003","26.773","0.005","23.723","0.002","90","","99.51","0.03","90","","9015","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C79 H66 F12 Hg3 O12 P6 S4 -","- C79 H66 F12 Hg3 O12 P6 S4 -","- C316 H264 F48 Hg12 O48 P24 S16 -","4","1","","Knoepfler-Mühlecker, Anna; Scheffter, Birgit; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Host‒guest chemistry of the cluster [Hg3(μ-dppm)3]4+ [dppm = bis(diphenylphosphino)methane] with oxo- and fluoro-anions","Journal of the Chemical Society, Dalton Transactions","1999","","15","2525","","10.1039/a901327j","","","0.71073","MoKa","","0.1424","0.0656","","0.2228","0.1628","","","","1.041","1.145","1.145","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027320","14.92","0.003","15.036","0.003","22.182","0.004","83.19","0.02","71.49","0.02","65.96","0.02","4309.2","1.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C79 H86 Hg3 O16 P6 S4 -","- C79 H78 Hg3 O16 P6 S4 -","- C158 H156 Hg6 O32 P12 S8 -","2","1","","Knoepfler-Mühlecker, Anna; Scheffter, Birgit; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Host‒guest chemistry of the cluster [Hg3(μ-dppm)3]4+ [dppm = bis(diphenylphosphino)methane] with oxo- and fluoro-anions","Journal of the Chemical Society, Dalton Transactions","1999","","15","2525","","10.1039/a901327j","","","0.71073","MoKa","","0.0858","0.0642","","0.2192","0.1732","","","","1.052","1.094","1.094","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027321","23.95","0.002","21.752","0.003","19.594","0.003","90","","111.13","0.01","90","","9521","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C79 H78 Hg3 O12 P6 S4 -","- C79 H78 Hg3 O12 P6 S4 -","- C316 H312 Hg12 O48 P24 S16 -","4","1","","Knoepfler-Mühlecker, Anna; Scheffter, Birgit; Kopacka, Holger; Wurst, Klaus; Peringer, Paul","Host‒guest chemistry of the cluster [Hg3(μ-dppm)3]4+ [dppm = bis(diphenylphosphino)methane] with oxo- and fluoro-anions","Journal of the Chemical Society, Dalton Transactions","1999","","15","2525","","10.1039/a901327j","","","0.71073","MoKα","","0.1187","0.0628","","0.181","0.1436","","","","1.04","1.128","1.128","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027322","11.191","0.0015","13.1465","0.0015","17.506","0.002","104.763","0.01","94.315","0.011","103.276","0.01","2399.3","0.5","160","2","160","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H48 B F15 Hf O Si2 -","- C46 H48 B F15 Hf O Si2 -","- C92 H96 B2 F30 Hf2 O2 Si4 -","2","1","","Pindado, Gerardo Jiménez; Thornton-Pett, Mark; Hursthouse, Michael B.; Coles, Simon J.; Bochmann, M.","Reaction of B(C6F5)3 with zirconium and hafnium benzyl diene complexes. The crystal and molecular structures of Cp″Zr(C6F5){η4-CH2CMeCHCHB(C6F5)2} and [Cp″Hf(2,3-Me2C4H4)(OEt2)][PhCH2B(C6F5)3] [Cp″ = 1,3-(SiMe3)2C5H3]","Journal of the Chemical Society, Dalton Transactions","1999","","10","1663","","10.1039/a901347d","","","0.71073","MoKα","","0.0229","0.0202","","","0.0465","0.0483","","","","","","1.084","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027323","10.068","0.007","11.442","0.016","16.218","0.017","96.79","0.03","105.19","0.05","94.15","0.06","1780","3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H28 B F15 Si2 Zr -","- C34 H28 B F15 Si2 Zr -","- C68 H56 B2 F30 Si4 Zr2 -","2","1","","Pindado, Gerardo Jiménez; Thornton-Pett, Mark; Hursthouse, Michael B.; Coles, Simon J.; Bochmann, M.","Reaction of B(C6F5)3 with zirconium and hafnium benzyl diene complexes. The crystal and molecular structures of Cp″Zr(C6F5){η4-CH2CMeCHCHB(C6F5)2} and [Cp″Hf(2,3-Me2C4H4)(OEt2)][PhCH2B(C6F5)3] [Cp″ = 1,3-(SiMe3)2C5H3]","Journal of the Chemical Society, Dalton Transactions","1999","","10","1663","","10.1039/a901347d","","","0.71069","MoKα","","0.1257","0.0734","","0.172","0.1534","","","","0.831","1.119","1.119","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027324","13.423","0.0014","17.641","0.002","17.946","0.002","101.79","0.013","109.224","0.012","92.608","0.013","3898.6","0.8","193","2","193","2","","","","","","","","8","P -1","-P 1","2","","","","- C73 H86 B F24 N2 O2.5 P2 Re -","- C73 H86 B F24 N2 O2.5 P2 Re -","- C146 H172 B2 F48 N4 O5 P4 Re2 -","2","1","","Jacobsen, Heiko; Heinze, Katja; Llamazares, Angela; Schmalle, Helmut W.; Artus, Georg; Berke, Heinz","Co-ordination chemistry of the [Re(NO)2(PR3)2]+ fragment: crystallographic and computational studies †","Journal of the Chemical Society, Dalton Transactions","1999","","11","1717","","10.1039/a901384i","","","0.71073","MoKα","","0.1017","0.0738","","","0.1747","0.1864","","","","","","1.091","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027325","12.9909","0.0012","16.67","0.0016","19.0701","0.0019","79.633","0.012","71.952","0.011","79.44","0.011","3826.4","0.7","193","2","193","2","","","","","","","","9","P -1","-P 1","2","","Bis(tricyclohexylphosphine)carbonyldinitrosylrhenium(-I) Tetrakis(3,5-bis(trifluoromethyl)phenyl)borate","","- C69.5 H79 B Cl F24 N2 O3 P2 Re -","- C69.5 H79 B Cl F24 N2 O3 P2 Re -","- C139 H158 B2 Cl2 F48 N4 O6 P4 Re2 -","2","1","","Jacobsen, Heiko; Heinze, Katja; Llamazares, Angela; Schmalle, Helmut W.; Artus, Georg; Berke, Heinz","Co-ordination chemistry of the [Re(NO)2(PR3)2]+ fragment: crystallographic and computational studies †","Journal of the Chemical Society, Dalton Transactions","1999","","11","1717","","10.1039/a901384i","","","0.71073","MoKα","","0.0823","0.0616","","","0.1585","0.1977","","","","","","1.388","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027326","13.892","0.003","18.768","0.003","19.569","0.003","97.76","0.02","107.96","0.02","102.88","0.02","4615.8","1.7","153","","153","","","","","","","","?","8","P -1","-P 1","2","","","","- C93 H102 B F24 N2 O3 P2 Re -","- C93 H102.001 B F24.0012 N2 O3 P2 Re -","- C186 H204.002 B2 F48.0024 N4 O6 P4 Re2 -","2","1","","Jacobsen, Heiko; Heinze, Katja; Llamazares, Angela; Schmalle, Helmut W.; Artus, Georg; Berke, Heinz","Co-ordination chemistry of the [Re(NO)2(PR3)2]+ fragment: crystallographic and computational studies †","Journal of the Chemical Society, Dalton Transactions","1999","","11","1717","","10.1039/a901384i","","","0.71073","MoKa","","","0.0539","","","0.0385","","","","","0.9612","0.9612","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027327","14.256","0.002","16.859","0.002","17.771","0.002","97.22","0.01","93.87","0.01","96.11","0.01","4199","0.9","183","5","183","5","","","","","","","?","7","P -1","-P 1","2","","","","- C68 H97 B F24 N4 O4 P4 -","- C68 H97 B F24 N4 O4 P4 Re2 -","- C136 H194 B2 F48 N8 O8 P8 Re4 -","2","1","","Jacobsen, Heiko; Heinze, Katja; Llamazares, Angela; Schmalle, Helmut W.; Artus, Georg; Berke, Heinz","Co-ordination chemistry of the [Re(NO)2(PR3)2]+ fragment: crystallographic and computational studies †","Journal of the Chemical Society, Dalton Transactions","1999","","11","1717","","10.1039/a901384i","","","0.71073","MoKα","","","0.1104","","","0.0813","","","","","1.1395","1.1395","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027328","11.274","0.001","13.007","0.001","13.35","0.001","100.639","0.007","100.376","0.008","108.309","0.007","1766.1","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C34 H37 B2 Cl2 N4 O4 Re -","- C34 H37 B2 Cl2 N4 O4 Re -","- C68 H74 B4 Cl4 N8 O8 Re2 -","2","1","","Paulo, António; Ascenso, José; Domingos, Ângela; Galvão, Adelino; Santos, Isabel","Rhenium-(III) and -(V) hydride complexes with modified poly(pyrazolyl)borates","Journal of the Chemical Society, Dalton Transactions","1999","","8","1293","","10.1039/a901410a","","","0.71073","MoKα","","0.0484","0.0347","","0.0838","0.0736","","","","1.058","1.064","1.064","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027329","9.8554","0.0007","11.035","0.001","14.868","0.002","107.354","0.007","91.229","0.005","100.002","0.005","1515.3","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H39 B N4 O P Re -","- C30 H39 B N4 O P Re -","- C60 H78 B2 N8 O2 P2 Re2 -","2","1","","Paulo, António; Ascenso, José; Domingos, Ângela; Galvão, Adelino; Santos, Isabel","Rhenium-(III) and -(V) hydride complexes with modified poly(pyrazolyl)borates","Journal of the Chemical Society, Dalton Transactions","1999","","8","1293","","10.1039/a901410a","","","0.71073","MoKα","","0.0485","0.0286","","0.0944","0.0703","","","","1.014","0.975","0.975","","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027330","11.625","0.002","12.683","0.003","15.885","0.004","96.65","0.02","100.2","0.02","115.54","0.02","2030.6","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C44 H44 B N4 O2 P2 Re -","- C44 H44 B N4 O2 P2 Re -","- C88 H88 B2 N8 O4 P4 Re2 -","2","1","","Paulo, António; Ascenso, José; Domingos, Ângela; Galvão, Adelino; Santos, Isabel","Rhenium-(III) and -(V) hydride complexes with modified poly(pyrazolyl)borates","Journal of the Chemical Society, Dalton Transactions","1999","","8","1293","","10.1039/a901410a","","","0.71073","MoKα","","0.0748","0.0618","","0.1845","0.156","","","","1.123","1.127","1.127","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027331","14.4276","0.0003","17.5358","0.0001","9.9439","0.0002","90","","104.85","","90","","2431.77","0.07","293","2","293","2","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H44 N6 S4 Zn2 -","- C54 H44 N6 S4 Zn2 -","- C108 H88 N12 S8 Zn4 -","2","0.5","","Sampanthar, Jeyagowry T.; Vittal, Jagadese J.","Syntheses and crystal structures of the dimer [{Zn(SPh)2(bpy)}2(μ-bpy)] and two forms of the zigzag co-ordination polymer [{Zn(SPh)2(μ-bpy)}n], (bpy = 4,4′-bipyridyl)","Journal of the Chemical Society, Dalton Transactions","1999","","12","1993","","10.1039/a901416k","","","0.71073","MoKα","","0.0697","0.0426","","0.0839","0.0754","","","","1.039","1.105","1.105","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027332","10.8329","0.0004","13.7844","0.0005","17.0215","0.0004","69.593","0.001","88.253","0.002","87.946","0.001","2380.25","0.14","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H36 N4 S4 Zn2 -","- C44 H36 N4 S4 Zn2 -","- C88 H72 N8 S8 Zn4 -","2","1","","Sampanthar, Jeyagowry T.; Vittal, Jagadese J.","Syntheses and crystal structures of the dimer [{Zn(SPh)2(bpy)}2(μ-bpy)] and two forms of the zigzag co-ordination polymer [{Zn(SPh)2(μ-bpy)}n], (bpy = 4,4′-bipyridyl)","Journal of the Chemical Society, Dalton Transactions","1999","","12","1993","","10.1039/a901416k","","","0.71073","MoKα","","0.1871","0.1183","","","0.3297","0.3663","","","","","","1.058","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027333","13.6823","0.0003","19.7171","0.0003","20.2532","0.0004","65.093","0.001","71.897","0.001","73.909","0.001","4642.01","0.16","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C44.25 H38.5 Cl0.5 N4 O S4 Zn2 -","- C44.25 H36 Cl0.5 N4 O S4 Zn2 -","- C177 H144 Cl2 N16 O4 S16 Zn8 -","4","2","","Sampanthar, Jeyagowry T.; Vittal, Jagadese J.","Syntheses and crystal structures of the dimer [{Zn(SPh)2(bpy)}2(μ-bpy)] and two forms of the zigzag co-ordination polymer [{Zn(SPh)2(μ-bpy)}n], (bpy = 4,4′-bipyridyl)","Journal of the Chemical Society, Dalton Transactions","1999","","12","1993","","10.1039/a901416k","","","0.71073","MoKα","","0.1345","0.1023","","","0.2337","0.2549","","","","","","1.132","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027334","5.528","0.002","5.442","0.002","25.999","0.009","90","","90.59","0.03","90","","782.1","0.5","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Cu(pyrazineamide)(N3)]n","","","- C5 H5 Cu N6 O -","- C5 H5 Cu N6 O -","- C20 H20 Cu4 N24 O4 -","4","1","","Goher, Mohamed A. S.; Mautner, Franz A.","A novel polymeric copper(I) complex with an unusual azide bridge. Synthesis and crystal structure of [Cu(pyza)(μ-1,1,3-N3)]\ιnfty (pyza = pyrazinecarboxamide)","Journal of the Chemical Society, Dalton Transactions","1999","","10","1535","","10.1039/a901425j","","","0.71069","MoKα","","0.0531","0.0427","","0.1172","0.1061","","","","1.066","1.092","1.092","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027335","11.176","0.008","13.892","0.009","13.363","0.012","97.31","0.06","91.32","0.06","88","0.06","2056","3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C43 H38 Cl N2 O3 P2 Pt -","- C43 H37 Cl N2 O3 P2 Pt -","- C86 H74 Cl2 N4 O6 P4 Pt2 -","2","1","","De Napoli, Lorenzo; Iacovino, Rosa; Messere, Anna; Montesarchio, Daniela; Piccialli, Gennaro; Romanelli, Alessandra; Ruffo, Francesco; Saviano, Michele","Synthesis of platinum(II) complexes of thymidine and 1-methylthymine (1-MeThy); crystal structure of cis-[PtCl(1-MeThy)(PPh3)2]","Journal of the Chemical Society, Dalton Transactions","1999","","12","1945","","10.1039/a901459d","","","1.54178","CuKα","","0.0515","0.0498","","","0.1313","0.1334","","","","","","0.838","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027336","5.21","0.001","12.693","0.001","15.518","0.001","90","","90","","90","","1026.2","0.2","150","","150","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C3 H14 Co N2 O8 P2 -","- C3 H14 Co N2 O8 P2 -","- C12 H56 Co4 N8 O32 P8 -","4","1","","Cowley, Andrew R.; Chippindale, Ann M.","Synthesis and characterisation of the first unidimensional cobalt hydrogen phosphate, [H3N(CH2)3NH3][Co(HPO4)2]","Journal of the Chemical Society, Dalton Transactions","1999","","13","2147","","10.1039/a901469a","","","0.71069","MoKα","","","0.0324","","","0.037","","","","","1.1387","1.1387","","","","","has coordinates","288252","2023-12-12","14:26:25",""
"7027337","16.3","0.007","23.398","0.005","15.791","0.003","90","","90","","90","","6022","3","296.2","","296.2","","","","","","","","[Zn(D-GlcN-en)2]X2","6","P 21 21 21","P 2ac 2ab","19","","","","- C16.5 H39.5 Cl2 N6 O11.25 Zn -","- C16.5 H32 Cl2 N6 O11.25 Zn -","- C132 H256 Cl16 N48 O90 Zn8 -","8","2","","Yano, Shigenobu; Inoue, Sahoko; Yasuda, Yukiko; Tanase, Tomoaki; Mikata, Yuji; Kakuchi, Toyoji; Tsubomura, Taro; Yamasaki, Mikio; Kinoshita, Isamu; Doe, Matsumi","First synthesis and characterization of zinc(II) complexes containing N-glycosides derived from ethylenediamine and D-glucosamine","Journal of the Chemical Society, Dalton Transactions","1999","","11","1851","","10.1039/a901475f","","","1.5418","CuKα","","0.0504","0.0504","","0.0916","0.0774","0.0774","","","1.252","","","1.253","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027338","8.67","0.005","9.703","0.005","16.815","0.009","75.71","0.03","81.36","0.04","81.72","0.04","1346.8","1.3","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H34 N4 Sn4 -","- C22 H34 N4 Sn4 -","- C44 H68 N8 Sn8 -","2","1","","Galán, Belén; Mosquera, Marta E. G.; Palmer, Julie S.; Raithby, Paul R.; Wright, Dominic S.","A leaving group strategy for the selective functionalisation of an imido Sn(II) cubane","Journal of the Chemical Society, Dalton Transactions","1999","","7","1043","","10.1039/a901478k","","","0.71073","MoKα","","0.0298","0.023","","","0.0546","0.0568","","","","","","1.083","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027339","9.043","0.001","24.151","0.003","15.318","0.002","90","","96.619","0.007","90","","3323.1","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C36 H88 Cr2 N16 Ni3 O32 -","- C36 H76 Cr2 N16 Ni3 O32.012 -","- C72 H152 Cr4 N32 Ni6 O64.024 -","2","0.5","","Masters, Vanessa M.; Bernhardt, Paul V.; Gahan, Lawrence R.; Moubaraki, Boujemaa; Murray, Keith S.; Berry, Kevin J.","Nickel complexes with tris(2-aminoethyl)amine (tren): [Ni3(tren)4(H2O)2][Cr(ox)3]2·6H2O (ox = oxalate), {[Ni2(tren)3][ClO4]4·H2O}n, and [Ni2(tren)2(aepd)][ClO4]4·2H2O (aepd = N-(2-aminoethyl)pyrrolidine-3,4-diamine). Synthesis, structure and magnetism †","Journal of the Chemical Society, Dalton Transactions","1999","","14","2323","","10.1039/a901659g","","","0.71073","MoKα","","0.2008","0.0775","","0.2746","0.2013","","","","1.005","1.16","1.16","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027340","8.784","0.003","23.414","0.002","10.31","0.003","90","","108.06","0.01","90","","2016","0.9","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C18 H56 Cl4 N12 Ni2 O17 -","- C18 H56 Cl4 N12 Ni2 O17 -","- C36 H112 Cl8 N24 Ni4 O34 -","2","0.5","","Masters, Vanessa M.; Bernhardt, Paul V.; Gahan, Lawrence R.; Moubaraki, Boujemaa; Murray, Keith S.; Berry, Kevin J.","Nickel complexes with tris(2-aminoethyl)amine (tren): [Ni3(tren)4(H2O)2][Cr(ox)3]2·6H2O (ox = oxalate), {[Ni2(tren)3][ClO4]4·H2O}n, and [Ni2(tren)2(aepd)][ClO4]4·2H2O (aepd = N-(2-aminoethyl)pyrrolidine-3,4-diamine). Synthesis, structure and magnetism †","Journal of the Chemical Society, Dalton Transactions","1999","","14","2323","","10.1039/a901659g","","","0.71073","MoKα","","0.1989","0.09","","0.3188","0.2421","","","","1.048","1.197","1.197","","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027341","9.968","0.002","15.48","0.001","15.684","0.002","118.552","0.007","104.25","0.01","97.47","0.01","1971.3","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H56 Cl4 N12 Ni2 O18 -","- C18 H56 Cl4 N12 Ni2 O18 -","- C36 H112 Cl8 N24 Ni4 O36 -","2","1","","Masters, Vanessa M.; Bernhardt, Paul V.; Gahan, Lawrence R.; Moubaraki, Boujemaa; Murray, Keith S.; Berry, Kevin J.","Nickel complexes with tris(2-aminoethyl)amine (tren): [Ni3(tren)4(H2O)2][Cr(ox)3]2·6H2O (ox = oxalate), {[Ni2(tren)3][ClO4]4·H2O}n, and [Ni2(tren)2(aepd)][ClO4]4·2H2O (aepd = N-(2-aminoethyl)pyrrolidine-3,4-diamine). Synthesis, structure and magnetism †","Journal of the Chemical Society, Dalton Transactions","1999","","14","2323","","10.1039/a901659g","","","0.71073","MoKα","","0.0838","0.047","","0.1503","0.1283","","","","1.02","1.065","1.065","","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027342","10.1455","0.0009","12.4123","0.0011","17.585","0.002","104.847","0.009","92.927","0.01","113.762","0.008","1929","0.4","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H66 N2 O8 Zr2 -","- C28 H66 N2 O8 Zr2 -","- C56 H132 N4 O16 Zr4 -","2","1","","Fleeting, Kirsty A.; O’Brien, Paul; Jones, Anthony C.; Otway, David J.; White, Andrew J. P.; Williams, David J.","Zirconium mixed ligand isopropoxide/aminoalkoxide complexes: crystal structures of [Zr2(OPri)6(L)2] and [Zr2(OBut)3(bdmap)4(OH)] {where L = dmap, 1-dimethylaminopropan-2-olate and bdmap, 1,1-bis(dimethylamino)propan-2-olate}","Journal of the Chemical Society, Dalton Transactions","1999","","16","2853","","10.1039/a901666j","","","0.71073","MoKα","","0.0569","0.038","","0.0949","0.085","","","","1.041","1.081","1.081","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027343","22.066","0.0015","12.3385","0.0009","32.591","0.003","90","","101.162","0.007","90","","8705.4","1.2","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H76 N4 O8 Zr2 -","- C32 H76 N4 O8 Zr2 -","- C256 H608 N32 O64 Zr16 -","8","1","","Fleeting, Kirsty A.; O’Brien, Paul; Jones, Anthony C.; Otway, David J.; White, Andrew J. P.; Williams, David J.","Zirconium mixed ligand isopropoxide/aminoalkoxide complexes: crystal structures of [Zr2(OPri)6(L)2] and [Zr2(OBut)3(bdmap)4(OH)] {where L = dmap, 1-dimethylaminopropan-2-olate and bdmap, 1,1-bis(dimethylamino)propan-2-olate}","Journal of the Chemical Society, Dalton Transactions","1999","","16","2853","","10.1039/a901666j","","","1.54178","CuKα","","0.0694","0.0537","","0.148","0.1363","","","","1.054","1.098","1.098","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027344","20.949","0.002","12.276","0.002","23.485","0.003","90","","111.494","0.007","90","","5619.6","1.3","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H96 N8 O8 Zr2 -","- C40 H96 N8 O8 Zr2 -","- C160 H384 N32 O32 Zr8 -","4","1","","Fleeting, Kirsty A.; O’Brien, Paul; Jones, Anthony C.; Otway, David J.; White, Andrew J. P.; Williams, David J.","Zirconium mixed ligand isopropoxide/aminoalkoxide complexes: crystal structures of [Zr2(OPri)6(L)2] and [Zr2(OBut)3(bdmap)4(OH)] {where L = dmap, 1-dimethylaminopropan-2-olate and bdmap, 1,1-bis(dimethylamino)propan-2-olate}","Journal of the Chemical Society, Dalton Transactions","1999","","16","2853","","10.1039/a901666j","","","0.71073","MoKα","","0.0729","0.0454","","0.1083","0.095","","","","1.032","1.059","1.059","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027345","12.5887","0.0014","14.147","0.002","17.0623","0.0013","86.483","0.008","70.62","0.008","85.225","0.011","2854.7","0.6","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H96 N8 O8 Zr2 -","- C40 H96 N8 O8 Zr2 -","- C80 H192 N16 O16 Zr4 -","2","1","","Fleeting, Kirsty A.; O’Brien, Paul; Jones, Anthony C.; Otway, David J.; White, Andrew J. P.; Williams, David J.","Zirconium mixed ligand isopropoxide/aminoalkoxide complexes: crystal structures of [Zr2(OPri)6(L)2] and [Zr2(OBut)3(bdmap)4(OH)] {where L = dmap, 1-dimethylaminopropan-2-olate and bdmap, 1,1-bis(dimethylamino)propan-2-olate}","Journal of the Chemical Society, Dalton Transactions","1999","","16","2853","","10.1039/a901666j","","","0.71073","MoKα","","0.1136","0.0561","","0.1427","0.1136","","","","1.009","1.061","1.061","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027346","25.695","0.0007","14.079","0.0004","35.418","0.0009","90","","100.37","0.002","90","","12603.5","0.6","150","0.1","150","0.1","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C121.5 H129 F24 N12 O10.5 P4 Ru2 -","- C121.5 H129 F24 N12 O10.5 P4 Ru2 -","- C486 H516 F96 N48 O42 P16 Ru8 -","4","0.5","","Chamchoumis, Charles M.; Potvin, Pierre G.","A singly stranded, helical di-ruthenium(II) complex of a novel 6,6-ethynyl-linked bis(terpyridine) ligand. Distortion of the ethyne linkage and inversion of helicity","Journal of the Chemical Society, Dalton Transactions","1999","","9","1373","","10.1039/a901696a","","","0.71073","MoKα","","0.0834","0.0603","","","0.1652","0.185","","","","","","1.015","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027347","7.178","0.002","10.502","0.003","17.184","0.005","105.81","0.02","93.25","0.02","100.94","0.02","1215.6","0.6","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H27 N P2 S4 Si2 -","- C17 H27 N P2 S4 Si2 -","- C34 H54 N2 P4 S8 Si4 -","2","1","","Kilián, Petr; Marek, Jaromír; Marek, Radek; Tousek, Jaromír; Humpa, Otakar; Slawin, Alexandra M. Z.; Touzín, Jirí; Novosad, Josef; Woollins, J. Derek","New P–S–N containing ring systems. Reaction of 2,4-(naphthalene-1,8-diyl)-1,3,2,4-dithiadiphosphetane 2,4-disulfide with methylbis(trimethylsilyl)amine","Journal of the Chemical Society, Dalton Transactions","1999","","13","2231","","10.1039/a901698h","","","0.71073","MoKα","","0.0537","0.043","","0.1232","0.114","","","","1.018","1.034","1.034","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027348","9.8665","0.0007","10.4165","0.0008","17.1308","0.0015","105.217","0.008","102.994","0.007","90.777","0.006","1650.4","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C35 H30 N P3 S4 -","- C35 H30 N P3 S4 -","- C70 H60 N2 P6 S8 -","2","1","","Kilián, Petr; Marek, Jaromír; Marek, Radek; Tousek, Jaromír; Humpa, Otakar; Slawin, Alexandra M. Z.; Touzín, Jirí; Novosad, Josef; Woollins, J. Derek","New P–S–N containing ring systems. Reaction of 2,4-(naphthalene-1,8-diyl)-1,3,2,4-dithiadiphosphetane 2,4-disulfide with methylbis(trimethylsilyl)amine","Journal of the Chemical Society, Dalton Transactions","1999","","13","2231","","10.1039/a901698h","","","0.71073","MoKα","","0.0539","0.0466","","0.1288","0.1196","","","","1.01","1.012","1.012","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027349","7.038","0.003","27.939","0.003","7.891","0.002","90","","103.81","0.03","90","","1506.8","0.8","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","2,6-(naphthalene-1,8-diyl)-3,4-dimethyl-1,3,5,2,6- thiadiazadiphosphinine-2,6-disulfide","","- C13 H12 N2 P2 S3 -","- C13 H12 N2 P2 S3 -","- C52 H48 N8 P8 S12 -","4","1","","Kilián, Petr; Marek, Jaromír; Marek, Radek; Tousek, Jaromír; Humpa, Otakar; Slawin, Alexandra M. Z.; Touzín, Jirí; Novosad, Josef; Woollins, J. Derek","New P–S–N containing ring systems. Reaction of 2,4-(naphthalene-1,8-diyl)-1,3,2,4-dithiadiphosphetane 2,4-disulfide with methylbis(trimethylsilyl)amine","Journal of the Chemical Society, Dalton Transactions","1999","","13","2231","","10.1039/a901698h","","","0.71073","MoKα","","0.0456","0.0347","","0.0934","0.0874","","","","1.03","1.053","1.053","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027350","9.962","0.002","14.79","0.002","8.217","0.002","83.55","0.01","78.08","0.02","72.65","0.01","1129","0.4","296.2","","296.2","","","","","","","","","7","P -1","-P 1","2","","","","- C12 H16 B N6 Na O3 S3 -","- C12 H16 B N6 Na2.5 O5.5 S3 -","- C24 H32 B2 N12 Na5 O11 S6 -","2","1","","Reglinski, John; Garner, Mark; Cassidy, Iain D.; Slavin, Paul A.; Spicer, Mark D.; Armstrong, David R.","Sodium hydrotris(methimazolyl)borate, a novel soft, tridentate ligand: preparation, structure and comparisons with sodium hydrotris(pyrazolyl)borate †","Journal of the Chemical Society, Dalton Transactions","1999","","13","2119","","10.1039/a901703h","","","0.7107","MoKalpha","","","0.0712","","","0.0914","","","","","1.449","1.449","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027351","8.508","0.002","20.73","0.003","7.062","0.001","90","","90","","90","","1245.5","0.4","293.2","","293.2","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C9 H12 B N6 Na O -","- C9 H12 B N6 Na O -","- C36 H48 B4 N24 Na4 O4 -","4","1","","Reglinski, John; Garner, Mark; Cassidy, Iain D.; Slavin, Paul A.; Spicer, Mark D.; Armstrong, David R.","Sodium hydrotris(methimazolyl)borate, a novel soft, tridentate ligand: preparation, structure and comparisons with sodium hydrotris(pyrazolyl)borate †","Journal of the Chemical Society, Dalton Transactions","1999","","13","2119","","10.1039/a901703h","","","0.7107","MoKalpha","","","0.0455","","","0.0432","","","","","1.618","1.618","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027352","30.07","0.003","14.241","0.002","25.259","0.002","90","","105.28","0.01","90","","10434","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C34 H66 N16 O2 Sn4 -","- C32 H45 N16 O2 Sn4 -","- C256 H360 N128 O16 Sn32 -","8","1","","Bhandari, Sonali; Mahon, Mary F.; Molloy, Kieran C.","Synthesis and supramolecular architectures of tetrakis(triorganostannyltetrazoles), including the crystal structure of hydrated 1,2,4,5-tetrakis(triethylstannyltetrazolyl)benzene","Journal of the Chemical Society, Dalton Transactions","1999","","12","1951","","10.1039/a901737b","","","0.71069","","","0.1642","0.0629","","0.2295","0.1451","","","","1.043","1","1","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027353","10.465","0.003","8.896","0.002","31.961","0.008","90","","98.45","0.03","90","","2943.2","1.3","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H39 Cl2 Cr N3 -","- C29 H39 Cl2 Cr N3 -","- C116 H156 Cl8 Cr4 N12 -","4","1","","Chew, Kong Chin; Clegg, William; Coles, Martyn P.; Elsegood, Mark R. J.; Gibson, Vernon C.; White, Andrew J. P.; Williams, David J.","Synthesis and characterisation of 2,6-diisopropylphenylimido complexes of chromium in oxidation states IV‒VI","Journal of the Chemical Society, Dalton Transactions","1999","","15","2633","","10.1039/a901790i","","","0.71073","MoKα","","0.0709","0.0438","","0.1152","0.09","","","","1.088","1.058","1.058","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027354","10.4714","0.0011","15.411","0.002","21.493","0.002","90","","94.707","0.002","90","","3456.7","0.7","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C36 H52 Cl Cr N3 -","- C36 H52 Cl Cr N3 -","- C144 H208 Cl4 Cr4 N12 -","4","1","","Chew, Kong Chin; Clegg, William; Coles, Martyn P.; Elsegood, Mark R. J.; Gibson, Vernon C.; White, Andrew J. P.; Williams, David J.","Synthesis and characterisation of 2,6-diisopropylphenylimido complexes of chromium in oxidation states IV‒VI","Journal of the Chemical Society, Dalton Transactions","1999","","15","2633","","10.1039/a901790i","","","0.71073","MoKα","","0.0721","0.0588","","0.1248","0.1177","","","","1.203","1.232","1.232","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027355","9.5275","0.0008","10.7197","0.001","15.5038","0.0014","97.572","0.002","105.819","0.005","104.82","0.002","1437.8","0.2","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","","","- C29 H39 Cl2 Cr N3 -","- C29 H39 Cl2 Cr N3 -","- C58 H78 Cl4 Cr2 N6 -","2","1","","Chew, Kong Chin; Clegg, William; Coles, Martyn P.; Elsegood, Mark R. J.; Gibson, Vernon C.; White, Andrew J. P.; Williams, David J.","Synthesis and characterisation of 2,6-diisopropylphenylimido complexes of chromium in oxidation states IV‒VI","Journal of the Chemical Society, Dalton Transactions","1999","","15","2633","","10.1039/a901790i","","","0.71073","MoKα","","0.052","0.0447","","0.1184","0.1068","","","","1.138","1.096","1.096","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027356","12.483","0.002","19.584","0.003","40.908","0.005","90","","92.598","0.01","90","","9990","3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H68 Cl2 Cr2 N4 -","- C48 H68 Cl2 Cr2 N4 -","- C384 H544 Cl16 Cr16 N32 -","8","2","","Chew, Kong Chin; Clegg, William; Coles, Martyn P.; Elsegood, Mark R. J.; Gibson, Vernon C.; White, Andrew J. P.; Williams, David J.","Synthesis and characterisation of 2,6-diisopropylphenylimido complexes of chromium in oxidation states IV‒VI","Journal of the Chemical Society, Dalton Transactions","1999","","15","2633","","10.1039/a901790i","","","0.71073","MoKα","","0.1758","0.0697","","0.1792","0.1273","","","","0.995","1.123","1.123","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027357","9.9487","0.0007","18.5847","0.0007","18.7972","0.0007","90","","90.884","0.004","90","","3475.1","0.3","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C34 H49 Cr N4 P -","- C34 H49 Cr N4 P -","- C136 H196 Cr4 N16 P4 -","4","1","","Chew, Kong Chin; Clegg, William; Coles, Martyn P.; Elsegood, Mark R. J.; Gibson, Vernon C.; White, Andrew J. P.; Williams, David J.","Synthesis and characterisation of 2,6-diisopropylphenylimido complexes of chromium in oxidation states IV‒VI","Journal of the Chemical Society, Dalton Transactions","1999","","15","2633","","10.1039/a901790i","","","1.54178","CuKα","","0.0722","0.0535","","0.1469","0.1327","","","","1.039","1.082","1.082","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027358","7.1165","0.0002","46.4397","0.0012","7.5328","0.0002","90","","116.457","0.001","90","","2228.77","0.11","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 O6 S2 W2 -","- C20 H16 O6 S2 W2 -","- C80 H64 O24 S8 W8 -","4","1","","Wang, Luxti J. J.; You, Sen-Jen; Huang, Shou-Ling; Yang, Yu-Lee; Lin, Ying-Chih; Lee, Gene-Hsiang; Peng, Shie-Ming","Reactions of a dinuclear tungsten complex containing an O-co-ordinated bridging ketene with various heterocumulenes","Journal of the Chemical Society, Dalton Transactions","1999","","13","2243","","10.1039/a901823i","","","0.71073","MoKα","","0.0633","0.0586","","0.1389","0.1367","","","","1.392","1.413","1.413","","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027359","9.7547","0.002","15.936","0.004","12.226","0.004","90","","111.811","0.023","90","","1764.5","0.9","298","","298","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H12 O5 S W2 -","- C17 H12 O5 S W2 -","- C68 H48 O20 S4 W8 -","4","1","","Wang, Luxti J. J.; You, Sen-Jen; Huang, Shou-Ling; Yang, Yu-Lee; Lin, Ying-Chih; Lee, Gene-Hsiang; Peng, Shie-Ming","Reactions of a dinuclear tungsten complex containing an O-co-ordinated bridging ketene with various heterocumulenes","Journal of the Chemical Society, Dalton Transactions","1999","","13","2243","","10.1039/a901823i","","","0.71073","MolybdenumKα","","0.093","0.057","","0.059","0.056","","","","","1.85","1.85","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027360","26.296","0.005","7.0225","0.0022","24.226","0.006","90","","118.299","0.02","90","","3939","1.9","298","","298","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 O6 W2 -","- C20 H16 O6 W2 -","- C160 H128 O48 W16 -","8","1","","Wang, Luxti J. J.; You, Sen-Jen; Huang, Shou-Ling; Yang, Yu-Lee; Lin, Ying-Chih; Lee, Gene-Hsiang; Peng, Shie-Ming","Reactions of a dinuclear tungsten complex containing an O-co-ordinated bridging ketene with various heterocumulenes","Journal of the Chemical Society, Dalton Transactions","1999","","13","2243","","10.1039/a901823i","","","0.71073","MolybdenumKα","","0.062","0.038","","0.039","0.038","","","","","2.14","2.14","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027361","22.705","0.008","16.855","0.002","25.917","0.004","90","","96.44","0.02","90","","9856","4","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C106 H97 F12 N18 Ni O2.5 P2 -","- C106 H97 F12 N18 Ni O2.5 P2 -","- C424 H388 F48 N72 Ni4 O10 P8 -","4","0.5","","Shu, Mou-Hai; Duan, Chun-Ying; Sun, Wei-Yin; Fu, You-Jun; Zhang, Dao-Hua; Bai, Zhi-Ping; Tang, Wen-Xia","Synthesis, structure and characterization of novel nickel(II) and iron(II) complexes with a 5,5′-bis[2-(2,2′-bipyridin-6-yl)-ethyl]-2,2′-bipyridine ligand","Journal of the Chemical Society, Dalton Transactions","1999","","14","2317","","10.1039/a901835b","","","0.71073","MoKα","","0.1397","0.072","","0.2258","0.1735","","","","1.025","1.181","1.181","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027362","9.83","0.012","11.254","0.014","13.787","0.017","73.957","0.01","79.888","0.01","67.599","0.01","1351","3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H23 La N10 O15 -","- C11 H11 La N10 O15 -","- C22 H22 La2 N20 O30 -","2","1","","Drew, Michael G. B.; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Russell, Mark L.","Experimental and theoretical studies of a triazole ligand and complexes formed with the lanthanides","Journal of the Chemical Society, Dalton Transactions","1999","","15","2433","","10.1039/a901842e","","","0.71073","MoKα","","0.1263","0.1172","","","0.3176","0.322","","","","","","1.174","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027363","9.354","0.012","29.4","0.03","9.836","0.012","90","","112.516","0.01","90","","2499","5","293","2","293","2","","","","","","","","5","I 1 2/c 1","-I 2yc","15","","","","- C13 H20 N11 O12 Tb -","- C13 H14 N11 O12 Tb -","- C52 H56 N44 O48 Tb4 -","4","0.5","","Drew, Michael G. B.; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Russell, Mark L.","Experimental and theoretical studies of a triazole ligand and complexes formed with the lanthanides","Journal of the Chemical Society, Dalton Transactions","1999","","15","2433","","10.1039/a901842e","","","0.71073","MoKα","","0.0497","0.0479","","","0.1447","0.1461","","","","","","1.089","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027364","9.353","0.012","29.59","0.03","9.889","0.012","90","","112.946","0.01","90","","2520","5","293","2","293","2","","","","","","","","5","I 1 2/c 1","-I 2yc","15","","","","- C13 H20 N11 O12 Sm -","- C13 H14 N11 O12 Sm -","- C52 H56 N44 O48 Sm4 -","4","0.5","","Drew, Michael G. B.; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Russell, Mark L.","Experimental and theoretical studies of a triazole ligand and complexes formed with the lanthanides","Journal of the Chemical Society, Dalton Transactions","1999","","15","2433","","10.1039/a901842e","","","0.71073","MoKα","","0.0807","0.0669","","","0.1924","0.1993","","","","","","1.187","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027365","9.326","0.009","29.71","0.03","9.895","0.011","90","","113.03","0.01","90","","2523","5","293","2","293","2","","","","","","","","5","I 1 2/c 1","-I 2yc","15","","","","- C13 H20 N11 Nd O12 -","- C13 H14 N11 Nd O12 -","- C52 H56 N44 Nd4 O48 -","4","0.5","","Drew, Michael G. B.; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Russell, Mark L.","Experimental and theoretical studies of a triazole ligand and complexes formed with the lanthanides","Journal of the Chemical Society, Dalton Transactions","1999","","15","2433","","10.1039/a901842e","","","0.71073","MoKα","","0.0626","0.0574","","","0.1622","0.165","","","","","","1.093","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027366","11.32","0.014","21.98","0.02","16.689","0.018","90","","109.698","0.01","90","","3909","7","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C34 H48 N14 O -","- C34 H44 N14 O -","- C136 H176 N56 O4 -","4","0.5","","Drew, Michael G. B.; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Russell, Mark L.","Experimental and theoretical studies of a triazole ligand and complexes formed with the lanthanides","Journal of the Chemical Society, Dalton Transactions","1999","","15","2433","","10.1039/a901842e","","","0.71073","MoKα","","0.2222","0.1345","","","0.3144","0.3765","","","","","","1.207","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027367","8.563","0.009","11.095","0.014","13.346","0.016","96.979","0.01","98.063","0.01","114.596","0.01","1118","2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H16 Ho N10 O11 -","- C13 H14 Ho N10 O11 -","- C26 H28 Ho2 N20 O22 -","2","1","","Drew, Michael G. B.; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Russell, Mark L.","Experimental and theoretical studies of a triazole ligand and complexes formed with the lanthanides","Journal of the Chemical Society, Dalton Transactions","1999","","15","2433","","10.1039/a901842e","","","0.71073","MoKα","","0.0324","0.0289","","","0.0826","0.0852","","","","","","0.915","","","","has coordinates","181910","2020-10-21","18:00:00",""
"7027368","16.102","0.018","8.179","0.01","16.571","0.018","90","","101.689","0.01","90","","2137","4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C13 H14 N11 O9 Yb -","- C13 H14 N11 O9 Yb -","- C52 H56 N44 O36 Yb4 -","4","1","","Drew, Michael G. B.; Hudson, Michael J.; Iveson, Peter B.; Madic, Charles; Russell, Mark L.","Experimental and theoretical studies of a triazole ligand and complexes formed with the lanthanides","Journal of the Chemical Society, Dalton Transactions","1999","","15","2433","","10.1039/a901842e","","","0.71073","MoKα","","0.0614","0.0447","","","0.123","0.1344","","","","","","1.077","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027369","15.2499","0.0007","13.8902","0.0007","15.3951","0.0007","90","","117.055","0.001","90","","2904.2","0.2","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H38 B N6 Tl -","- C27 H38 B N6 Tl -","- C108 H152 B4 N24 Tl4 -","4","1","","Kisko, Jennifer L.; Hascall, Tony; Kimblin, Clare; Parkin, Gerard","Phenyl tris(3-tert-butylpyrazolyl)borato complexes of lithium and thallium, [PhTpBut]M (M = Li, Tl): a novel structure for a monomeric tris(pyrazolyl)boratothallium complex and a study of its stereochemical nonrigidity by 1H and 205Tl NMR spectroscopy","Journal of the Chemical Society, Dalton Transactions","1999","","12","1929","","10.1039/a901875a","","","0.71073","MoKα","","0.0372","0.0279","","0.0614","0.0585","","","","1.044","1.08","1.08","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027370","18.6329","0.001","16.1563","0.0009","18.7233","0.001","90","","90.454","0.001","90","","5636.3","0.5","203","2","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H38 B Li N6 -","- C27 H38 B Li N6 -","- C216 H304 B8 Li8 N48 -","8","1","","Kisko, Jennifer L.; Hascall, Tony; Kimblin, Clare; Parkin, Gerard","Phenyl tris(3-tert-butylpyrazolyl)borato complexes of lithium and thallium, [PhTpBut]M (M = Li, Tl): a novel structure for a monomeric tris(pyrazolyl)boratothallium complex and a study of its stereochemical nonrigidity by 1H and 205Tl NMR spectroscopy","Journal of the Chemical Society, Dalton Transactions","1999","","12","1929","","10.1039/a901875a","","","0.71073","MoKα","","0.067","0.0518","","","0.1185","0.1266","","","","","","1.045","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027371","11.6639","0.0008","12.1658","0.0008","12.248","0.0008","114.003","0.001","101.409","0.001","109.44","0.001","1380.66","0.16","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H39 B N6 -","- C27 H39 B N6 -","- C54 H78 B2 N12 -","2","1","","Kisko, Jennifer L.; Hascall, Tony; Kimblin, Clare; Parkin, Gerard","Phenyl tris(3-tert-butylpyrazolyl)borato complexes of lithium and thallium, [PhTpBut]M (M = Li, Tl): a novel structure for a monomeric tris(pyrazolyl)boratothallium complex and a study of its stereochemical nonrigidity by 1H and 205Tl NMR spectroscopy","Journal of the Chemical Society, Dalton Transactions","1999","","12","1929","","10.1039/a901875a","","","0.71073","MoKα","","0.1174","0.074","","0.1842","0.161","","","","1.07","1.18","1.18","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027372","15.091","0.006","14.532","0.003","17.99","0.009","90","","123.87","0.02","90","","3276","2","294","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C31 H42 Cu F6 N3 P2 -","- C31 H42 Cu F6 N3 P2 -","- C124 H168 Cu4 F24 N12 P8 -","4","1","","Watkins, Scott E.; Yang, Xinhao; Craig, Donald C.; Colbran, Stephen B.","A new route to (N)n-donor functionalised phosphines; novel homo- and hetero-nuclear complexes of a phosphino-substituted triazacyclononane ligand","Journal of the Chemical Society, Dalton Transactions","1999","","10","1539","","10.1039/a901885i","","","0.71073","MoKα","","","0.037","","","","0.051","","","","","","1.69","","","","has coordinates","191942","2020-10-21","18:00:00",""
"7027373","22.365","0.003","13.812","0.002","28.778","0.004","90","","105.053","0.011","90","","8585","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C35 H37 Cl5 Fe2 N10 O3 -","- C35 H37 Cl5 Fe2 N10 O3 -","- C280 H296 Cl40 Fe16 N80 O24 -","8","1","","Horng, Den-Nan; Lee, Kwang-Ming","Using pseudohalides (NCS−, N3−) as a probe for the active site of (μ-alkoxo)diiron(III) complexes and to reveal a novel asymmetrical structure","Journal of the Chemical Society, Dalton Transactions","1999","","13","2205","","10.1039/a901905g","","","0.71073","MoKα","","0.1923","0.0744","","0.2347","0.199","","","","1.089","1.596","1.596","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027374","13.638","0.003","22.508","0.003","17.667","0.003","90","","99.56","0.02","90","","5347.8","1.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C37 H41 Cl3 Fe2 N12 O5 S2 -","- C37 H33 Cl2.7 Fe2 N12 O5.2 S2 -","- C148 H132 Cl10.8 Fe8 N48 O20.8 S8 -","4","1","","Horng, Den-Nan; Lee, Kwang-Ming","Using pseudohalides (NCS−, N3−) as a probe for the active site of (μ-alkoxo)diiron(III) complexes and to reveal a novel asymmetrical structure","Journal of the Chemical Society, Dalton Transactions","1999","","13","2205","","10.1039/a901905g","","","0.71073","MoKα","","0.238","0.0894","","0.3199","0.242","","","","0.785","1.313","1.313","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027375","21.338","0.004","15.685","0.003","28.017","0.006","90","","102.68","0.03","90","","9148","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C35 H39 Fe2 N23 O7 -","- C35 H33 Fe2 N23 O7 -","- C280 H264 Fe16 N184 O56 -","8","1","","Horng, Den-Nan; Lee, Kwang-Ming","Using pseudohalides (NCS−, N3−) as a probe for the active site of (μ-alkoxo)diiron(III) complexes and to reveal a novel asymmetrical structure","Journal of the Chemical Society, Dalton Transactions","1999","","13","2205","","10.1039/a901905g","","","0.71073","MoKα","","0.3903","0.0828","","0.3346","0.1944","","","","1.06","1.646","1.646","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027376","10.3523","0.0004","10.786","0.0004","11.1139","0.0005","114.6","","107.14","","102.42","","993.42","0.07","293","2","150","0.1","","","","","","","","5","P -1","-P 1","2","","","","- C32 H38 Cl8 Ru Te4 -","- C32 H38 Cl8 Ru Te4 -","- C32 H38 Cl8 Ru Te4 -","1","0.5","","Levason, William; Orchard, Simon D.; Reid, Gillian; Tolhurst, Vicki-Ann","Platinum metal ditelluroether complexes: synthesis, spectroscopic and structural studies of [M(L‒L)2][PF6]2 [M = Pd or Pt, L‒L = RTe(CH2)3TeR (R = Me or Ph) or C6H4(TeMe)2-o], [Rh(L‒L)2Cl2]PF6, [Ru(L‒L)2X2] (X = Cl, Br or I) and [Ru(L‒L)2(PPh3)Cl]PF6","Journal of the Chemical Society, Dalton Transactions","1999","","12","2071","","10.1039/a901942a","","","0.71073","MoKα","","0.0756","0.0505","","","0.1177","0.1304","","","","","","0.99","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027377","9.296","0.003","30.811","0.002","12.732","0.003","90","","105.4","0.02","90","","3515.8","1.5","150","","150","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C28 H39 Cl F6 P2 Ru Te4 -","- C28 H39 Cl F6 P2 Ru Te4 -","- C112 H156 Cl4 F24 P8 Ru4 Te16 -","4","1","","Levason, William; Orchard, Simon D.; Reid, Gillian; Tolhurst, Vicki-Ann","Platinum metal ditelluroether complexes: synthesis, spectroscopic and structural studies of [M(L‒L)2][PF6]2 [M = Pd or Pt, L‒L = RTe(CH2)3TeR (R = Me or Ph) or C6H4(TeMe)2-o], [Rh(L‒L)2Cl2]PF6, [Ru(L‒L)2X2] (X = Cl, Br or I) and [Ru(L‒L)2(PPh3)Cl]PF6","Journal of the Chemical Society, Dalton Transactions","1999","","12","2071","","10.1039/a901942a","","","0.71073","MoKalpha","","","0.0448","","","0.0508","","","","","1.63","1.63","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027378","8.9645","0.0006","18.896","0.002","8.9325","0.0005","94.536","0.006","95.649","0.005","99.533","0.007","1477.9","0.2","150","","150","","","","","","","","diffusion of Et~2~O into MeCN solution","7","P -1","-P 1","2","","","","- C18 H23 F12 N P2 Pd Te4 -","- C18 H20 F12 N2 P2 Pd Te4 -","- C36 H40 F24 N4 P4 Pd2 Te8 -","2","1","","Levason, William; Orchard, Simon D.; Reid, Gillian; Tolhurst, Vicki-Ann","Platinum metal ditelluroether complexes: synthesis, spectroscopic and structural studies of [M(L‒L)2][PF6]2 [M = Pd or Pt, L‒L = RTe(CH2)3TeR (R = Me or Ph) or C6H4(TeMe)2-o], [Rh(L‒L)2Cl2]PF6, [Ru(L‒L)2X2] (X = Cl, Br or I) and [Ru(L‒L)2(PPh3)Cl]PF6","Journal of the Chemical Society, Dalton Transactions","1999","","12","2071","","10.1039/a901942a","","","0.71073","MoKalpha","","","0.0309","","","0.0362","","","","","1.933","1.933","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027379","12.905","0.003","13.584","0.003","9.229","0.0018","96.84","0.03","97.86","0.03","107.43","0.03","1507","0.7","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","Compound 3","","- C38 H31 As N2 O3 -","- C38 H31 As N2 O3 -","- C76 H62 As2 N4 O6 -","2","1","","Adams, Christopher J.","Synthesis, structure and metal compounds of a novel chromophoric cyanamide ligand","Journal of the Chemical Society, Dalton Transactions","1999","","12","2059","","10.1039/a901959f","","","0.71073","MoKα","","0.0633","0.0414","","","0.0848","0.093","","","","","","1.029","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027380","10.527","0.003","11.852","0.003","12.33","0.003","99.59","0.02","107.35","0.02","114.1","0.03","1264.8","0.8","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","Compound 5","","- C32 H22 Au N2 O P -","- C32 H22 Au N2 O P -","- C64 H44 Au2 N4 O2 P2 -","2","1","","Adams, Christopher J.","Synthesis, structure and metal compounds of a novel chromophoric cyanamide ligand","Journal of the Chemical Society, Dalton Transactions","1999","","12","2059","","10.1039/a901959f","","","0.71073","MoKα","","0.0566","0.042","","","0.0981","0.1044","","","","","","1.048","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027381","10","0.02","15.94","0.02","17.49","0.01","90","","92.4","0.1","90","","2785","7","493.2","","493.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H44 O4 Si5 -","- C10.6667 H26.6667 O2.66667 Si3.33333 -","- C64 H160 O16 Si20 -","6","1.5","","Coupar, Pamela I.; Jaffrès, Paul-Alain; Morris, Russell E.","Synthesis and characterisation of silanol-functionalised dendrimers †","Journal of the Chemical Society, Dalton Transactions","1999","","13","2183","","10.1039/a901962f","","","0.7107","MoKalpha","","","0.0385","","","0.0471","","","","","2.407","2.407","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027382","9.947","0.001","10.795","0.0011","15.541","0.002","106.56","0.003","92.882","0.003","108.241","0.002","1501.2","0.3","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H36 Ag2 N10 -","- C32 H36 Ag2 N10 -","- C64 H72 Ag4 N20 -","2","1","","Adams, Harry; Elsegood, Mark R. J.; Fenton, David E.; Heath, Sarah L.; Ryan, Sara J.","Dinuclear silver(I) complexes of bibracchial tetraimine Schiff base macrocycles derived from pyrrole-2,5-dicarbaldehyde","Journal of the Chemical Society, Dalton Transactions","1999","","12","2031","","10.1039/a901992h","","","0.71073","MoKα","","0.0356","0.0243","","0.0696","0.056","","","","0.981","1.045","1.045","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027383","10.0484","0.0002","12.2896","0.0003","18.078","0.0004","90.352","0.002","97.606","0.002","102.199","0.002","2161.52","0.09","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H49 Ag2 Cl2 N11 O8 -","- C38 H46 Ag2 Cl2 N11 O8 -","- C76 H92 Ag4 Cl4 N22 O16 -","2","1","","Adams, Harry; Elsegood, Mark R. J.; Fenton, David E.; Heath, Sarah L.; Ryan, Sara J.","Dinuclear silver(I) complexes of bibracchial tetraimine Schiff base macrocycles derived from pyrrole-2,5-dicarbaldehyde","Journal of the Chemical Society, Dalton Transactions","1999","","12","2031","","10.1039/a901992h","","","0.71073","MoKα","","0.0536","0.0346","","0.0858","0.0698","","","","1.022","1.056","1.056","","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027384","12.739","0.003","14.266","0.003","14.699","0.003","77","0.03","84.61","0.03","63.04","0.03","2319.9","1.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C47 H38 Cl2 N10 Ni2 O8 -","- C47 H38 Cl2 N10 Ni2 O8 -","- C94 H76 Cl4 N20 Ni4 O16 -","2","1","","Bermejo, Manuel R.; Fondo, Matilde; González, Ana M.; Hoyos, Olga L.; Sousa, Antonio; McAuliffe, Charles A.; Hussain, Wasif; Pritchard, Robin; Novotorsev, Vladimir M.","Electrochemical synthesis and structural characterisation of transition metal complexes with 2,6-bis(1-salicyloylhydrazonoethyl)pyridine, H4daps","Journal of the Chemical Society, Dalton Transactions","1999","","13","2211","","10.1039/a902018g","","","0.71069","MoKα","","0.0363","0.0363","","","0.0971","0.0971","","","","","","1.062","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027385","20.993","0.004","20.649","0.004","16.821","0.003","90","","122.32","0.02","90","","6162","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28.5 H25 Cl N6 Ni O4 -","- C29 H24 Cl2 N6 Ni O4 -","- C232 H192 Cl16 N48 Ni8 O32 -","8","1","","Bermejo, Manuel R.; Fondo, Matilde; González, Ana M.; Hoyos, Olga L.; Sousa, Antonio; McAuliffe, Charles A.; Hussain, Wasif; Pritchard, Robin; Novotorsev, Vladimir M.","Electrochemical synthesis and structural characterisation of transition metal complexes with 2,6-bis(1-salicyloylhydrazonoethyl)pyridine, H4daps","Journal of the Chemical Society, Dalton Transactions","1999","","13","2211","","10.1039/a902018g","","","1.5418","CuKα","","0.1237","0.1232","","0.3253","0.3245","","","","0.826","0.827","0.827","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027386","9.4944","0.0001","12.9445","0.0002","16.9514","0.0001","90","","90.924","0.001","90","","2083.06","0.04","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 Br2 Cu2 N4 -","- C20 H16 Br2 Cu2 N4 -","- C80 H64 Br8 Cu8 N16 -","4","1","","Fun, Hoong-Kun; Raj, S. Shanmuga Sundara; Xiong, Ren-Gen; Zuo, Jing-Lin; Yu, Zhi; Zhu, Xiao-Lei; You, Xiao-Zeng","The first structurally characterized 3,4′-bipyridine copper(I) coordination polymer with an approximately rectangular molecular box","Journal of the Chemical Society, Dalton Transactions","1999","","11","1711","","10.1039/a902054c","","","0.71073","MoKα","","0.044","0.032","","","0.07","0.075","","","","","","1.059","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027387","16.9875","0.0004","9.9995","0.0002","7.8476","0.0001","90","","104.584","0.001","90","","1290.09","0.04","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H9 Cd N O4 -","- C13 H9 Cd N O4 -","- C52 H36 Cd4 N4 O16 -","4","0.5","","Fun, Hoong-Kun; Raj, S. Shnamuga Sundara; Xiong, Ren-Gen; Zuo, Jing-Lin; Yu, Zhi; You, Xiao-Zeng","A three-dimensional network coordination polymer, (terephthalato)(pyridine)cadmium, with blue fluorescent emission","Journal of the Chemical Society, Dalton Transactions","1999","","12","1915","","10.1039/a902056j","","","0.71073","MoKα","","0.0345","0.0263","","","0.0565","0.0596","","","","","","1.084","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027388","21.9372","0.0011","11.7406","0.0008","9.1656","0.0004","90","","93.68","0.003","90","","2355.8","0.2","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C19 H9 N O11 Os3 -","- C19 H9 N O11 Os3 -","- C76 H36 N4 O44 Os12 -","4","1","","Deeming, Antony J.; Stchedroff, Marc J.; Whittaker, Caroline; Arce, Alejandro J.; De Sanctis, Ysaura; Steed, Jonathan W.","Orientational isomerism in bridging 2-pyridyl complexes: orthometallation of (S )-nicotine and (R)-1-(4-pyridyl)ethanol in triosmium clusters","Journal of the Chemical Society, Dalton Transactions","1999","","18","3289","","10.1039/a902061f","","","0.7107","MoKα","","0.0414","0.0377","","","0.0847","0.0859","","","","","","1.047","","","","has coordinates,has disorder","179979","2020-10-21","18:00:00",""
"7027389","9.204","0.004","17.129","0.004","10.041","0.004","90","","104.65","0.03","90","","1531.6","1","290.2","","290.2","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C28 H45 Cl2 N O P2 Ru -","- C28 H45 Cl2 N O P2 Ru -","- C56 H90 Cl4 N2 O2 P4 Ru2 -","2","1","","Bustelo, Emilio; Jiménez-Tenorio, Manuel; Puerta, Ma Carmen; Valerga, Pedro","Synthesis and characterization of new ruthenium(II) complexes containing diisopropylmethylphosphine","Journal of the Chemical Society, Dalton Transactions","1999","","14","2399","","10.1039/a902065i","","","0.7107","MoKalpha","","","0.0289","","","0.0353","","","","","1.273","1.273","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027390","18.8181","0.0006","10.8572","0.0003","29.2564","0.001","90","","96.791","0.001","90","","5935.5","0.3","223","2","223","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C26 H46 F6 P3 Rh -","- C26 H46 F6 P3 Rh -","- C208 H368 F48 P24 Rh8 -","8","2","","Wolf, Justin; Manger, Matthias; Schmidt, Ulrich; Fries, Guido; Barth, Dietmar; Weberndörfer, Birgit; Vicic, David A.; Jones, William D.; Werner, Helmut","A new synthetic route to ligands of the general composition R2PCH2ER′2 (E = P, As) and some rhodium complexes derived thereof","Journal of the Chemical Society, Dalton Transactions","1999","","11","1867","","10.1039/a902139f","","","0.71073","MoKα","","0.0673","0.0537","","0.1142","0.106","","","","1.139","1.162","1.162","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027391","10.064","0.0004","10.064","0.0004","57.716","0.004","90","","90","","120","","5062.5","0.5","173","2","173","2","","","","","","","","4","P 31 2 1","P 31 2""","152","","","","- C33 H62 As P -","- C33 H62 As P -","- C198 H372 As6 P6 -","6","1","","Wolf, Justin; Manger, Matthias; Schmidt, Ulrich; Fries, Guido; Barth, Dietmar; Weberndörfer, Birgit; Vicic, David A.; Jones, William D.; Werner, Helmut","A new synthetic route to ligands of the general composition R2PCH2ER′2 (E = P, As) and some rhodium complexes derived thereof","Journal of the Chemical Society, Dalton Transactions","1999","","11","1867","","10.1039/a902139f","","","0.71073","MoKα","","0.0729","0.0418","","0.0955","","0.0854","","","0.927","","","1.016","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027392","13.961","0.003","14.297","0.003","10.95","0.004","104.95","0.02","112.45","0.02","81.65","0.02","1948.9","1","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C34 H16 Cl12 Co Cr O6 -","- C34 H16 Cl12 Co Cr O6 -","- C68 H32 Cl24 Co2 Cr2 O12 -","2","1","","Chang, Ho-Chol; Ishii, Tomohiko; Kondo, Mitsuru; Kitagawa, Susumu","Synthesis, X-ray crystal structures and properties of chromium complexes with semiquinonate and catecholate","Journal of the Chemical Society, Dalton Transactions","1999","","15","2467","","10.1039/a902162k","","","0.7107","MoKα","","0.0417","0.0417","","","0.045","0.045","","","","","","1.478","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027393","14.303","0.002","15.084","0.003","12.907","0.005","109.62","0.02","99.31","0.02","91.86","0.02","2577.1","1.2","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C35 H20 Br12 Cr O6 S8 -","- C35 Br12 Cr O6 S8 -","- C70 Br24 Cr2 O12 S16 -","2","1","","Chang, Ho-Chol; Ishii, Tomohiko; Kondo, Mitsuru; Kitagawa, Susumu","Synthesis, X-ray crystal structures and properties of chromium complexes with semiquinonate and catecholate","Journal of the Chemical Society, Dalton Transactions","1999","","15","2467","","10.1039/a902162k","","","0.7107","MoKα","","0.0632","0.0632","","","0.0638","0.0638","","","","","","2.239","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027394","13.523","0.006","16.177","0.008","12.406","0.007","111.43","0.04","109.39","0.04","83.91","0.04","2383","2","296.2","","296.2","","","","","","","","","7","P -1","-P 1","2","","","","- C30 H16 Br12 Cl4 Cr O6 Se4 -","- C30 H16 Br12 Cl4 Cr O6 Se4 -","- C60 H32 Br24 Cl8 Cr2 O12 Se8 -","2","1","","Chang, Ho-Chol; Ishii, Tomohiko; Kondo, Mitsuru; Kitagawa, Susumu","Synthesis, X-ray crystal structures and properties of chromium complexes with semiquinonate and catecholate","Journal of the Chemical Society, Dalton Transactions","1999","","15","2467","","10.1039/a902162k","","","0.7107","MoKα","","0.057","0.057","","","0.0577","0.0577","","","","","","1.976","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027395","14.401","0.002","23.66","0.002","15.2958","0.0012","90","","97.404","0.009","90","","5168.2","0.9","293","1","293","1","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C30 H54 F6 O6 P S6 Tl7 -","- C30 F6 O6 P S6 Tl7 -","- C120 F24 O24 P4 S24 Tl28 -","4","1","","Barclay, J. Elaine; Evans, David J.; Davies, Sian C.; Hughes, David L.; Sobota, Piotr","A new thallium‒thiolate coordination environment as found in the polymer [{Tl7(Sthff )6}n][PF6]n (HSthff = tetrahydrofurfurylthiol)","Journal of the Chemical Society, Dalton Transactions","1999","","10","1533","","10.1039/a902193k","","","0.71069","MoKα","","0.1613","0.0521","","0.1328","0.0873","","","","0.955","1.141","1.141","","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027396","14.738","0.016","13.392","0.015","14.581","0.017","90","","92.069","0.01","90","","2876","6","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C25 H24 I2 Mo N O4 P -","- C25 H24 I2 Mo N O4 P -","- C100 H96 I8 Mo4 N4 O16 P4 -","4","2","","Baker, Paul K.; Drew, Michael G. B.; Evans, Deborah S.; Johans, Archie W.; Meehan, Margaret M.","Synthesis, molecular structures, fluxional properties and catalytic activity of a series of alkyne complexes of molybdenum(II) and tungsten(II) containing phosphite donor ligands","Journal of the Chemical Society, Dalton Transactions","1999","","15","2541","","10.1039/a902224d","","","0.71073","MoKα","","0.0915","0.0515","","","0.1375","0.1554","","","","","","1.063","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027397","10.439","0.012","11.186","0.014","16.11","0.017","89.763","0.01","73.927","0.01","77.097","0.01","1759","4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C35 H28 I2 Mo N O4 P -","- C35 H28 I2 Mo N O4 P -","- C70 H56 I4 Mo2 N2 O8 P2 -","2","1","","Baker, Paul K.; Drew, Michael G. B.; Evans, Deborah S.; Johans, Archie W.; Meehan, Margaret M.","Synthesis, molecular structures, fluxional properties and catalytic activity of a series of alkyne complexes of molybdenum(II) and tungsten(II) containing phosphite donor ligands","Journal of the Chemical Society, Dalton Transactions","1999","","15","2541","","10.1039/a902224d","","","0.71073","MoKα","","0.1155","0.0856","","","0.2223","0.2417","","","","","","1.019","","","","has coordinates","181910","2020-10-21","18:00:00",""
"7027398","12.121","0.013","15.702","0.017","20.38","0.02","90","","106.265","0.01","90","","3724","7","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C31.5 H34 I2 Mo N O5.5 P -","- C31.5 H29 I2 Mo N O5.5 P -","- C126 H116 I8 Mo4 N4 O22 P4 -","4","1","","Baker, Paul K.; Drew, Michael G. B.; Evans, Deborah S.; Johans, Archie W.; Meehan, Margaret M.","Synthesis, molecular structures, fluxional properties and catalytic activity of a series of alkyne complexes of molybdenum(II) and tungsten(II) containing phosphite donor ligands","Journal of the Chemical Society, Dalton Transactions","1999","","15","2541","","10.1039/a902224d","","","0.71073","MoKα","","0.1413","0.0926","","","0.2658","0.2996","","","","","","1.061","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027399","18.08","0.02","11.581","0.017","23.65","0.03","90","","112.475","0.01","90","","4576","10","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C46 H35 I2 Mo O7 P2 -","- C46 H38 I2 Mo O7 P2 -","- C184 H152 I8 Mo4 O28 P8 -","4","1","","Baker, Paul K.; Drew, Michael G. B.; Evans, Deborah S.; Johans, Archie W.; Meehan, Margaret M.","Synthesis, molecular structures, fluxional properties and catalytic activity of a series of alkyne complexes of molybdenum(II) and tungsten(II) containing phosphite donor ligands","Journal of the Chemical Society, Dalton Transactions","1999","","15","2541","","10.1039/a902224d","","","0.71073","MoKα","","0.1771","0.0814","","","0.2125","0.2693","","","","","","0.949","","","","has coordinates","179979","2020-10-21","18:00:00",""
"7027400","20.52","0.02","15.4","0.017","14.286","0.016","90","","90","","90","","4514","8","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C11 H24 I2 Mo O7 P2 -","- C11 H24 I2 Mo O7 P2 -","- C88 H192 I16 Mo8 O56 P16 -","8","1","","Baker, Paul K.; Drew, Michael G. B.; Evans, Deborah S.; Johans, Archie W.; Meehan, Margaret M.","Synthesis, molecular structures, fluxional properties and catalytic activity of a series of alkyne complexes of molybdenum(II) and tungsten(II) containing phosphite donor ligands","Journal of the Chemical Society, Dalton Transactions","1999","","15","2541","","10.1039/a902224d","","","0.71073","MoKα","","0.0807","0.0591","","","0.1749","0.1959","","","","","","1.073","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027401","11.133","0.012","40.22","0.05","19.49","0.02","90","","93.806","0.01","90","","8708","17","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C17 H36 I2 O7 P2 W -","- C17 H36 I2 O7 P2 W -","- C204 H432 I24 O84 P24 W12 -","12","3","","Baker, Paul K.; Drew, Michael G. B.; Evans, Deborah S.; Johans, Archie W.; Meehan, Margaret M.","Synthesis, molecular structures, fluxional properties and catalytic activity of a series of alkyne complexes of molybdenum(II) and tungsten(II) containing phosphite donor ligands","Journal of the Chemical Society, Dalton Transactions","1999","","15","2541","","10.1039/a902224d","","","0.71073","MoKα","","0.1602","0.108","","","0.3344","0.3847","","","","","","1.3","","","","has coordinates,has disorder","179980","2020-10-21","18:00:00",""
"7027402","14.116","0.015","14.142","0.015","9.143","0.009","90","","90","","90","","1825","3","293","2","293","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C23 H48 I2 Mo O7 P2 -","- C23 H48 I2 Mo O7 P2 -","- C46 H96 I4 Mo2 O14 P4 -","2","0.5","","Baker, Paul K.; Drew, Michael G. B.; Evans, Deborah S.; Johans, Archie W.; Meehan, Margaret M.","Synthesis, molecular structures, fluxional properties and catalytic activity of a series of alkyne complexes of molybdenum(II) and tungsten(II) containing phosphite donor ligands","Journal of the Chemical Society, Dalton Transactions","1999","","15","2541","","10.1039/a902224d","","","0.71073","MoKα","","0.084","0.0651","","","0.1733","0.1898","","","","","","0.823","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027403","14.079","0.015","14.072","0.015","9.146","0.009","90","","90","","90","","1812","3","293","2","293","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C23 H48 I2 O7 P2 W -","- C23 H48 I2 O7 P2 W -","- C46 H96 I4 O14 P4 W2 -","2","0.5","","Baker, Paul K.; Drew, Michael G. B.; Evans, Deborah S.; Johans, Archie W.; Meehan, Margaret M.","Synthesis, molecular structures, fluxional properties and catalytic activity of a series of alkyne complexes of molybdenum(II) and tungsten(II) containing phosphite donor ligands","Journal of the Chemical Society, Dalton Transactions","1999","","15","2541","","10.1039/a902224d","","","0.71073","MoKα","","0.0456","0.0427","","","0.1206","0.1258","","","","","","0.71","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027404","12.498","0.014","16.916","0.017","18.95","0.02","90","","97.944","0.01","90","","3968","7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H44 I2 O7 P2 W -","- C28 H50 I2 O7 P2 W -","- C112 H200 I8 O28 P8 W4 -","4","1","","Baker, Paul K.; Drew, Michael G. B.; Evans, Deborah S.; Johans, Archie W.; Meehan, Margaret M.","Synthesis, molecular structures, fluxional properties and catalytic activity of a series of alkyne complexes of molybdenum(II) and tungsten(II) containing phosphite donor ligands","Journal of the Chemical Society, Dalton Transactions","1999","","15","2541","","10.1039/a902224d","","","0.71073","MoKα","","0.1761","0.0901","","","0.2215","0.2621","","","","","","1.128","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027405","11.631","0.014","11.29","0.014","15.645","0.017","90","","99.636","0.01","90","","2025","4","293","2","293","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C27 H24 -","- C27 H24 -","- C108 H96 -","4","1","","Baker, Paul K.; Drew, Michael G. B.; Evans, Deborah S.; Johans, Archie W.; Meehan, Margaret M.","Synthesis, molecular structures, fluxional properties and catalytic activity of a series of alkyne complexes of molybdenum(II) and tungsten(II) containing phosphite donor ligands","Journal of the Chemical Society, Dalton Transactions","1999","","15","2541","","10.1039/a902224d","","","0.71073","MoKα","","0.1713","0.0912","","","0.2526","0.3101","","","","","","0.98","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027406","14.809","0.003","14.809","0.003","18.39","0.003","90","","90","","120","","3492.7","1.2","293","2","293","2","","","","","","","","6","P -3 c 1","-P 3 2""c","165","","","","- C42 H96 Fe2 N30 Ni3 O9 -","- C42 H66 Fe2 N30 Ni3 O9 -","- C84 H132 Fe4 N60 Ni6 O18 -","2","0.166667","","Kou, Hui-Zhong; Gao, Song; Bu, Wei-Ming; Liao, Dai-Zheng; Ma, Bao-Qing; Jiang, Zong-Hui; Yan, Shi-Ping; Fan, Yu-Guo; Wang, Geng-Lin","Synthesis, crystal structure and metamagnetic properties of a two-dimensional honeycomb network based on ferricyanide and (3,10-dimethyl-1,3,5,8,10,12-hexaazacyclotetradecane)nickel(II) building blocks †","Journal of the Chemical Society, Dalton Transactions","1999","","15","2477","","10.1039/a902228g","","","0.71073","MoKα","","0.0526","0.0485","","0.1255","0.109","","","","0.991","1.134","1.134","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027407","13.24","0.01","13.79","0.02","11.2","0.01","90","","112.63","0.07","90","","1887","4","223","2","223","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H21 Cr O9 -","- C20 H18 Cr O9 -","- C80 H72 Cr4 O36 -","4","1","","Braga, Dario; Benedi, Oscar; Maini, Lucia; Grepioni, Fabrizia","Organometallic crystal engineering with multidentate building blocks and template guest size effect. Supra-anionic organic frameworks obtained from cyclobutane-1,2,3,4-tetracarboxylic and trans-acotinic acids †","Journal of the Chemical Society, Dalton Transactions","1999","","15","2611","","10.1039/a902258i","","","0.71069","MoKα","","0.4195","0.086","","","0.1551","0.2616","","","0.926","","","0.926","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027408","11.4656","0.0001","9.9676","0.0001","17.0414","0.0003","90","","96.125","0.001","90","","1936.45","0.04","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[methyltris(3,5-dimethylpyrazol-1-yl)boratothallium(I)]","","- C16 H24 B N6 Tl -","- C16 H24 B N6 Tl -","- C64 H96 B4 N24 Tl4 -","4","1","","Janiak, Christoph; Braun, Lothar; Girgsdies, Frank","A new route to tris(pyrazolyl)borate ligands and new structural variations in TlTp complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3133","","10.1039/a902264c","","","0.71073","MoKα","","0.056","0.0312","","","0.0566","0.0625","","","","","","1.048","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027409","8.1756","0.0001","14.1921","0.0001","13.9746","0.0001","90","","96.771","0.001","90","","1610.15","0.03","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","[methyltris(3-methylpyrazol-1-yl)boratothallium(I)]","","- C13 H18 B N6 Tl -","- C13 H18 B N6 Tl -","- C52 H72 B4 N24 Tl4 -","4","1","","Janiak, Christoph; Braun, Lothar; Girgsdies, Frank","A new route to tris(pyrazolyl)borate ligands and new structural variations in TlTp complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3133","","10.1039/a902264c","","","0.71073","MoKα","","0.0502","0.0311","","","0.0617","0.0688","","","","","","1.024","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027410","30.6275","0.0005","8.6168","0.0001","15.6585","0.0002","90","","119.812","0.001","90","","3585.57","0.09","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","[hydrotris(3,5-dimethylpyrazol-1-yl)boratothallium(I)]","","- C15 H22 B N6 Tl -","- C15 H22 B N6 Tl -","- C120 H176 B8 N48 Tl8 -","8","1","","Janiak, Christoph; Braun, Lothar; Girgsdies, Frank","A new route to tris(pyrazolyl)borate ligands and new structural variations in TlTp complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3133","","10.1039/a902264c","","","0.71073","MoKα","","0.079","0.0479","","","0.0948","0.106","","","","","","1.006","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027411","16.096","0.003","6.518","0.0013","18.01","0.004","90","","90","","90","","1889.5","0.7","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","Tris(copper bromide) triazine","Tris(copper bromide) 1,3,5-triazine","","- C3 H3 Br3 Cu3 N3 -","- C3 H3 Br3 Cu3 N3 -","- C24 H24 Br24 Cu24 N24 -","8","1","","Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Cooke, Paul A.; Deveson, Anne M.; Fenske, Dieter; Hubberstey, Peter; Li, Wan-Sheung; Schröder, Martin","Controlling copper(I) halide framework formation using N-donor bridging ligand symmetry: use of 1,3,5-triazine to construct architectures with threefold symmetry","Journal of the Chemical Society, Dalton Transactions","1999","","13","2103","","10.1039/a902290b","","","0.71073","MoKα","","0.0474","0.0391","","","0.0915","0.0968","","","","","","1.087","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027412","6.913","0.004","9.777","0.005","15.75","0.009","90","","90","","90","","1064.5","1","150","2","150","2","","","","","","","","5","P n m a","-P 2ac 2n","62","Tri(copper(i) iodide) triazine","1,3,5-triazine tris(copper(I) iodide)","","- C3 H3 Cu3 I3 N3 -","- C3 H3 Cu3 I3 N3 -","- C12 H12 Cu12 I12 N12 -","4","0.5","","Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Cooke, Paul A.; Deveson, Anne M.; Fenske, Dieter; Hubberstey, Peter; Li, Wan-Sheung; Schröder, Martin","Controlling copper(I) halide framework formation using N-donor bridging ligand symmetry: use of 1,3,5-triazine to construct architectures with threefold symmetry","Journal of the Chemical Society, Dalton Transactions","1999","","13","2103","","10.1039/a902290b","","","0.71073","MoKα","","0.0371","0.0293","","","0.0719","0.0755","","","","","","1.183","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027413","14.247","0.006","14.247","0.006","6.415","0.003","90","","90","","120","","1127.6","0.9","150","2","150","2","","","","","","","","5","P 63 m c","P 6c -2c","186","Copper Bromide Triazine","1,3,5-triazine tris(copper(I) bromide)","","- C6 H6 Br4 Cu4 N6 -","- C6 H6 Br4 Cu4 N6 -","- C18 H18 Br12 Cu12 N18 -","3","0.25","","Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Cooke, Paul A.; Deveson, Anne M.; Fenske, Dieter; Hubberstey, Peter; Li, Wan-Sheung; Schröder, Martin","Controlling copper(I) halide framework formation using N-donor bridging ligand symmetry: use of 1,3,5-triazine to construct architectures with threefold symmetry","Journal of the Chemical Society, Dalton Transactions","1999","","13","2103","","10.1039/a902290b","","","0.71073","MoKα","","0.0376","0.0328","","","0.0791","0.0819","","","","","","1.109","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027414","15.38","0.004","7.7248","0.0008","6.913","0.0003","90","","90","","90","","821.3","0.2","150","2","150","2","","","","","","","","5","C m c 21","C 2c -2","36","Dicopper diiodide triazine","1,3,5-triazine bis(copper(I) iodide)","","- C3 H3 Cu2 I2 N3 -","- C3 H3 Cu2 I2 N3 -","- C12 H12 Cu8 I8 N12 -","4","0.5","","Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Cooke, Paul A.; Deveson, Anne M.; Fenske, Dieter; Hubberstey, Peter; Li, Wan-Sheung; Schröder, Martin","Controlling copper(I) halide framework formation using N-donor bridging ligand symmetry: use of 1,3,5-triazine to construct architectures with threefold symmetry","Journal of the Chemical Society, Dalton Transactions","1999","","13","2103","","10.1039/a902290b","","","0.71073","MoKα","","0.0263","0.0257","","","0.0639","0.0642","","","","","","1.164","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027415","11.952","0.002","11.247","0.002","18.779","0.004","90","","101.89","0.03","90","","2470.2","0.8","291","2","291","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H18 Cu3 Mo N4 O S3 -","- C19 H15 Cu3 Mo N4 O S3 -","- C76 H60 Cu12 Mo4 N16 O4 S12 -","4","1","","Hou, Hongwei; Zheng, Hegen; Ang, How Ghee; Fan, Yaoting; Low, Michael K. M.; Zhu, Yu; Wang, Wenling; Xin, Xinquan; Ji, Wei; Wong, Wing-Tak","Synthesis, crystal structure and nonlinear optical properties of two novel linear cluster polymers {[MoOS3Cu3(CN)(py)3]·0.5C6H6}n and [WOS3Cu3(CN)(py)4]n","Journal of the Chemical Society, Dalton Transactions","1999","","17","2953","","10.1039/a902352f","","","0.71073","MoKα","","0.0546","0.0451","","","0.1183","0.1241","","","","","","1.125","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027416","13.023","0.003","12.199","0.002","17.579","0.004","90","","95.09","0.03","90","","2781.7","1","291","2","291","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C21 H20 Cu3 N5 O S3 W -","- C21 H20 Cu3 N5 O S3 W -","- C84 H80 Cu12 N20 O4 S12 W4 -","4","1","","Hou, Hongwei; Zheng, Hegen; Ang, How Ghee; Fan, Yaoting; Low, Michael K. M.; Zhu, Yu; Wang, Wenling; Xin, Xinquan; Ji, Wei; Wong, Wing-Tak","Synthesis, crystal structure and nonlinear optical properties of two novel linear cluster polymers {[MoOS3Cu3(CN)(py)3]·0.5C6H6}n and [WOS3Cu3(CN)(py)4]n","Journal of the Chemical Society, Dalton Transactions","1999","","17","2953","","10.1039/a902352f","","","0.71073","MoKα","","0.1044","0.0865","","","0.2257","0.2513","","","","","","1.139","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027417","9.1846","0.0003","13.9712","0.0005","14.6305","0.0003","90","","90","","90","","1877.38","0.1","173","2","173","2","","","","","","","","5","P c 21 n","P -2n -2ac","33","","","","- C12 H26 Cl Na O11 -","- C12 H26 Cl Na O11 -","- C48 H104 Cl4 Na4 O44 -","4","1","","Steed, Jonathan W.; Junk, Peter C.","Stabilisation of sodium complexes of 18-crown-6 by intramolecular hydrogen bonding †","Journal of the Chemical Society, Dalton Transactions","1999","","13","2141","","10.1039/a902358e","","","0.7107","MoKα","","0.0319","0.0298","","","0.0745","0.0766","","","","","","1.059","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027418","12.059","0.0004","10.5053","0.0003","14.0593","0.0005","90","","103.295","0.002","90","","1733.35","0.1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H26 N Na O10 -","- C12 H26 N Na O10 -","- C48 H104 N4 Na4 O40 -","4","1","","Steed, Jonathan W.; Junk, Peter C.","Stabilisation of sodium complexes of 18-crown-6 by intramolecular hydrogen bonding †","Journal of the Chemical Society, Dalton Transactions","1999","","13","2141","","10.1039/a902358e","","","0.7107","MoKα","","0.0398","0.0325","","","0.0788","0.0837","","","","","","1.056","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027419","7.9787","0.0012","14.377","0.0006","16.9546","0.0008","90","","98.254","0.002","90","","1924.7","0.3","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H27 Na O11 Re -","- C12 H24 Na O11 Re -","- C48 H96 Na4 O44 Re4 -","4","1","","Steed, Jonathan W.; Junk, Peter C.","Stabilisation of sodium complexes of 18-crown-6 by intramolecular hydrogen bonding †","Journal of the Chemical Society, Dalton Transactions","1999","","13","2141","","10.1039/a902358e","","","0.7107","MoKα","","0.0716","0.0688","","","0.1789","0.1831","","","","","","1.077","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027420","9.5186","0.0008","10.4064","0.0009","11.025","0.0006","67.825","0.001","76.113","0.001","67.551","0.001","928.78","0.12","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H28 N3 Na O8 -","- C12 H24 N3 Na O8 -","- C24 H48 N6 Na2 O16 -","2","1","","Steed, Jonathan W.; Junk, Peter C.","Stabilisation of sodium complexes of 18-crown-6 by intramolecular hydrogen bonding †","Journal of the Chemical Society, Dalton Transactions","1999","","13","2141","","10.1039/a902358e","","","0.7107","MoKα","","0.0892","0.0606","","","0.1611","0.1824","","","","","","1.063","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027421","20.6803","0.0008","11.048","0.0005","10.8675","0.0003","90","","109.989","0.002","90","","2333.38","0.16","123","2","123","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C12 H28 I3 Na O8 -","- C12 H28 I3 Na O8 -","- C48 H112 I12 Na4 O32 -","4","0.5","","Steed, Jonathan W.; Junk, Peter C.","Stabilisation of sodium complexes of 18-crown-6 by intramolecular hydrogen bonding †","Journal of the Chemical Society, Dalton Transactions","1999","","13","2141","","10.1039/a902358e","","","0.7107","MoKα","","0.0266","0.0246","","","0.0615","0.0628","","","","","","1.082","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027422","13.4119","0.0009","13.9456","0.001","22.593","0.0017","77.532","0.002","74.082","0.002","62.094","0.002","3572.1","0.4","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H93 B2 Na2 O15 -","- C74 H88 B2 Na2 O15 -","- C148 H176 B4 Na4 O30 -","2","1","","Steed, Jonathan W.; Junk, Peter C.","Stabilisation of sodium complexes of 18-crown-6 by intramolecular hydrogen bonding †","Journal of the Chemical Society, Dalton Transactions","1999","","13","2141","","10.1039/a902358e","","","0.7107","MoKα","","0.0959","0.0617","","","0.1366","0.154","","","","","","1.024","","","","has coordinates,has disorder","179980","2020-10-21","18:00:00",""
"7027423","11.6668","0.0013","13.9198","0.0012","35.885","0.003","90","","90.533","0.015","90","","5827.5","1","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H77 O19 P3 S Ti4 -","- C44 H77 O19 P3 S Ti4 -","- C176 H308 O76 P12 S4 Ti16 -","4","1","","Guerrero, Gilles; Mehring, Michael; Mutin, P. Hubert; Dahan, Françoise; Vioux, André","Syntheses and single-crystal structures of novel soluble phosphonato- and phosphinato-bridged titanium oxo alkoxides","Journal of the Chemical Society, Dalton Transactions","1999","","10","1537","","10.1039/a902407g","","","0.71073","MoKα","","0.0365","0.0249","","","0.0526","0.0549","","","","","","0.892","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027424","12.4983","0.001","16.1317","0.0014","33.706","0.003","90","","97.141","0.01","90","","6743.1","1","180","2","180","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C61 H71 O16.5 P4 S0.5 Ti4 -","- C61 H71 O16.5 P4 S0.5 Ti4 -","- C244 H284 O66 P16 S2 Ti16 -","4","1","","Guerrero, Gilles; Mehring, Michael; Mutin, P. Hubert; Dahan, Françoise; Vioux, André","Syntheses and single-crystal structures of novel soluble phosphonato- and phosphinato-bridged titanium oxo alkoxides","Journal of the Chemical Society, Dalton Transactions","1999","","10","1537","","10.1039/a902407g","","","0.71073","MoKα","","0.0401","0.024","","","0.0568","0.0607","","","","","","0.836","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027425","10.878","0.0013","9.0848","0.0009","14.213","0.002","90","","90","","90","","1404.6","0.3","203","2","203","2","","","","","","","","6","C m c 21","C 2c -2","36","","","","- C6 H18 I2 N3 P S -","- C6 H18 I2 N3 P S -","- C24 H72 I8 N12 P4 S4 -","4","0.5","","Cross, Wendy I.; Godfrey, Stephen M.; Jackson, Sheena L.; McAuliffe, Charles A.; Pritchard, Robin G.","The reaction of the tertiary phosphine sulfides R3PS (R = Ph, Me2N or C6H11) with X2 (X2 = I2, Br2, IBr or ICl); structural characterisation of the CT complexes (Me2N)3PSI2 and Ph3PS(I0.89Br0.11)Br and the ionic compound [{(Me2N)3PS}2S]2+ 2[Br3]−","Journal of the Chemical Society, Dalton Transactions","1999","","13","2225","","10.1039/a902433f","","","0.71069","MoKα","","0.0326","0.0323","","","0.0827","0.083","","","","","","1.187","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027426","12.352","0.002","9.3856","0.001","15.298","0.002","90","","95.47","0.02","90","","1765.4","0.4","203","2","203","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H15 Br I P S -","- C18 H15 Br1.112 I0.888 P S -","- C72 H60 Br4.448 I3.552 P4 S4 -","4","1","","Cross, Wendy I.; Godfrey, Stephen M.; Jackson, Sheena L.; McAuliffe, Charles A.; Pritchard, Robin G.","The reaction of the tertiary phosphine sulfides R3PS (R = Ph, Me2N or C6H11) with X2 (X2 = I2, Br2, IBr or ICl); structural characterisation of the CT complexes (Me2N)3PSI2 and Ph3PS(I0.89Br0.11)Br and the ionic compound [{(Me2N)3PS}2S]2+ 2[Br3]−","Journal of the Chemical Society, Dalton Transactions","1999","","13","2225","","10.1039/a902433f","","","0.71069","MoKα","","0.041","0.0295","","","0.0724","0.0779","","","","","","0.995","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027427","8.429","0.002","9.972","0.002","19.282","0.004","80.66","0.02","81.18","0.02","74.33","0.02","1529.5","0.6","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H36 Br6 N6 P2 S3 -","- C12 H36 Br6 N6 P2 S3 -","- C24 H72 Br12 N12 P4 S6 -","2","1","","Cross, Wendy I.; Godfrey, Stephen M.; Jackson, Sheena L.; McAuliffe, Charles A.; Pritchard, Robin G.","The reaction of the tertiary phosphine sulfides R3PS (R = Ph, Me2N or C6H11) with X2 (X2 = I2, Br2, IBr or ICl); structural characterisation of the CT complexes (Me2N)3PSI2 and Ph3PS(I0.89Br0.11)Br and the ionic compound [{(Me2N)3PS}2S]2+ 2[Br3]−","Journal of the Chemical Society, Dalton Transactions","1999","","13","2225","","10.1039/a902433f","","","0.71069","MoKα","","0.1048","0.0544","","","0.1176","0.1386","","","","","","1.007","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027428","10.1","0.003","17.727","0.005","42.363","0.009","90","","96.06","0.02","90","","7542","3","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C43 H37 B Mn N2 O4 P -","- C43 H35.598 B Mn N2 O4 P -","- C344 H284.784 B8 Mn8 N16 O32 P8 -","8","2","","Bellamy, Dena; Connelly, Neil G.; Hicks, Owen M.; Orpen, A. Guy","Triphenylboron adducts of redox-active cyanomanganese ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","18","3185","","10.1039/a902478f","","","0.71073","MoKα","","0.1244","0.0663","","0.1737","0.1491","","","","1.019","1.167","1.167","","","","","has coordinates,has disorder","179980","2020-10-21","18:00:00",""
"7027429","16.267","0.003","13.822","0.003","24.993","0.005","90","","97.95","0.03","90","","5565","2","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C35 H39 Cl13 Mn N O5 P3 Sb2 -","- C35 H39 Cl13 Mn N O5 P3 Sb2 -","- C140 H156 Cl52 Mn4 N4 O20 P12 Sb8 -","4","1","","Bellamy, Dena; Brown, Nathan C.; Connelly, Neil G.; Orpen, A. Guy","The synthesis and structure of a paramagnetic Lewis base adduct of antimony pentachloride, trans-[MnII(CNSbCl5)(CO)2{P(OEt)3}(dppm)][SbCl6] †","Journal of the Chemical Society, Dalton Transactions","1999","","18","3191","","10.1039/a902481f","","","0.71073","MoKα","","0.0585","0.0476","","0.1334","0.1205","","","","1.111","1.099","1.099","","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7027430","7.01","0.0002","13.7821","0.0003","12.6683","0.0002","90","","105.3","0.001","90","","1180.54","0.05","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H15 Mo N4 O8.5 -","- C4 H10 Mo N4 O8.5 -","- C16 H40 Mo4 N16 O34 -","4","1","","Farkas, Etelka; Csóka, Hajnalka; Bell, Gareth; Brown, David A.; Cuffe, Laurence P.; Fitzpatrick, Noel J.; Glass, William K.; Errington, William; Kemp, Terence J.","Oxygen versus nitrogen co-ordination in complexes of MoVI and hydroxamate derivatives of α-amino acids: equilibrium, structural and theoretical studies †","Journal of the Chemical Society, Dalton Transactions","1999","","16","2789","","10.1039/a902572c","","","0.71073","MoKα","","0.0629","0.051","","","0.1256","0.1302","","","","","","1.105","","","","has coordinates,has disorder","198632","2020-10-21","18:00:00",""
"7027431","7.769","0.002","19.351","0.006","12.688","0.003","90","","104.41","0.02","90","","1847.5","0.9","200","","200","","","","","","","","?","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H10 F4 O4 Re2 -","- C20 H10 F4 O4 Re2 -","- C80 H40 F16 O16 Re8 -","4","1","","Godoy, Fernando; Higgitt, Catherine L.; Klahn, A. Hugo; Oelckers, Beatriz; Parsons, Simon; Perutz, Robin N.","Photochemical reactions of [Re(η5-C5R5)(CO)3] (R = H or Me) with partially fluorinated benzenes: C‒H and C‒F activation","Journal of the Chemical Society, Dalton Transactions","1999","","12","2039","","10.1039/a902573a","","","0.71073","MoKα","","","0.0395","","","0.04","","","","","1.1494","1.1494","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027432","8.15","0.002","8.564","0.002","11.278","0.002","90","","101.87","0.03","90","","770.3","0.3","180","2","180","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H22 As Li O2 -","- C14 H21 As Li O2 -","- C28 H42 As2 Li2 O4 -","2","1","","Beswick, Michael A.; Lawson, Yvonne G.; Raithby, Paul R.; Wood, Jody A.; Wright, Dominic S.","A metallated primary arsine; synthesis and structure of [PhAsHLi·2thf ]\ιnfty","Journal of the Chemical Society, Dalton Transactions","1999","","12","1921","","10.1039/a902590a","","","0.71073","MoKα","","0.1293","0.104","","","0.2339","0.2439","","","","","","1.595","","","","has coordinates,has disorder","179980","2020-10-21","18:00:00",""
"7027433","17.3431","0.0002","15.4671","0.0001","18.0049","0.0002","90","","90","","90","","4829.77","0.08","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C14 H2 As F3 O13 Ru4 -","- C14 H2 As F3 O13 Ru4 -","- C112 H16 As8 F24 O104 Ru32 -","8","1","","Ang, How Ghee; Ang, Siau Gek; Du, Shaowu; Sow, Boon Hwa; Wu, Xintao","Reactions of trifluoromethyl-phosphine and -arsine with a ruthenium carbonyl cluster: synthesis, characterization and reactivity of cluster derivatives capped by trifluoromethyl-phosphinidene and -arsinidene moieties","Journal of the Chemical Society, Dalton Transactions","1999","","16","2799","","10.1039/a902598g","","","0.71073","MoKα","","0.0375","0.0252","","0.0498","0.0448","","","","1.13","1.13","1.13","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027434","9.789","0.003","18.534","0.005","13.689","0.004","90","","91.64","0.02","90","","2482.6","1.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H27 N O10 V -","- C21 H27 N O10 V -","- C84 H108 N4 O40 V4 -","4","2","","Rajak, Kajal Krishna; Rath, Sankar Prasad; Mondal, Sujit; Chakravorty, Animesh","Sugar vanadates: synthesis and characterisation of mannopyranoside and ribofuranoside esters incorporating VO3+","Journal of the Chemical Society, Dalton Transactions","1999","","15","2537","","10.1039/a902632k","","","0.71073","MoKα","","0.1034","0.0649","","0.1637","0.1396","","","","1.03","1.082","1.082","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027435","17.9414","0.0008","13.6413","0.0006","18.8617","0.0009","90","","112.26","0.001","90","","4272.3","0.3","120","2","120","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C36 H49 B2 Cu F10 Fe N6 O5 -","- C36 H43 B2 Cu F10 Fe N6 O6 -","- C144 H172 B8 Cu4 F40 Fe4 N24 O24 -","4","1","","Ghiladi, Morten; Jensen, Kenneth B.; Jiang, Jianzhong; McKenzie, Christine J.; Mørup, Steen; Søtofte, Inger; Ulstrup, Jens","Synthesis and characterization of dinuclear complexes containing the FeIII‒F · · · (H2O)MII motif","Journal of the Chemical Society, Dalton Transactions","1999","","16","2675","","10.1039/a902678i","","","0.71073","MoKα","","0.0916","0.0538","","0.1481","0.1228","","","","1.099","1.104","1.104","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027436","12.191","0.002","21.792","0.004","16.435","0.003","90","","93.92","0.03","90","","4356","1.3","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C40 H45 B2 F8 Fe2 N6 O5 -","- C40 H45 B2 F8 Fe2 N6 O5 -","- C160 H180 B8 F32 Fe8 N24 O20 -","4","1","","Ghiladi, Morten; Jensen, Kenneth B.; Jiang, Jianzhong; McKenzie, Christine J.; Mørup, Steen; Søtofte, Inger; Ulstrup, Jens","Synthesis and characterization of dinuclear complexes containing the FeIII–F · · · (H2O)MII motif","Journal of the Chemical Society, Dalton Transactions","1999","","16","2675","","10.1039/a902678i","","","0.71073","MoKα","","0.2028","0.085","","0.2144","0.1636","","","","1.007","1.183","1.183","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027437","8.324","0.001","17.879","0.003","20.464","0.004","90","","100.92","","90","","2990.4","0.9","183","2","183","2","","","","","","","synthesis","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H33 Cl7 N2 W -","- C25 H33 Cl7 N2 W -","- C100 H132 Cl28 N8 W4 -","4","1","","Cremer, Christian; Burger, Peter","Synthesis and crystal structure of the 16 e− cationic tungsten(IV) complex [WCp*(4,4′-Me2bipy)Cl2]+BPh4− †","Journal of the Chemical Society, Dalton Transactions","1999","","12","1967","","10.1039/a902743b","","","0.71073","MoKα","","0.0629","0.0563","","0.1463","0.1069","","","","1.321","1.336","1.336","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027438","11.672","0.001","16.362","0.002","21.122","0.002","90","","99.61","0.01","90","","3977.2","0.7","193","2","193","2","","","","","","","synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C46 H47 B Cl2 N2 W -","- C46 H47 B Cl2 N2 W -","- C184 H188 B4 Cl8 N8 W4 -","4","1","","Cremer, Christian; Burger, Peter","Synthesis and crystal structure of the 16 e− cationic tungsten(IV) complex [WCp*(4,4′-Me2bipy)Cl2]+BPh4− †","Journal of the Chemical Society, Dalton Transactions","1999","","12","1967","","10.1039/a902743b","","","0.71073","MoKα","","0.0322","0.0192","","0.0372","0.0363","","","","0.991","1.135","1.135","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027439","22.428","0.002","9.2642","0.0006","23.646","0.002","90","","115.132","0.009","90","","4448","0.7","183","2","183","2","","","","","","","synthesis","7","P 1 21/n 1","-P 2yn","14","","","","- C49 H51 B Cl4 N2 O W -","- C49 H49 B Cl4 N2 O1.128 W -","- C196 H196 B4 Cl16 N8 O4.512 W4 -","4","1","","Cremer, Christian; Burger, Peter","Synthesis and crystal structure of the 16 e− cationic tungsten(IV) complex [WCp*(4,4′-Me2bipy)Cl2]+BPh4− †","Journal of the Chemical Society, Dalton Transactions","1999","","12","1967","","10.1039/a902743b","","","0.71073","MoKα","","0.0442","0.028","","0.077","0.0668","","","","1.057","1.07","1.07","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027440","13.459","0.004","13.517","0.006","13.843","0.006","76.75","0.04","74.45","0.04","78.76","0.04","2337.6","1.7","294.2","","294.2","","","","","","","","","5","P -1","-P 1","2","","","","- C52 H61 B Fe P4 -","- C52 H61 B Fe P4 -","- C104 H122 B2 Fe2 P8 -","2","1","","Field, Leslie D.; Messerle, Barbara A.; Smernik, Ronald J.; Hambley, Trevor W.; Turner, Peter","Butenynyl complexes of iron(II) containing the tripodal tetraphosphine ligand P(CH2CH2PMe2)3","Journal of the Chemical Society, Dalton Transactions","1999","","15","2557","","10.1039/a902784j","","","0.7109","MoKα","","0.0534","0.0534","","0.0433","0.0433","","","","1.546","1.546","1.546","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027441","10.704","0.002","14.043","0.003","10.889","0.002","90","","109.57","0.03","90","","1542.2","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H40 O2 Sb2 Si2 -","- C26 H40 O2 Sb2 Si2 -","- C52 H80 O4 Sb4 Si4 -","2","0.5","","Jones, Cameron; Steed, Jonathan W.; Thomas, Ryan C.","Compounds containing λ3,σ2-SbC bonds: synthesis and structural characterisation of the first stiba-enol, Mes*C(O)SbC(OH)Mes* (Mes* = C6H2But3-2,4,6) and a 2,3-distibabutadiene, {Mes(Me3SiO)CSb}2 (Mes = C6H2Me3-2,4,6) †","Journal of the Chemical Society, Dalton Transactions","1999","","10","1541","","10.1039/a902791b","","","0.7107","MoKα","","0.0482","0.0331","","","0.094","0.1127","","","","","","0.502","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027442","11.4906","0.0002","20.0826","0.0004","31.2742","0.0005","90","","90","0.002","90","","7216.9","0.2","100","2","100","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C38 H59 O2 Sb -","- C38 H59 O2 Sb -","- C304 H472 O16 Sb8 -","8","1","","Jones, Cameron; Steed, Jonathan W.; Thomas, Ryan C.","Compounds containing λ3,σ2-SbC bonds: synthesis and structural characterisation of the first stiba-enol, Mes*C(O)SbC(OH)Mes* (Mes* = C6H2But3-2,4,6) and a 2,3-distibabutadiene, {Mes(Me3SiO)CSb}2 (Mes = C6H2Me3-2,4,6) †","Journal of the Chemical Society, Dalton Transactions","1999","","10","1541","","10.1039/a902791b","","","0.7107","MoKα","","0.0632","0.0423","","","0.0833","0.0894","","","","","","1.079","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027443","8.6599","0.0017","16.907","0.004","12.784","0.002","90","","106.208","0.019","90","","1797.3","0.6","220","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","{Cu[exoO~2~cyclam]}~2~Cu(ClO4)~2~2H~2~O","[((1,4,8,11-tetraaza-κ^4^N)-cyclotetradecane-2,3- dione-(hydrato-/kO)copper(II))2-κ^4^O-copper(II))] bis perchlorate dihydrate","","- C20 H44 Cl2 Cu3 N8 O16 -","- C20 H38 Cl2 Cu3 N8 O14 -","- C40 H76 Cl4 Cu6 N16 O28 -","2","0.5","","Cronin, Leroy; Mount, Andrew R.; Parsons, Simon; Robertson, Neil","A new class of macrocycle capable of binding exogenous metals: synthesis, structure, magnetic and electrochemical properties of a Cu(II) trinuclear complex based upon 1,4,8,11-tetraazacyclotetradecane-2,3-dione [exoO2]cyclam †","Journal of the Chemical Society, Dalton Transactions","1999","","12","1925","","10.1039/a902792k","","","1.5418","CuKα","","0.0659","0.0555","","","0.146","0.1532","","","","","","1.048","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027444","10.7699","0.001","11.6826","0.001","19.751","0.002","90","","90","","90","","2485.1","0.4","150","2","150","2","","","","","","","","9","P 21 21 21","P 2ac 2ab","19","","","","- C16 H21 B2 Cl2 F8 Fe2 N O S2 -","- C16 H21 B2 Cl2 F8 Fe2 N O S2 -","- C64 H84 B8 Cl8 F32 Fe8 N4 O4 S8 -","4","1","","Madec, Pascale; Muir, Kenneth W.; Pétillon, François Y.; Rumin, René; Scaon, Yannick; Schollhammer, Philippe; Talarmin, Jean","Generation of substrate-binding sites by electrochemical reduction of cis-[Fe2(cp)2(μ-SMe)2(MeCN)(L)]2+ (L = CO or MeCN). Reactivity of the sites toward CO and tBuNC. Crystal structure of [Fe2(cp)2(μ-SMe)2(CO)(MeCN)][BF4]2·CH2Cl2","Journal of the Chemical Society, Dalton Transactions","1999","","14","2371","","10.1039/a902793i","","","0.6915","synchrotron","","0.0346","0.0325","","","0.086","0.0873","","","","","","0.992","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027445","21.139","0.007","15.858","0.006","15.665","0.006","90","0.03","90","0.03","90","0.03","5251","3","293","","293","","","","","","","","Synthesized in the laboratory","6","P b c a","-P 2ac 2ab","61","","","","- C26 H24 Cl2 Cu N4 O4 -","- C28 H14 Cl4 Cu N4 O4 -","- C224 H112 Cl32 Cu8 N32 O32 -","8","1","","Patra, Apurba Kumar; Ray, Manabendra; Mukherjee, Rabindranath","Synthesis, crystal structure and properties of trigonal bipyramidal [M(L5)2(H2O)]·H2O complexes [M = cobalt(II) (S = 3/2) or copper(II) (S = 1/2); HL5 = N-(2-chloro-6-methylphenyl)pyridine-2-carboxamide]","Journal of the Chemical Society, Dalton Transactions","1999","","15","2461","","10.1039/a902851j","","","0.71073","MoK-alpha","","0.097","0.056","","0.06","0.054","","","","2.569","3.023","3.023","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027446","21.039","0.009","15.841","0.003","15.678","0.005","90","0.01","90","0.03","90","0.03","5225","3","293","","293","","","","","","","","Synthesized in the laboratory","6","P b c a","-P 2ac 2ab","61","","","","- C26 H24 Cl2 Co N4 O4 -","- C28 H14 Cl4 Co N4 O4 -","- C224 H112 Cl32 Co8 N32 O32 -","8","1","","Patra, Apurba Kumar; Ray, Manabendra; Mukherjee, Rabindranath","Synthesis, crystal structure and properties of trigonal bipyramidal [M(L5)2(H2O)]·H2O complexes [M = cobalt(II) (S = 3/2) or copper(II) (S = 1/2); HL5 = N-(2-chloro-6-methylphenyl)pyridine-2-carboxamide]","Journal of the Chemical Society, Dalton Transactions","1999","","15","2461","","10.1039/a902851j","","","0.71073","MoK-alpha","","0.149","0.058","","0.058","0.046","","","","1.968","2.499","2.499","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027447","11.104","0.002","10.193","0.002","24.365","0.005","90","","99.34","0.03","90","","2721.1","0.9","293","2","293","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C20 H28 N8 O12 Pd -","- C20 H18 N8 O12 Pd -","- C80 H72 N32 O48 Pd4 -","4","1","","Coşar, Sultan; Janik, Matthias B. L.; Flock, Matthias; Freisinger, Eva; Farkas, Etelka; Lippert, Bernhard","Mono- and di-nuclear complexes of (trpy)MII (M = Pd, Pt) with the model nucleobase 1-methylcytosine. Crystal structure and NMR solution studies","Journal of the Chemical Society, Dalton Transactions","1999","","14","2329","","10.1039/a902862e","","","0.71069","MoKα","","0.0585","0.0366","","0.0705","0.0641","","","","0.912","0.998","0.998","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027448","14.309","0.003","10.961","0.002","25.975","0.005","90","","100.95","0.03","90","","3999.8","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H30 Cl3 N9 O14 Pd2 -","- C35 H28 Cl3 N9 O14 Pd2 -","- C140 H112 Cl12 N36 O56 Pd8 -","4","1","","Coşar, Sultan; Janik, Matthias B. L.; Flock, Matthias; Freisinger, Eva; Farkas, Etelka; Lippert, Bernhard","Mono- and di-nuclear complexes of (trpy)MII (M = Pd, Pt) with the model nucleobase 1-methylcytosine. Crystal structure and NMR solution studies","Journal of the Chemical Society, Dalton Transactions","1999","","14","2329","","10.1039/a902862e","","","0.71069","MoKα","","0.1087","0.0439","","0.1137","0.0954","","","","0.864","1.092","1.092","","","","","has coordinates,has disorder","179980","2020-10-21","18:00:00",""
"7027449","11.061","0.002","9.993","0.002","24.211","0.005","90","","98.7","0.03","90","","2645.3","0.9","126","2","126","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C20 H28 N8 O12 Pt -","- C20 H20 N8 O12 Pt -","- C80 H80 N32 O48 Pt4 -","4","1","","Coşar, Sultan; Janik, Matthias B. L.; Flock, Matthias; Freisinger, Eva; Farkas, Etelka; Lippert, Bernhard","Mono- and di-nuclear complexes of (trpy)MII (M = Pd, Pt) with the model nucleobase 1-methylcytosine. Crystal structure and NMR solution studies","Journal of the Chemical Society, Dalton Transactions","1999","","14","2329","","10.1039/a902862e","","","0.71069","MoKα","","0.0252","0.0238","","0.0592","0.0579","","","","1.042","1.057","1.057","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027450","14.066","0.003","10.988","0.002","25.783","0.005","90","","101.7","0.03","90","","3902.2","1.4","163","2","163","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C35 H30 Cl3 N9 O14 Pt2 -","- C35 H28 Cl3 N9 O14 Pt2 -","- C140 H112 Cl12 N36 O56 Pt8 -","4","1","","Coşar, Sultan; Janik, Matthias B. L.; Flock, Matthias; Freisinger, Eva; Farkas, Etelka; Lippert, Bernhard","Mono- and di-nuclear complexes of (trpy)MII (M = Pd, Pt) with the model nucleobase 1-methylcytosine. Crystal structure and NMR solution studies","Journal of the Chemical Society, Dalton Transactions","1999","","14","2329","","10.1039/a902862e","","","0.71069","MoKα","","0.0978","0.0409","","0.1198","0.0747","","","","0.865","1.062","1.062","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027451","8.529","0.001","9.123","0.001","21.298","0.003","87.46","0.01","86.75","0.01","66.53","0.01","1517.2","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C27 H40 Cl2 Cu N6 O8 -","- C27 H40 Cl2 Cu N6 O8 -","- C54 H80 Cl4 Cu2 N12 O16 -","2","1","","Bernhardt, Paul V.; Flanagan, Bernadine M.; Riley, Mark J.","Metal-centred versus ligand-centred luminescence quenching of a macrocyclic copper(II) complex †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3579","","10.1039/a902881a","","","0.71073","MoKα","","0.1189","0.0568","","0.1807","0.1426","","","","1.022","1.096","1.096","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027452","8.2523","0.0016","10.035","0.0019","16.5","0.005","97.27","0.02","99.19","0.02","108.358","0.016","1257.2","0.5","203","2","203","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H25 N2 O2 P -","- C31 H25 N2 O2 P -","- C62 H50 N4 O4 P2 -","2","1","","Alder, Mark J.; Cross, Wendy I.; Flower, Kevin R.; Pritchard, Robin G.","Azo-containing tertiary phosphines: synthesis, reactivity and structural characterisation","Journal of the Chemical Society, Dalton Transactions","1999","","15","2563","","10.1039/a902885d","","","0.71069","MoKα","","0.1221","0.0581","","","0.1117","0.1417","","","","","","0.925","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027453","8.077","0.001","22.366","0.003","25.317","0.004","90","","90","","90","","4573.5","1.1","293","2","203","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C29 H23 N2 O P -","- C29 H23 N2 O P -","- C232 H184 N16 O8 P8 -","8","1","","Alder, Mark J.; Cross, Wendy I.; Flower, Kevin R.; Pritchard, Robin G.","Azo-containing tertiary phosphines: synthesis, reactivity and structural characterisation","Journal of the Chemical Society, Dalton Transactions","1999","","15","2563","","10.1039/a902885d","","","0.71069","MoKα","","0.2136","0.0686","","","0.1172","0.1665","","","","","","0.911","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027454","8.865","0.002","12.054","0.003","13.935","0.003","107.558","0.017","94.483","0.018","108.463","0.016","1321.6","0.6","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H25 N2 O2 P S -","- C31 H25 N2 O2 P S -","- C62 H50 N4 O4 P2 S2 -","2","1","","Alder, Mark J.; Cross, Wendy I.; Flower, Kevin R.; Pritchard, Robin G.","Azo-containing tertiary phosphines: synthesis, reactivity and structural characterisation","Journal of the Chemical Society, Dalton Transactions","1999","","15","2563","","10.1039/a902885d","","","0.71069","MoKα","","0.0648","0.0412","","","0.0964","0.1077","","","","","","1.016","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027455","11.676","0.006","12.804","0.005","27.34","0.012","102.48","0.04","90.68","0.03","112.34","0.03","3671","3","293","2","293","2","","","","","","","","10","P -1","-P 1","2","6.(BF4)37H2O7CH2Cl2","","","- C77 H64 B3 Cl2 Cu F12 N8 O P2 Ru -","- C77 H64 B3 Cl2 Cu F12 N8 O P2 Ru -","- C154 H128 B6 Cl4 Cu2 F24 N16 O2 P4 Ru2 -","2","1","","Scott, Sonya M.; Gordon, Keith C.; Burrell, Anthony K.","Structure, spectroscopic and electrochemical properties of novel binuclear ruthenium(II) copper(I) complexes with polypyridyl bridging ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","16","2669","","10.1039/a902934f","","","0.71073","MoKα","","0.0662","0.0482","","0.1387","0.1265","","","","1.029","1.076","1.076","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027456","12.905","0.003","13.264","0.003","45.357","0.009","90","","94.51","0.03","90","","7740","3","293","2","293","2","","","","","","","","10","P 1 21/n 1","-P 2yn","14","4.(BF4)37H2O72CH2Cl2","","","- C72 H56 B3 Cl4 Cu F12 N8 O2 P2 Ru -","- C72 H56 B3 Cl4 Cu F12 N8 O2 P2 Ru -","- C288 H224 B12 Cl16 Cu4 F48 N32 O8 P8 Ru4 -","4","1","","Scott, Sonya M.; Gordon, Keith C.; Burrell, Anthony K.","Structure, spectroscopic and electrochemical properties of novel binuclear ruthenium(II) copper(I) complexes with polypyridyl bridging ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","16","2669","","10.1039/a902934f","","","0.71073","MoKα","","0.1808","0.0745","","0.2408","0.1826","","","","1.045","1.216","1.216","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027457","8.5256","0.0005","15.5111","0.0009","10.8567","0.0006","90","","101.176","0.001","90","","1408.48","0.14","293","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C20 H44 Cl2 Cu N4 O10 -","- C20 H44 Cl2 Cu N4 O10 -","- C40 H88 Cl4 Cu2 N8 O20 -","2","1","","Aneetha, Halikhedkar; Lai, Ying-Huang; Lin, Shih-Chi; Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chung, Chung-Sun","Copper(II) complexes of tetraaza macrocycles bearing pendant arms: syntheses, structures and properties","Journal of the Chemical Society, Dalton Transactions","1999","","16","2885","","10.1039/a902955i","","","0.71073","MoKα","","0.0529","0.0496","","","0.1325","0.1369","","","","","","1.054","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027458","22.1089","0.0009","30.5304","0.0012","8.7632","0.0004","90","","90","","90","","5915.1","0.4","293","2","293","2","","","","","","","","6","F d d 2","F 2 -2d","43","","","","- C22 H42 Cl2 Cu N6 O8 -","- C22 H42 Cl2 Cu N6 O8 -","- C176 H336 Cl16 Cu8 N48 O64 -","8","0.5","","Aneetha, Halikhedkar; Lai, Ying-Huang; Lin, Shih-Chi; Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chung, Chung-Sun","Copper(II) complexes of tetraaza macrocycles bearing pendant arms: syntheses, structures and properties","Journal of the Chemical Society, Dalton Transactions","1999","","16","2885","","10.1039/a902955i","","","0.71073","MoKα","","0.0564","0.0487","","","0.1204","0.1278","","","","","","1.031","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027459","9.2539","0.0001","12.7198","0.0001","11.8658","0.0002","90","","103.187","0.001","90","","1359.87","0.03","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H38 Cl2 Cu N6 O8 -","- C20 H38 Cl2 Cu N6 O8 -","- C40 H76 Cl4 Cu2 N12 O16 -","2","0.5","","Aneetha, Halikhedkar; Lai, Ying-Huang; Lin, Shih-Chi; Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chung, Chung-Sun","Copper(II) complexes of tetraaza macrocycles bearing pendant arms: syntheses, structures and properties","Journal of the Chemical Society, Dalton Transactions","1999","","16","2885","","10.1039/a902955i","","","0.71073","MoKα","","0.0415","0.0331","","","0.0829","0.087","","","","","","1.04","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027460","8.833","0.0018","9.8814","0.0012","16.1678","0.0016","90","","81.694","0.017","90","","1396.4","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H40 Cl2 Cu N4 O14 -","- C18 H40 Cl2 Cu N4 O14 -","- C36 H80 Cl4 Cu2 N8 O28 -","2","0.5","","Aneetha, Halikhedkar; Lai, Ying-Huang; Lin, Shih-Chi; Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chung, Chung-Sun","Copper(II) complexes of tetraaza macrocycles bearing pendant arms: syntheses, structures and properties","Journal of the Chemical Society, Dalton Transactions","1999","","16","2885","","10.1039/a902955i","","","0.71073","MoKα","","0.0719","0.0515","","","0.1401","0.1545","","","","","","1.075","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027461","30.899","0.006","12.156","0.002","17.311","0.004","90","","90","","90","","6502","2","150","2","150","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C28 H42 N2 O4 Pt Se Sn -","- C28 H42 N2 O4 Pt Se Sn -","- C224 H336 N16 O32 Pt8 Se8 Sn8 -","8","2","","Janzen, Michael C.; Jenkins, Hilary A.; Jennings, Michael C.; Rendina, Louis M.; Puddephatt, Richard J.","Easy ring expansion and contraction in Pt‒Sn bonded metallacycles","Journal of the Chemical Society, Dalton Transactions","1999","","11","1713","","10.1039/a902991e","","","0.71073","MoKα","","0.0366","0.0293","","0.0651","0.063","","","","1.045","1.075","1.075","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027462","10.2375","0.0006","16.035","0.001","18.8895","0.0012","90","","102.624","0.003","90","","3025.9","0.3","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H40 N2 O6 Pt -","- C30 H40 N2 O6 Pt -","- C120 H160 N8 O24 Pt4 -","4","1","","Janzen, Michael C.; Jenkins, Hilary A.; Jennings, Michael C.; Rendina, Louis M.; Puddephatt, Richard J.","Easy ring expansion and contraction in Pt‒Sn bonded metallacycles","Journal of the Chemical Society, Dalton Transactions","1999","","11","1713","","10.1039/a902991e","","","0.71073","MoKα","","0.0468","0.039","","","0.0959","0.1003","","","","","","1.125","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027463","10.811","0.0003","12.5192","0.0002","15.0604","0.0003","78.895","0.001","70.862","0.001","86.721","0.001","1889.6","0.07","294","2","294","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H48 N2 O4 Pt Se2 Sn2 -","- C30 H48 N2 O4 Pt Se2 Sn2 -","- C60 H96 N4 O8 Pt2 Se4 Sn4 -","2","1","","Janzen, Michael C.; Jenkins, Hilary A.; Jennings, Michael C.; Rendina, Louis M.; Puddephatt, Richard J.","Easy ring expansion and contraction in Pt‒Sn bonded metallacycles","Journal of the Chemical Society, Dalton Transactions","1999","","11","1713","","10.1039/a902991e","","","0.71073","MoKα","","0.0341","0.0267","","0.069","0.0621","","","","0.972","0.949","0.949","","","","","has coordinates,has disorder","179980","2020-10-21","18:00:00",""
"7027464","9.684","0.0014","9.684","0.0014","29.523","0.006","90","","90","","120","","2397.7","0.7","296","2","296","2","","","","","","","","5","R 3 c :H","R 3 -2""c","161","","Tris(3-hydroxy-2(1H)-pyridonate)aluminium(III)","","- C15 H9 Al N3 O6 -","- C15 H9 Al N3 O6 -","- C90 H54 Al6 N18 O36 -","6","0.333333","","Di Marco, Valerio B.; Bombi, G. Giorgio; Tapparo, Andrea; Powell, Annie K.; Anson, Christopher E.","Complexation of aluminium(III) with 3-hydroxy-2(1H )-pyridinone. Solution state study and crystal structure of tris(3-hydroxy-2(1H )-pyridinonato)aluminium(III)","Journal of the Chemical Society, Dalton Transactions","1999","","15","2427","","10.1039/a902997d","","","0.71073","MoKα","","0.0468","0.0413","","0.1211","0.116","","","","1.149","1.162","1.162","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027465","10.4784","0.0006","10.5404","0.0006","12.5099","0.0008","81.626","0.001","88.656","0.001","67.23","0.001","1259.59","0.13","145","2","145","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H25 Fe2 I -","- C34 H25 Fe2 I -","- C68 H50 Fe4 I2 -","2","1","","McAdam, C. John; Brunton, Jason J.; Robinson, Brian H.; Simpson, Jim","Ferrocenylethynylnaphthalenes and acenaphthylenes; communication between ferrocenyl and cluster redox centres","Journal of the Chemical Society, Dalton Transactions","1999","","15","2487","","10.1039/a903003d","","","0.71073","MoKα","","0.0663","0.0559","","","0.1481","0.155","","","","","","0.992","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027466","13.515","0.005","13.242","0.006","30.181","0.007","90","","90","","90","","5401","3","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C46 H52 Co4 O20 P4 -","- C46 H52 Co4 O20 P4 -","- C184 H208 Co16 O80 P16 -","4","0.5","","McAdam, C. John; Brunton, Jason J.; Robinson, Brian H.; Simpson, Jim","Ferrocenylethynylnaphthalenes and acenaphthylenes; communication between ferrocenyl and cluster redox centres","Journal of the Chemical Society, Dalton Transactions","1999","","15","2487","","10.1039/a903003d","","","0.71073","MoKα","","0.2202","0.0685","","","0.12","0.1538","","","","","","0.851","","","","has coordinates,has disorder","179980","2020-10-21","18:00:00",""
"7027467","10.251","0.003","10.251","","7.283","0.002","90","","90","","90","","765.3","0.3","293","2","294","2","","","","","","","","4","P 42 n m","P 4n -2n","102","","","","- C12 H24 O5 Os -","- C12 O5 Os -","- C24 O10 Os2 -","2","0.25","","Lehtonen, Ari; Jokela, Jukka; Edwards, Peter G.; Sillanpää, Reijo","Preparation and crystal structures of oxoosmium(VI) diolato complexes","Journal of the Chemical Society, Dalton Transactions","1999","","16","2785","","10.1039/a903042e","","","0.71069","MoKα","","0.0521","0.0244","","","0.0548","0.061","","","","","","1.097","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027468","15.055","0.005","15.899","0.008","12.677","0.005","107.08","0.04","96.18","0.03","112.9","0.03","2586","2","294","2","294","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H77 O8 Os P -","- C54 H77 O8 Os P -","- C108 H154 O16 Os2 P2 -","2","1","","Lehtonen, Ari; Jokela, Jukka; Edwards, Peter G.; Sillanpää, Reijo","Preparation and crystal structures of oxoosmium(VI) diolato complexes","Journal of the Chemical Society, Dalton Transactions","1999","","16","2785","","10.1039/a903042e","","","0.71069","MoKα","","0.0656","0.0357","","","0.0697","0.0768","","","","","","1.015","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7027469","16.421","0.008","17.103","0.005","12.299","0.005","107.61","0.03","96.28","0.04","67.01","0.03","3031","2","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H40 O5 Os -","- C24 H31.2 O5 Os -","- C120 H156 O25 Os5 -","5","2.5","","Lehtonen, Ari; Jokela, Jukka; Edwards, Peter G.; Sillanpää, Reijo","Preparation and crystal structures of oxoosmium(VI) diolato complexes","Journal of the Chemical Society, Dalton Transactions","1999","","16","2785","2788","10.1039/a903042e","","","0.71069","MoKα","","0.0938","0.0433","","","0.0882","0.0996","","","","","","1.039","","","","has coordinates","134365","2020-10-21","18:00:00",""
"7027470","6.9403","0.0009","8.3128","0.0014","10.554","0.004","69.042","0.013","87.146","0.011","87.88","0.008","567.8","0.3","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","4,5-Bis(methylthio)-1,3-dithiole-2-thione dibromine","","- C5 H6 Br2 S5 -","- C5 H6 Br2 S5 -","- C10 H12 Br4 S10 -","2","1","","Bricklebank, Neil; Skabara, Peter J.; Hibbs, David E.; Hursthouse, Michael B.; Abdul Malik, K. M.","Reaction of thiones with dihalogens; comparison of the solid state structures of 4,5-bis(methylsulfanyl)-1,3-dithiole-2-thione‒diiodine, ‒dibromine and ‒iodine monobromide","Journal of the Chemical Society, Dalton Transactions","1999","","17","3007","","10.1039/a903068i","","","0.71069","MoKα","","0.059","0.0492","","0.1346","0.1325","","","","0.975","1.125","1.125","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027471","9.037","0.003","9.606","0.002","13.906","0.005","90","","98.57","0.02","90","","1193.7","0.6","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,4-bis(methylthio)-1,3-dithiole-2-thione-diiodine","","- C5 H6 I2 S5 -","- C5 H6 I2 S5 -","- C20 H24 I8 S20 -","4","1","","Bricklebank, Neil; Skabara, Peter J.; Hibbs, David E.; Hursthouse, Michael B.; Abdul Malik, K. M.","Reaction of thiones with dihalogens; comparison of the solid state structures of 4,5-bis(methylsulfanyl)-1,3-dithiole-2-thione–diiodine, –dibromine and –iodine monobromide","Journal of the Chemical Society, Dalton Transactions","1999","","17","3007","","10.1039/a903068i","","","0.71069","MoKα","","0.0675","0.0514","","0.1258","0.1187","","","","1.038","1.129","1.129","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027472","7.5933","0.0012","8.601","0.002","10.8848","0.0014","110.71","0.008","91.227","0.009","111.989","0.013","606.8","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","4,5,-bis(methylthio)-1,3-dithiole-2-thione iodine monobromide","","- C5 H6 Br I S5 -","- C5 H6 Br I S5 -","- C10 H12 Br2 I2 S10 -","2","1","","Bricklebank, Neil; Skabara, Peter J.; Hibbs, David E.; Hursthouse, Michael B.; Abdul Malik, K. M.","Reaction of thiones with dihalogens; comparison of the solid state structures of 4,5-bis(methylsulfanyl)-1,3-dithiole-2-thione–diiodine, –dibromine and –iodine monobromide","Journal of the Chemical Society, Dalton Transactions","1999","","17","3007","","10.1039/a903068i","","","0.71069","MoKα","","0.0418","0.0382","","0.1042","0.1031","","","","1.071","1.137","1.137","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027473","6.4872","0.0006","7.0403","0.0009","17.166","0.004","84.06","0.01","80.958","0.009","69.198","0.009","722.8","0.2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","2-Bromo-4,5-bis(methylthio)-1,3-dithiolium tribromide, Bromine (2:1)","","- C5 H6 Br5 S4 -","- C5 H6 Br5 S4 -","- C10 H12 Br10 S8 -","2","1","","Bricklebank, Neil; Skabara, Peter J.; Hibbs, David E.; Hursthouse, Michael B.; Abdul Malik, K. M.","Reaction of thiones with dihalogens; comparison of the solid state structures of 4,5-bis(methylsulfanyl)-1,3-dithiole-2-thione–diiodine, –dibromine and –iodine monobromide","Journal of the Chemical Society, Dalton Transactions","1999","","17","3007","","10.1039/a903068i","","","0.71069","MoKα","","0.0534","0.045","","0.1136","0.1116","","","","1.021","1.131","1.131","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027474","14.404","0.004","15.06","0.005","8.629","0.003","105.45","0.03","105","0.02","74.02","0.03","1699.4","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H33 N19 O15 Pt2 -","- C17 H33 N19 O15 Pt2 -","- C34 H66 N38 O30 Pt4 -","2","1","","Komeda, Seiji; Ohishi, Hirofumi; Yamane, Hirotoshi; Harikawa, Michinori; Sakaguchi, Ken-ichi; Chikuma, Masahiko","An NMR study and crystal structure of [{cis-Pt(NH3)2(9EtG-κN7)}2(μ-pz)][NO3]3 (9EtG = 9-ethylguanine) as a model compound for the 1,2-intrastrand GG crosslink †","Journal of the Chemical Society, Dalton Transactions","1999","","17","2959","","10.1039/a903081f","","","0.71069","MoK'a","","0.1177","0.0949","","0.5629","0.3078","","","","1.742","1.808","1.808","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027475","11.1378","0.0002","16.8068","0.0005","18.0549","0.0005","108.218","0.001","102.675","0.0015","106.052","0.0016","2906.8","0.14","193","","193","","","","","","","","see text","6","P -1","-P 1","2","","","","- C56 H72 N3 O4 Si Y -","- C56 H72 N3 O4 Si Y -","- C112 H144 N6 O8 Si2 Y2 -","2","1","","Anwander, Reiner; Görlitzer, Hans W.; Gerstberger, Gisela; Palm, Clemens; Runte, Oliver; Spiegler, Michael","Grafting of bulky rare earth metal complexes onto mesoporous silica MCM-41 †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3611","","10.1039/a903096d","","","0.71073","MoKα","","0.0608","0.0522","","","0.1369","0.1433","","","","","","1.018","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027476","15.296","0.004","17.578","0.005","14.224","0.003","99.57","0.02","113","0.02","80.14","0.02","3447.6","1.6","193.15","","193.15","","","","","","","","","7","P -1","-P 1","2","","","","- C60 H72 Cl2 Co2 Mn2 N14 O18 -","- C60 H72 Cl2 Co2 Mn2 N14 O18 -","- C120 H144 Cl4 Co4 Mn4 N28 O36 -","2","1","","Furutachi, Hideki; Fujinami, Shuhei; Suzuki, Masatatsu; Ōkawa, Hisashi","Oxygenation of heterodinuclear di(μ-phenoxo) CoIIMII (M = Mn, Fe or Co) complexes having a “Co(salen)” entity in a macrocyclic framework †","Journal of the Chemical Society, Dalton Transactions","1999","","13","2197","","10.1039/a903099i","","","0.7107","MoKa","","","0.0506","","","0.0662","","","","","1.184","1.184","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027477","14.833","0.002","17.962","0.002","13.82","0.002","98.656","0.009","110.54","0.008","82.378","0.009","3396","0.8","193.15","","193.15","","","","","","","","","6","P -1","-P 1","2","","","","- C60 H72 Cl2 Co4 N14 O18 -","- C60 H72 Cl2 Co4 N14 O18 -","- C120 H144 Cl4 Co8 N28 O36 -","2","1","","Furutachi, Hideki; Fujinami, Shuhei; Suzuki, Masatatsu; Ōkawa, Hisashi","Oxygenation of heterodinuclear di(μ-phenoxo) CoIIMII (M = Mn, Fe or Co) complexes having a “Co(salen)” entity in a macrocyclic framework †","Journal of the Chemical Society, Dalton Transactions","1999","","13","2197","","10.1039/a903099i","","","0.7107","MoKa","","","0.0585","","","0.0828","","","","","1.489","1.489","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027478","11.433","0.002","17.78","0.002","9.467","0.001","95.94","0.01","97.71","0.01","102.34","0.01","1845.5","0.4","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H18 Cl2 O14 Ru6 -","- C32 H16 Cl2 O14 Ru6 -","- C64 H32 Cl4 O28 Ru12 -","2","1","","Schooler, Paul; Johnson, Brian F. G.; Scaccianoce, Laura; Tregonning, Rosemary","Synthesis and characterisation of [Ru6C(CO)14] cluster complexes of some [2.2]- and [2.2.2]-cyclophane ligands","Journal of the Chemical Society, Dalton Transactions","1999","","16","2743","","10.1039/a903103k","","","0.71069","MoKα","","0.0994","0.0502","","0.1979","0.1229","","","","1.051","1.077","1.077","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027479","29.386","0.013","15.601","0.006","18.629","0.008","90","","103.82","0.03","90","","8293","6","291","2","291","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C39 H24 O14 Ru6 -","- C39 H24 O14 Ru6 -","- C312 H192 O112 Ru48 -","8","1","","Schooler, Paul; Johnson, Brian F. G.; Scaccianoce, Laura; Tregonning, Rosemary","Synthesis and characterisation of [Ru6C(CO)14] cluster complexes of some [2.2]- and [2.2.2]-cyclophane ligands","Journal of the Chemical Society, Dalton Transactions","1999","","16","2743","","10.1039/a903103k","","","0.71073","MoKα","","0.1388","0.0951","","","0.255","0.3092","","","","","","1.122","","","","has coordinates,has disorder","179980","2020-10-21","18:00:00",""
"7027480","20.414","0.003","17.153","0.004","14.177","0.002","90","","129.8","0.01","90","","3813.9","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H24 N10 O12 Zn2 -","- C36 H24 N10 O12 Zn2 -","- C144 H96 N40 O48 Zn8 -","4","0.5","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.","Self-assembly of novel co-ordination polymers containing polycatenated molecular ladders and intertwined two-dimensional tilings","Journal of the Chemical Society, Dalton Transactions","1999","","11","1799","","10.1039/a903107c","","","0.71073","MoKα","","","0.0572","","","0.1043","","","","","1.119","1.119","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027481","20.383","0.002","17.247","0.002","14.203","0.001","90","","129.85","0.02","90","","3833.3","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H24 Co2 N10 O12 -","- C36 H24 Co2 N10 O12 -","- C144 H96 Co8 N40 O48 -","4","0.5","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.","Self-assembly of novel co-ordination polymers containing polycatenated molecular ladders and intertwined two-dimensional tilings","Journal of the Chemical Society, Dalton Transactions","1999","","11","1799","","10.1039/a903107c","","","0.71073","MoKα","","","0.0381","","","0.0972","","","","","1.059","1.059","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027482","20.682","0.009","11.244","0.003","20.821","0.009","90","","112.8","0.04","90","","4464","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C37 H26 Cd2 Cl2 N10 O12 -","- C37 H26 Cd2 Cl2 N10 O12 -","- C148 H104 Cd8 Cl8 N40 O48 -","4","0.5","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.","Self-assembly of novel co-ordination polymers containing polycatenated molecular ladders and intertwined two-dimensional tilings","Journal of the Chemical Society, Dalton Transactions","1999","","11","1799","","10.1039/a903107c","","","0.71073","MoKα","","","0.072","","","0.178","","","","","1.078","1.078","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027483","21.044","0.003","10.811","0.002","20.849","0.003","90","","117.31","0.01","90","","4214.6","1.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Cd2 N16 O12 -","- C30 H24 Cd2 N16 O12 -","- C120 H96 Cd8 N64 O48 -","4","0.5","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.","Self-assembly of novel co-ordination polymers containing polycatenated molecular ladders and intertwined two-dimensional tilings","Journal of the Chemical Society, Dalton Transactions","1999","","11","1799","","10.1039/a903107c","","","0.71073","MoKα","","","0.0636","","","0.1795","","","","","1.104","1.104","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027484","15.276","0.001","28.313","0.002","13.846","0.001","90","","109.43","0.01","90","","5647.5","0.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C54 H50 Cl N4 O3 Y -","- C54 H50 Cl N4 O3 Y -","- C216 H200 Cl4 N16 O12 Y4 -","4","1","","Wong, Wai-Kwok; Zhang, Lilu; Xue, Feng; Mak, Thomas C. W.","Synthesis, characterization and crystal structures of neutral mono- and di-nuclear lanthanide(III) porphyrinate complexes","Journal of the Chemical Society, Dalton Transactions","1999","","17","3053","","10.1039/a903127h","","","0.71073","MoKα","","0.1177","0.0833","","","0.2098","0.2297","","","","","","1.13","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027485","13.607","0.002","14.732","0.002","14.933","0.002","63.95","0.02","87.14","0.02","71.12","0.02","2529.6","0.9","293","2","293","2","","","","","","","","6","P 1","P 1","1","","","","- C100 H87 Cl2 N8 O6.5 Y2 -","- C100 H80 Cl2 N8 O7 Y2 -","- C100 H80 Cl2 N8 O7 Y2 -","1","1","","Wong, Wai-Kwok; Zhang, Lilu; Xue, Feng; Mak, Thomas C. W.","Synthesis, characterization and crystal structures of neutral mono- and di-nuclear lanthanide(III) porphyrinate complexes","Journal of the Chemical Society, Dalton Transactions","1999","","17","3053","","10.1039/a903127h","","","0.71073","MoKα","","0.1361","0.0779","","","0.1027","0.1863","","","","","","1.33","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027486","15.807","0.002","18.212","0.002","18.864","0.002","70.26","0.02","72.93","0.02","68.06","0.02","4653.3","1.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C106.5 H88 N8 O11 Yb2 -","- C102.5 H72 N8 O11 Yb2 -","- C205 H144 N16 O22 Yb4 -","2","1","","Wong, Wai-Kwok; Zhang, Lilu; Xue, Feng; Mak, Thomas C. W.","Synthesis, characterization and crystal structures of neutral mono- and di-nuclear lanthanide(III) porphyrinate complexes","Journal of the Chemical Society, Dalton Transactions","1999","","17","3053","","10.1039/a903127h","","","0.71073","MoKα","","0.0899","0.0683","","","0.0893","0.1037","","","","","","1.8","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027487","16.758","0.001","27.758","0.001","20.303","0.001","90","","108.09","0.01","90","","8977.5","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C100 H82.5 N8 O3.25 Yb2 -","- C100 H82.5 N8 O3.25 Yb2 -","- C400 H330 N32 O13 Yb8 -","4","1","","Wong, Wai-Kwok; Zhang, Lilu; Xue, Feng; Mak, Thomas C. W.","Synthesis, characterization and crystal structures of neutral mono- and di-nuclear lanthanide(III) porphyrinate complexes","Journal of the Chemical Society, Dalton Transactions","1999","","17","3053","","10.1039/a903127h","","","0.71073","MoKα","","0.0999","0.0888","","","0.1809","0.1872","","","","","","1.235","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027488","13.68","0.001","14.74","0.002","14.969","0.001","64.59","0.01","87.25","0.01","70.34","0.01","2550.9","0.5","294","2","294","2","","","","","","","","6","P -1","-P 1","2","","","","- C54.5 H52 Cl N4 O4 Yb -","- C54.5 H48.5 Cl N4 O4 Yb -","- C109 H97 Cl2 N8 O8 Yb2 -","2","1","","Wong, Wai-Kwok; Zhang, Lilu; Xue, Feng; Mak, Thomas C. W.","Synthesis, characterization and crystal structures of neutral mono- and di-nuclear lanthanide(III) porphyrinate complexes","Journal of the Chemical Society, Dalton Transactions","1999","","17","3053","","10.1039/a903127h","","","0.71073","MoKα","","0.0576","0.0555","","","0.1539","0.1568","","","","","","1.011","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027489","14.916","0.007","7.458","0.004","23.687","0.012","90","","97.89","","90","","2610","2","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H12 Cl Cu N3 O7 -","- C8 H12 Cl Cu N3 O7 -","- C64 H96 Cl8 Cu8 N24 O56 -","8","1","","Long, La-Sheng; Yang, Shi-Ping; Tong, Ye-Xiang; Mao, Zong-Wan; Chen, Xiao-Ming; Ji, Liang-Nian","Synthesis, crystal structures and properties of copper(II) complexes of Schiff base derivatives containing imidazole and β-alanine groups","Journal of the Chemical Society, Dalton Transactions","1999","","12","1999","","10.1039/a903154e","","","0.71073","MoKα","","0.1723","0.0728","","","0.1618","0.2056","","","","","","1.026","","","","has coordinates,has disorder","179980","2020-10-21","18:00:00",""
"7027490","12.793","0.01","13.167","0.008","7.731","0.003","90","","90","","90","","1302.3","1.4","293","2","293","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C8 H12 Cl Cu N3 O7 -","- C8 H12 Cl Cu N3 O7 -","- C32 H48 Cl4 Cu4 N12 O28 -","4","1","","Long, La-Sheng; Yang, Shi-Ping; Tong, Ye-Xiang; Mao, Zong-Wan; Chen, Xiao-Ming; Ji, Liang-Nian","Synthesis, crystal structures and properties of copper(II) complexes of Schiff base derivatives containing imidazole and β-alanine groups","Journal of the Chemical Society, Dalton Transactions","1999","","12","1999","","10.1039/a903154e","","","0.71073","MoKα","","0.0947","0.0618","","","0.1601","0.1858","","","","","","1.086","","","","has coordinates,has disorder","179980","2020-10-21","18:00:00",""
"7027491","10.314","0.012","8.167","0.004","19.468","0.016","90","","102.09","","90","","1604","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H17 Cl Cu N4 O6 -","- C13 H17 Cl Cu N4 O6 -","- C52 H68 Cl4 Cu4 N16 O24 -","4","1","","Long, La-Sheng; Yang, Shi-Ping; Tong, Ye-Xiang; Mao, Zong-Wan; Chen, Xiao-Ming; Ji, Liang-Nian","Synthesis, crystal structures and properties of copper(II) complexes of Schiff base derivatives containing imidazole and β-alanine groups","Journal of the Chemical Society, Dalton Transactions","1999","","12","1999","","10.1039/a903154e","","","0.71073","MoKα","","0.0982","0.0566","","","0.1311","0.1508","","","","","","1.028","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027492","8.24","0.003","18.185","0.005","23.445","0.006","90","","90.96","0.03","90","","3512.6","1.8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H40 Cl2 Cu2 N10 O14 -","- C26 H40 Cl2 Cu2 N10 O14 -","- C104 H160 Cl8 Cu8 N40 O56 -","4","1","","Long, La-Sheng; Yang, Shi-Ping; Tong, Ye-Xiang; Mao, Zong-Wan; Chen, Xiao-Ming; Ji, Liang-Nian","Synthesis, crystal structures and properties of copper(II) complexes of Schiff base derivatives containing imidazole and β-alanine groups","Journal of the Chemical Society, Dalton Transactions","1999","","12","1999","","10.1039/a903154e","","","0.71073","MoKα","","0.1086","0.0559","","","0.1151","0.1367","","","","","","1.017","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027493","10.891","0.002","10.959","0.002","21.645","0.004","88.93","0.03","89.58","0.03","82.31","0.03","2559.7","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","Compound 1","","- C28 H54 Cs Cu5 I6 N2 O12 -","- C28 H54 Cs Cu5 I6 N2 O12 -","- C56 H108 Cs2 Cu10 I12 N4 O24 -","2","1","","Domasevitch, Konstantin V.; Rusanova, Julia A.; Vassilyeva, Olga Yu.; Kokozay, Vladimir N.; Squattrito, Philip J.; Sieler, Joachim; Raithby, Paul R.","Extended multidecker sandwich architecture of Cs±-18-crown-6 complexes stabilized in the environment of novel large iodocuprate(I) clusters obtained from zerovalent copper","Journal of the Chemical Society, Dalton Transactions","1999","","17","3087","","10.1039/a903225h","","","0.71073","MoKα","","0.0788","0.0373","","0.1372","0.1022","","","","0.915","0.974","0.974","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027494","10.501","0.005","13.849","0.007","14.153","0.007","64.28","0.03","89.16","0.03","80.49","0.03","1825.1","1.6","180","2","180","2","","","","","","","","7","P -1","-P 1","2","","Compound 2","","- C20 H37 Cs Cu4 I5 N O9 -","- C20 H37 Cs Cu4 I5 N O9 -","- C40 H74 Cs2 Cu8 I10 N2 O18 -","2","1","","Domasevitch, Konstantin V.; Rusanova, Julia A.; Vassilyeva, Olga Yu.; Kokozay, Vladimir N.; Squattrito, Philip J.; Sieler, Joachim; Raithby, Paul R.","Extended multidecker sandwich architecture of Cs±-18-crown-6 complexes stabilized in the environment of novel large iodocuprate(I) clusters obtained from zerovalent copper","Journal of the Chemical Society, Dalton Transactions","1999","","17","3087","","10.1039/a903225h","","","0.71073","MoKα","","0.0359","0.0296","","0.0772","0.0743","","","","1.092","1.126","1.126","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027495","28.2558","0.0001","28.2558","0.0001","28.2558","0.0001","90","","90","","90","","22559.2","0.14","293","2","293","2","","","","","","","","6","P a -3","-P 2ac 2ab 3","205","","Compound 3","","- C108 H216 Cs9 Cu24 I33 O54 -","- C108 H216 Cs9 Cu24 I32.98 O54 -","- C432 H864 Cs36 Cu96 I131.92 O216 -","4","0.166667","","Domasevitch, Konstantin V.; Rusanova, Julia A.; Vassilyeva, Olga Yu.; Kokozay, Vladimir N.; Squattrito, Philip J.; Sieler, Joachim; Raithby, Paul R.","Extended multidecker sandwich architecture of Cs±-18-crown-6 complexes stabilized in the environment of novel large iodocuprate(I) clusters obtained from zerovalent copper","Journal of the Chemical Society, Dalton Transactions","1999","","17","3087","","10.1039/a903225h","","","0.71073","MoKα","","0.1196","0.096","","0.2469","0.1974","","","","1.148","1.21","1.21","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027496","15.487","0.002","10.811","0.004","18.249","0.003","90","","91.54","0.01","90","","3054.3","1.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[{C6H4CH2NMe2}Pd{OC(Ph)NH}2Pd{C6H4CH2NMe2}]","","","- C32 H36 N4 O2 Pd2 -","- C32 H36 N4 O2 Pd2 -","- C128 H144 N16 O8 Pd8 -","4","1","","Ruiz, José; Cutillas, Natalia; Rodríguez, Venancio; Sampedro, José; López, Gregorio; Chaloner, Penny A.; Hitchcock, Peter B.","Reactivity of hydroxo complexes of palladium(II) towards nitriles: formation of carboxamide and imino ether derivatives of palladium(II)","Journal of the Chemical Society, Dalton Transactions","1999","","17","2939","","10.1039/a903262b","","","0.71073","MoKα","","0.0699","0.0404","","0.1034","0.0882","","","","0.999","1.028","1.028","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027497","9.243","0.003","14.634","0.006","15.865","0.003","90","","94.71","0.02","90","","2138.7","1.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[Pd(C6F5)2{NC(Me)OMe}2]","","","- C18 H12 F10 N2 O2 Pd -","- C18 H12 F10 N2 O2 Pd -","- C72 H48 F40 N8 O8 Pd4 -","4","1","","Ruiz, José; Cutillas, Natalia; Rodríguez, Venancio; Sampedro, José; López, Gregorio; Chaloner, Penny A.; Hitchcock, Peter B.","Reactivity of hydroxo complexes of palladium(II) towards nitriles: formation of carboxamide and imino ether derivatives of palladium(II)","Journal of the Chemical Society, Dalton Transactions","1999","","17","2939","","10.1039/a903262b","","","0.71073","MoKα","","0.089","0.047","","0.1212","0.101","","","","1.019","1.092","1.092","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027498","19.969","0.002","20.071","0.002","30.876","0.003","82.306","0.005","79.979","0.004","87.709","0.005","12075","2","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C244 H268 Cl3 N15 O36 U6 -","- C244 H243 Cl3 N15 O36 U6 -","- C488 H486 Cl6 N30 O72 U12 -","2","1","","Thuéry, Pierre; Nierlich, Martine; Souley, Bahari; Asfari, Zouhair; Vicens, Jacques","Complexation of a hexameric uranium(VI) cluster by p-benzylcalix[7]arene","Journal of the Chemical Society, Dalton Transactions","1999","","15","2589","2594","10.1039/a903289d","","","0.71073","MoKα","","0.1926","0.0914","","0.2949","0.2058","","","","1.065","1.13","1.13","","","","","has coordinates","179980","2020-10-21","18:00:00",""
"7027499","12.996","0.002","11.174","0.001","7.679","0.001","90","","96.29","0.01","90","","1108.4","0.2","158","2","158","2","","","","","","","","5","C 1 c 1","C -2yc","9","","tris(dimethylamino)phosphane-borane","","- C6 H21 B N3 P -","- C6 H21 B N3 P -","- C24 H84 B4 N12 P4 -","4","1","","Mitzel, Norbert W.; Lustig, Christian","The molecular and crystal structures of the tris(dimethylamino)phosphoranes (Me2N)3P–X (X = BH3, CH2, NH or O)","Journal of the Chemical Society, Dalton Transactions","1999","","18","3177","","10.1039/a903292d","","","0.71073","MoKα","","0.0219","0.0207","","0.0556","0.0543","","","","1.083","1.088","1.088","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027500","8.219","0.0009","10.0901","0.0003","12.1644","0.0014","90","","97.512","0.006","90","","1000.14","0.16","163","2","163","2","","","","","","","Fluka","4","P 1 21/n 1","-P 2yn","14","","Tris(dimethylamino)iminophosphorane","","- C6 H19 N4 P -","- C6 H19 N4 P -","- C24 H76 N16 P4 -","4","1","","Mitzel, Norbert W.; Lustig, Christian","The molecular and crystal structures of the tris(dimethylamino)phosphoranes (Me2N)3P–X (X = BH3, CH2, NH or O)","Journal of the Chemical Society, Dalton Transactions","1999","","18","3177","","10.1039/a903292d","","","0.71073","MoKα","","0.0399","0.036","","0.1054","0.1006","","","","1.075","1.084","1.084","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027501","6.398","0.001","12.57","0.003","6.428","0.001","90","","104.19","0.03","90","","501.18","0.18","163","2","163","2","","","","","","","Aldrich Chemicals","5","P 1 21/m 1","-P 2yb","11","HMPA","Tris(dimethylamino)oxophosphorane","","- C6 H18 N3 O P -","- C6 H18 N3 O P -","- C12 H36 N6 O2 P2 -","2","0.5","","Mitzel, Norbert W.; Lustig, Christian","The molecular and crystal structures of the tris(dimethylamino)phosphoranes (Me2N)3P–X (X = BH3, CH2, NH or O)","Journal of the Chemical Society, Dalton Transactions","1999","","18","3177","","10.1039/a903292d","","","0.71073","MoKα","","0.0592","0.0427","","0.1162","0.1063","","","","1.045","1.075","1.075","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027502","5.904","0.002","11.593","0.003","9.038","0.004","90","","90","","90","","618.6","0.4","295","2","295","2","","","","","","","","5","P n m a","-P 2ac 2n","62","[Cu(pyrazine)(NCO)]n","","","- C5 H4 Cu N3 O -","- C5 H4 Cu N3 O -","- C20 H16 Cu4 N12 O4 -","4","0.5","","Goher, Mohamed A. S.; Mautner, Franz A.","The first copper(I) complex containing a cyanato ligand. Synthesis and structural characterization of [Cu(pyz)(μ-NCO)]n (pyz = pyrazine)","Journal of the Chemical Society, Dalton Transactions","1999","","12","1923","","10.1039/a903332g","","","0.71069","MoKα","","0.0307","0.0261","","0.0655","0.0617","","","","1.095","1.087","1.087","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027503","18.8743","0.0012","10.7534","0.0005","19.5999","0.0006","90","","97.967","0.004","90","","3939.7","0.3","293","2","293","2","","","","","","","","7","I 1 a 1","I -2ya","9","","","","- C36 H30 F6 Mo N6 O6 S2 -","- C36 H30 F6 Mo N6 O6 S2 -","- C144 H120 F24 Mo4 N24 O24 S8 -","4","1","","Dilworth, Jonathan R.; Gibson, Vernon C.; Davies, Nicola; Redshaw, Carl; White, Andrew P.; Williams, David J.","Bis(isodiazene) and related complexes of molybdenum(VI). Syntheses and structures of [Mo(OTf )2(NNPh2)2(py)2], [MoCl(OTf )(NNPh2){NC5H3(CH2C(O)Ph2)2-2,6}], [{MoCl(NNPh2)2(μ-Cl)(NH2But)}2] and [MoTp′Cl(NNPh2)2] [OTf = O3SCF3, Tp′ = tris(3,5-dimethylpyrazolyl)hydroborate]","Journal of the Chemical Society, Dalton Transactions","1999","","16","2695","","10.1039/a903372f","","","1.54178","CuKα","","0.0521","0.0456","","0.1179","0.1128","","","","1.03","1.041","1.041","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027504","12.9","0.002","14.588","0.003","14.795","0.003","119.41","0.02","91.321","0.014","95.5","0.02","2406.3","0.9","223","2","223","2","","","","","","","","8","P -1","-P 1","2","","","","- C47.5 H40 Cl4 F3 Mo N3 O5 S -","- C47.5 H40 Cl4 F3 Mo N3 O5 S -","- C95 H80 Cl8 F6 Mo2 N6 O10 S2 -","2","1","","Dilworth, Jonathan R.; Gibson, Vernon C.; Davies, Nicola; Redshaw, Carl; White, Andrew P.; Williams, David J.","Bis(isodiazene) and related complexes of molybdenum(VI). Syntheses and structures of [Mo(OTf )2(NNPh2)2(py)2], [MoCl(OTf )(NNPh2){NC5H3(CH2C(O)Ph2)2-2,6}], [{MoCl(NNPh2)2(μ-Cl)(NH2But)}2] and [MoTp′Cl(NNPh2)2] [OTf = O3SCF3, Tp′ = tris(3,5-dimethylpyrazolyl)hydroborate]","Journal of the Chemical Society, Dalton Transactions","1999","","16","2695","","10.1039/a903372f","","","0.71073","MoKα","","0.0938","0.0628","","0.1705","0.1494","","","","1.056","1.094","1.094","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027505","10.6091","0.0006","18.777","0.002","14.6059","0.0009","90","","106.569","0.005","90","","2788.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C56 H62 Cl4 Mo2 N10 -","- C56 H62 Cl4 Mo2 N10 -","- C112 H124 Cl8 Mo4 N20 -","2","0.5","","Dilworth, Jonathan R.; Gibson, Vernon C.; Davies, Nicola; Redshaw, Carl; White, Andrew P.; Williams, David J.","Bis(isodiazene) and related complexes of molybdenum(VI). Syntheses and structures of [Mo(OTf )2(NNPh2)2(py)2], [MoCl(OTf )(NNPh2){NC5H3(CH2C(O)Ph2)2-2,6}], [{MoCl(NNPh2)2(μ-Cl)(NH2But)}2] and [MoTp′Cl(NNPh2)2] [OTf = O3SCF3, Tp′ = tris(3,5-dimethylpyrazolyl)hydroborate]","Journal of the Chemical Society, Dalton Transactions","1999","","16","2695","","10.1039/a903372f","","","1.54178","CuKα","","0.0936","0.0588","","0.5182","0.133","","","","1.025","1.08","1.08","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027506","15.56","0.01","13.67","0.01","18.86","0.01","90","","105.09","0.03","90","","3873","4","291","","291","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C39 H42 B Cl Mo N10 -","- C39 H42 B Cl Mo N10 -","- C156 H168 B4 Cl4 Mo4 N40 -","4","1","","Dilworth, Jonathan R.; Gibson, Vernon C.; Davies, Nicola; Redshaw, Carl; White, Andrew P.; Williams, David J.","Bis(isodiazene) and related complexes of molybdenum(VI). Syntheses and structures of [Mo(OTf )2(NNPh2)2(py)2], [MoCl(OTf )(NNPh2){NC5H3(CH2C(O)Ph2)2-2,6}], [{MoCl(NNPh2)2(μ-Cl)(NH2But)}2] and [MoTp′Cl(NNPh2)2] [OTf = O3SCF3, Tp′ = tris(3,5-dimethylpyrazolyl)hydroborate]","Journal of the Chemical Society, Dalton Transactions","1999","","16","2695","","10.1039/a903372f","","","0.71073","Mo-Kα","","0.077","0.049","","","0.081","","","","","2.972","2.972","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027507","19.1305","0.0006","9.8798","0.0002","20.7186","0.0006","90","","91.66","","90","","3914.29","0.18","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H60 O12 Ti3 -","- C30 H60 O12 Ti3 -","- C120 H240 O48 Ti12 -","4","1","","Corden, Jonathan P.; Errington, William; Moore, Peter; Partridge, Martin G.; Wallbridge, Malcolm G. H.","An open chain trinuclear titanium(IV) isopropoxide species formed with the tridentate ligand cis,cis–cyclohexane–1,3,5-trialkoxide [C6H9O3]3−. Crystal structure of [{Ti(OPri)3}2{μ-Ti(C6H9O3-O1,O5)2}]","Journal of the Chemical Society, Dalton Transactions","1999","","16","2647","","10.1039/a903384j","","","0.71073","MoKα","","0.1622","0.0887","","","0.1481","0.1812","","","","","","1.136","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027508","7.2723","0.0003","6.1126","0.0003","7.5563","0.0004","90","","90","","90","","335.9","0.03","123","2","123","2","","","","","","","","3","P n n m","-P 2 2n","58","","manganese bis(dicyanamide)","","- C4 Mn N6 -","- C4 Mn N6 -","- C8 Mn2 N12 -","2","0.25","","Batten, Stuart R.; Jensen, Paul; Kepert, Cameron J.; Kurmoo, Mohamedally; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J.","Syntheses, structures and magnetism of α-Mn(dca)2, [Mn(dca)2(H2O)2]·H2O, [Mn(dca)2(C2H5OH)2]·(CH3)2CO, [Fe(dca)2(CH3OH)2] and [Mn(dca)2(L)2], where L = pyridine, CH3OH or DMF and dca− = dicyanamide, N(CN)2− †","Journal of the Chemical Society, Dalton Transactions","1999","","17","2987","","10.1039/a903487k","","","0.71073","MoKα","","0.0287","0.0249","","0.0645","0.0629","","","","1.133","1.161","1.161","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027509","7.5212","0.0003","13.1458","0.0009","8.6087","0.0006","90","","115.183","0.009","90","","770.26","0.1","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","manganese bis(dicyanamide) dipyridinate","","- C14 H10 Mn N8 -","- C14 H10 Mn N8 -","- C28 H20 Mn2 N16 -","2","0.5","","Batten, Stuart R.; Jensen, Paul; Kepert, Cameron J.; Kurmoo, Mohamedally; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J.","Syntheses, structures and magnetism of α-Mn(dca)2, [Mn(dca)2(H2O)2]·H2O, [Mn(dca)2(C2H5OH)2]·(CH3)2CO, [Fe(dca)2(CH3OH)2] and [Mn(dca)2(L)2], where L = pyridine, CH3OH or DMF and dca− = dicyanamide, N(CN)2− †","Journal of the Chemical Society, Dalton Transactions","1999","","17","2987","","10.1039/a903487k","","","0.71073","MoKα","","0.1034","0.0509","","","0.1053","0.12","","","","","","1.067","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027510","6.4242","0.0003","7.4907","0.0004","8.4034","0.0004","103.021","0.003","106.485","0.004","99.39","0.004","366.46","0.03","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","manganese bis(dicyanamide) bis(N,N'-dimethylforamide)","","- C10 H14 Mn N8 O2 -","- C10 H14 Mn N8 O2 -","- C10 H14 Mn N8 O2 -","1","0.5","","Batten, Stuart R.; Jensen, Paul; Kepert, Cameron J.; Kurmoo, Mohamedally; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J.","Syntheses, structures and magnetism of α-Mn(dca)2, [Mn(dca)2(H2O)2]·H2O, [Mn(dca)2(C2H5OH)2]·(CH3)2CO, [Fe(dca)2(CH3OH)2] and [Mn(dca)2(L)2], where L = pyridine, CH3OH or DMF and dca− = dicyanamide, N(CN)2− †","Journal of the Chemical Society, Dalton Transactions","1999","","17","2987","","10.1039/a903487k","","","0.71073","MoKα","","0.0464","0.0415","","","0.1268","0.1289","","","","","","1.234","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027511","12.409","0.001","7.481","0.001","6.528","0.001","90","","119.979","0.003","90","","524.93","0.12","150","2","150","2","","","","","","","'metathesis and recrystallisation in methanol'","5","C 1 2/m 1","-C 2y","12","","manganese bis(dicyanamide) dimethanolate","","- C6 H8 Mn N6 O2 -","- C6 H8 Mn N6 O2 -","- C12 H16 Mn2 N12 O4 -","2","0.25","","Batten, Stuart R.; Jensen, Paul; Kepert, Cameron J.; Kurmoo, Mohamedally; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J.","Syntheses, structures and magnetism of α-Mn(dca)2, [Mn(dca)2(H2O)2]·H2O, [Mn(dca)2(C2H5OH)2]·(CH3)2CO, [Fe(dca)2(CH3OH)2] and [Mn(dca)2(L)2], where L = pyridine, CH3OH or DMF and dca− = dicyanamide, N(CN)2− †","Journal of the Chemical Society, Dalton Transactions","1999","","17","2987","","10.1039/a903487k","","","0.71073","MoKα","","0.0238","0.0237","","0.0578","0.0577","","","","1.257","1.255","1.255","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027512","12.2247","0.0007","7.3921","0.0005","6.461","0.0004","90","","120.119","0.001","90","","505.03","0.05","123","2","123","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","iron bis(dicyanamide) dimethanolate","","- C6 H8 Fe N6 O2 -","- C6 H8 Fe N6 O2 -","- C12 H16 Fe2 N12 O4 -","2","0.25","","Batten, Stuart R.; Jensen, Paul; Kepert, Cameron J.; Kurmoo, Mohamedally; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J.","Syntheses, structures and magnetism of α-Mn(dca)2, [Mn(dca)2(H2O)2]·H2O, [Mn(dca)2(C2H5OH)2]·(CH3)2CO, [Fe(dca)2(CH3OH)2] and [Mn(dca)2(L)2], where L = pyridine, CH3OH or DMF and dca− = dicyanamide, N(CN)2− †","Journal of the Chemical Society, Dalton Transactions","1999","","17","2987","","10.1039/a903487k","","","0.71073","MoKα","","0.0555","0.0424","","","0.0874","0.0926","","","","","","1.089","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027513","11.316","0.001","11.358","0.001","12.488","0.001","90","","96.918","0.003","90","","1593.4","0.2","150","2","150","2","","","","","","","'metathesis and recrystallisation in an ethanol and acetone mixture'","5","C 1 2/c 1","-C 2yc","15","","manganese bis(dicyanamide) diethanolate acetone solvate","","- C11 H18 Mn N6 O3 -","- C11 H17 Mn N6 O3 -","- C44 H68 Mn4 N24 O12 -","4","0.5","","Batten, Stuart R.; Jensen, Paul; Kepert, Cameron J.; Kurmoo, Mohamedally; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J.","Syntheses, structures and magnetism of α-Mn(dca)2, [Mn(dca)2(H2O)2]·H2O, [Mn(dca)2(C2H5OH)2]·(CH3)2CO, [Fe(dca)2(CH3OH)2] and [Mn(dca)2(L)2], where L = pyridine, CH3OH or DMF and dca− = dicyanamide, N(CN)2− †","Journal of the Chemical Society, Dalton Transactions","1999","","17","2987","","10.1039/a903487k","","","0.71073","MoKα","","0.0437","0.0433","","0.0855","0.0854","","","","1.445","1.446","1.446","","","","","has coordinates,has disorder","179981","2020-10-21","18:00:00",""
"7027514","7.3165","0.0002","11.6229","0.0005","11.359","0.0005","90","","103.241","0.005","90","","940.28","0.07","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","manganese bis(dicyanamide) dihydrate water solvate","","- C4 H6 Mn N6 O3 -","- C4 H6 Mn N6 O3 -","- C16 H24 Mn4 N24 O12 -","4","1","","Batten, Stuart R.; Jensen, Paul; Kepert, Cameron J.; Kurmoo, Mohamedally; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J.","Syntheses, structures and magnetism of α-Mn(dca)2, [Mn(dca)2(H2O)2]·H2O, [Mn(dca)2(C2H5OH)2]·(CH3)2CO, [Fe(dca)2(CH3OH)2] and [Mn(dca)2(L)2], where L = pyridine, CH3OH or DMF and dca− = dicyanamide, N(CN)2− †","Journal of the Chemical Society, Dalton Transactions","1999","","17","2987","","10.1039/a903487k","","","0.71073","MoKα","","0.044","0.0313","","0.0992","0.0926","","","","1.175","1.246","1.246","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027515","18.999","0.001","27.303","0.001","9.902","0.001","90","","90","","90","","5136.5","0.6","198","2","198","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C59 H68 B N Si Zr2 -","- C59 H68 B N Si Zr2 -","- C236 H272 B4 N4 Si4 Zr8 -","4","1","","Pflug, Jörg; Fröhlich, Roland; Erker, Gerhard","Unexpected alkyl-substituent exchange during the formation of a cationic bis(zirconocene) complex that contains a planar four-co-ordinate carbon atom","Journal of the Chemical Society, Dalton Transactions","1999","","15","2551","","10.1039/a903492g","","","0.71073","MoKα","","0.058","0.0375","","","0.0806","0.0873","","","","","","1.04","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027516","25.643","0.001","18.965","0.001","9.398","0.001","90","","90","","90","","4570.4","0.6","198","2","198","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C54 H57 B Si Zr2 -","- C54 H57 B Si Zr2 -","- C216 H228 B4 Si4 Zr8 -","4","1","","Pflug, Jörg; Fröhlich, Roland; Erker, Gerhard","Unexpected alkyl-substituent exchange during the formation of a cationic bis(zirconocene) complex that contains a planar four-co-ordinate carbon atom","Journal of the Chemical Society, Dalton Transactions","1999","","15","2551","","10.1039/a903492g","","","0.71073","MoKα","","0.041","0.032","","","0.0704","0.0744","","","","","","1.038","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027517","25.913","0.003","10.0434","0.0012","27.989","0.003","90","","106.69","0.002","90","","6977.4","1.4","148","2","148","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27 H29 N4 S6 V -","- C27 H29 N4 S6 V -","- C216 H232 N32 S48 V8 -","8","1","","Montilla, Francisco; Pastor, Antonio; Monge, Angeles; Gutiérrez-Puebla, Enrique; Galindo, Agustín","Synthesis and characterization of d0 imido complexes of vanadium. Crystal structure of [V(2,6-iPr2C6H3N)(S2CNC4H4)3]","Journal of the Chemical Society, Dalton Transactions","1999","","16","2893","","10.1039/a903507i","","","0.71073","MoKα","","0.1396","0.0782","","0.2374","0.2087","","","","1.012","1.213","1.213","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027518","10.19","0.01","17.138","0.004","12.732","0.002","90","","102.9","0.004","90","","2167","2","288.2","","288.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 Cu N4 O2 S2 -","- C20 H22 Cu N4 O2 S2 -","- C80 H88 Cu4 N16 O8 S8 -","4","1","","Che, De-Ji; Li, Gang; Yao, Xiao-Lan; Zhou, Da-Peng","Simultaneous formation of both novel bis(μ-sulfur)- and bis(μ-oxo)bridged copper(II) dimers by reaction of N-benzoyl-N ′,N ′-dimethylthiourea (HL) with CuCl2. Syntheses, crystal structures and magnetic properties of [{CuL(HL)Cl}2] and [{CuL2}2] †","Journal of the Chemical Society, Dalton Transactions","1999","","16","2683","","10.1039/a903517f","","","0.7107","MoKα","","","0.0385","","","0.0564","","","","","1.249","1.249","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027519","21.637","0.004","26.29","0.005","9.109","0.002","90","","90","","90","","5181.5","1.8","291","2","291","2","","","","","","","","7","P c c n","-P 2ab 2ac","56","","","","- C40 H46 Cl2 Cu2 N8 O4 S4 -","- C40 H46 Cl2 Cu2 N8 O4 S4 -","- C160 H184 Cl8 Cu8 N32 O16 S16 -","4","0.5","","Che, De-Ji; Li, Gang; Yao, Xiao-Lan; Zhou, Da-Peng","Simultaneous formation of both novel bis(μ-sulfur)- and bis(μ-oxo)bridged copper(II) dimers by reaction of N-benzoyl-N ′,N ′-dimethylthiourea (HL) with CuCl2. Syntheses, crystal structures and magnetic properties of [{CuL(HL)Cl}2] and [{CuL2}2] †","Journal of the Chemical Society, Dalton Transactions","1999","","16","2683","","10.1039/a903517f","","","0.71073","MoKα","","0.1635","0.107","","0.1945","0.1737","","","","1.257","1.312","1.312","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027520","19.458","0.005","11.518","0.003","19.846","0.004","90","","109.15","0.01","90","","4201.7","1.8","296.2","","296.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H54 Cl4 Cu4 N8 O21 -","- C20 H52 Cl4 Cu4 N8 O21 -","- C80 H208 Cl16 Cu16 N32 O84 -","4","1","","Tan, Xiang Shi; Fujii, Yuki; Nukada, Ryoji; Mikuriya, Masahiro; Nakano, Yoshiharu","Crystal structure and ferromagnetic behaviour of a novel tetranuclear copper(II) complex with an open cubane-like Cu4O4 framework","Journal of the Chemical Society, Dalton Transactions","1999","","15","2415","","10.1039/a903524i","","","0.7107","MoKα","","0.068","0.068","","","0.0712","0.0712","","","","","","2.681","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027521","10.03","0.003","14.2591","0.002","14.396","0.003","88.618","0.015","80.504","0.023","89.759","0.02","2030.1","0.8","293","","295","","","","","","","","","7","P -1","-P 1","2","","","","- C45 H34 Mn N O3 P2 S2 -","- C45 H34 Mn N O3 P2 S2 -","- C90 H68 Mn2 N2 O6 P4 S4 -","2","1","","Lee, Chien-Ming; Lin, Ging-Yi; Hsieh, Chung-Hung; Hu, Ching-Han; Lee, Gene-Hsiang; Peng, Shie-Ming; Liaw, Wen-Feng","A five-coordinate, sixteen-electron manganese(I) complex [Mn(CO)3(S,S‒C6H4)]− stabilized by S,S π-donation from chelating [S,S‒C6H4]2−","Journal of the Chemical Society, Dalton Transactions","1999","","14","2393","","10.1039/a903538i","","","0.71073","MolybdenumKα","","0.076","0.036","","0.037","0.034","","","","","1.56","1.56","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027522","14.7936","0.0002","10.2732","0.0002","29.6377","0.0002","90","","92.567","0.001","90","","4499.75","0.11","295","2","295","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C49 H38 Mn N3 O3 P2 S2 -","- C49 H38 Mn N3 O3 P2 S2 -","- C196 H152 Mn4 N12 O12 P8 S8 -","4","1","","Lee, Chien-Ming; Lin, Ging-Yi; Hsieh, Chung-Hung; Hu, Ching-Han; Lee, Gene-Hsiang; Peng, Shie-Ming; Liaw, Wen-Feng","A five-coordinate, sixteen-electron manganese(I) complex [Mn(CO)3(S,S‒C6H4)]− stabilized by S,S π-donation from chelating [S,S‒C6H4]2−","Journal of the Chemical Society, Dalton Transactions","1999","","14","2393","","10.1039/a903538i","","","0.71073","MoKα","","0.0985","0.051","","0.1128","0.095","","","","1.044","1.133","1.133","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027523","10.493","0.0008","10.493","0.0008","13.3402","0.0011","90","","90","","90","","1468.8","0.2","293","2","293","2","","","","","","","","7","I -4","I -4","82","","","","- C24 H28 Cu F6 Fe2 P S4 -","- C24 H28 Cu F6 Fe2 P S4 -","- C48 H56 Cu2 F12 Fe4 P2 S8 -","2","0.25","","Long, Nicholas J.; Martin, Jeff; Opromolla, Giuliana; White, Andrew J. P.; Williams, David J.; Zanello, Piero","Synthesis and characterisation of 1-(diphenylphosphino)-1′-(methylsulfanyl)ferrocene and a series of metal (CuI, AgI)‒ferrocenylene complexes","Journal of the Chemical Society, Dalton Transactions","1999","","12","1981","","10.1039/a903539g","","","0.71073","MoKα","","0.0394","0.0307","","0.7055","0.0781","","","","1.053","1.084","1.084","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027524","22.627","0.005","23.575","0.006","22.97","0.006","90","","100.917","0.011","90","","12031","5","293","2","293","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C68 H56 Ag B F4 Fe2 P4 -","- C68 H56 Ag B F4.01 Fe2 P4 -","- C544 H448 Ag8 B8 F32.08 Fe16 P32 -","8","1","","Long, Nicholas J.; Martin, Jeff; Opromolla, Giuliana; White, Andrew J. P.; Williams, David J.; Zanello, Piero","Synthesis and characterisation of 1-(diphenylphosphino)-1′-(methylsulfanyl)ferrocene and a series of metal (CuI, AgI)‒ferrocenylene complexes","Journal of the Chemical Society, Dalton Transactions","1999","","12","1981","","10.1039/a903539g","","","1.54178","CuKα","","0.1494","0.0852","","0.6861","0.197","","","","1.03","1.104","1.104","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027525","29.3","0.008","17.762","0.008","22.139","0.008","90","","97.19","0.02","90","","11431","7","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C52 H45 Cl4 N12 O18.5 Ru2 -","- C52 H36 Cl4 N12 O18.5 Ru2 -","- C416 H288 Cl32 N96 O148 Ru16 -","8","1","","Fletcher, Nicholas C.; Robinson, Toby C.; Behrendt, Andreas; Jeffery, John C.; Reeves, Zoe R.; Ward, Michael D.","Structural, electrochemical and UV/VIS/NIR spectroelectrochemical properties of diastereomerically pure dinuclear ruthenium complexes based on the bridging ligand phenanthroline-5,6-diimine, and a mononuclear by-product with a peripheral isoimidazole group","Journal of the Chemical Society, Dalton Transactions","1999","","17","2999","","10.1039/a903556g","","","0.71073","MoKα","","0.1412","0.0712","","0.213","0.1729","","","","1.017","1.138","1.138","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027526","13.862","0.002","15.622","0.002","19.794","0.003","90","","90","","90","","4286.4","1.1","293","2","293","2","","","","","","","","6","A b a 2","A 2 -2ab","41","","","","- C39 H34 F12 N10 P2 Ru -","- C39 H34 F12 N10 P2 Ru -","- C156 H136 F48 N40 P8 Ru4 -","4","","","Fletcher, Nicholas C.; Robinson, Toby C.; Behrendt, Andreas; Jeffery, John C.; Reeves, Zoe R.; Ward, Michael D.","Structural, electrochemical and UV/VIS/NIR spectroelectrochemical properties of diastereomerically pure dinuclear ruthenium complexes based on the bridging ligand phenanthroline-5,6-diimine, and a mononuclear by-product with a peripheral isoimidazole group","Journal of the Chemical Society, Dalton Transactions","1999","","17","2999","","10.1039/a903556g","","","0.71073","MoKα","","0.0363","0.0295","","0.0802","0.078","","","","0.997","1.077","1.077","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027527","10.179","0.002","10.8","0.001","16.866","0.002","85.54","0.02","78.49","0.02","72.03","0.01","1728","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H26 Cl N15 Ni2 O6 -","- C30 H26 Cl N15 Ni2 O6 -","- C60 H52 Cl2 N30 Ni4 O12 -","2","1","","Barandika, M. Gotzone; Cortés, Roberto; Lezama, Luis; Urtiaga, M. Karmele; Arriortua, M. Isabel; Rojo, Teófilo","Synthesis and magnetostructural characterization of two ferromagnetic nickel(II) dimers","Journal of the Chemical Society, Dalton Transactions","1999","","17","2971","","10.1039/a903558c","","","0.7107","MoKα","","0.0793","0.0492","","0.1494","0.1276","","","","1.037","1.079","1.079","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027528","20.979","0.003","7.733","0.001","20.117","0.004","90","","90.29","0.02","90","","3263.6","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H12 N9 Ni O0.5 -","- C15 H12 N9 Ni O0.5 -","- C120 H96 N72 Ni8 O4 -","8","1","","Barandika, M. Gotzone; Cortés, Roberto; Lezama, Luis; Urtiaga, M. Karmele; Arriortua, M. Isabel; Rojo, Teófilo","Synthesis and magnetostructural characterization of two ferromagnetic nickel(II) dimers","Journal of the Chemical Society, Dalton Transactions","1999","","17","2971","","10.1039/a903558c","","","0.71069","MoKα","","0.0762","0.0675","","0.2251","0.1891","","","","1.062","1.068","1.068","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027529","6.0102","0.0004","15.6972","0.0011","8.7387","0.0006","90","","102.25","0.002","90","","805.67","0.1","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C3 H8 Br2 N2 Se -","- C3 H8 Br2 N2 Se -","- C12 H32 Br8 N8 Se4 -","4","1","","Boyle, Philip D.; Cross, Wendy I.; Godfrey, Stephen M.; McAuliffe, Charles A.; Pritchard, Robin G.; Teat, Simon J.","Reaction of dimethylselenourea and selenourea with dibromine to produce selenourea–dibromine, the ‘T’-shaped 1:1 molecular adduct N,N-dimethyl-2-selenourea–dibromine, its solvent of crystallisation-containing analogue and the unusual ionic compound 5[(H2N)(Me2N)CBr]+[SeBr6]2−[Se2Br9]−2[Br3]−. A low temperature crystallographic reinvestigation of N-methylbenzothiazole-2-selone–dibromine","Journal of the Chemical Society, Dalton Transactions","1999","","16","2845","","10.1039/a903564h","","","0.6875","","","0.0396","0.0374","","","0.0892","0.0901","","","","","","1.037","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027530","5.9721","0.001","22.241","0.002","8.9466","0.001","90","","104.503","0.01","90","","1150.5","0.3","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C4 H10 Br2 Cl2 N2 Se -","- C4 H10 Br2 Cl2 N2 Se -","- C16 H40 Br8 Cl8 N8 Se4 -","4","1","","Boyle, Philip D.; Cross, Wendy I.; Godfrey, Stephen M.; McAuliffe, Charles A.; Pritchard, Robin G.; Teat, Simon J.","Reaction of dimethylselenourea and selenourea with dibromine to produce selenourea–dibromine, the ‘T’-shaped 1:1 molecular adduct N,N-dimethyl-2-selenourea–dibromine, its solvent of crystallisation-containing analogue and the unusual ionic compound 5[(H2N)(Me2N)CBr]+[SeBr6]2−[Se2Br9]−2[Br3]−. A low temperature crystallographic reinvestigation of N-methylbenzothiazole-2-selone–dibromine","Journal of the Chemical Society, Dalton Transactions","1999","","16","2845","","10.1039/a903564h","","","0.71073","MoKα","","0.0861","0.0466","","","0.093","0.1074","","","","","","0.977","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027531","12.265","0.003","13.625","0.003","14.222","0.002","90","","90.73","0.03","90","","2376.5","0.9","203","2","203","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16.5 H15 Br4 Cl N2 S2 Se2 -","- C16.5 H15 Br4 Cl N2 S2 Se2 -","- C66 H60 Br16 Cl4 N8 S8 Se8 -","4","1","","Boyle, Philip D.; Cross, Wendy I.; Godfrey, Stephen M.; McAuliffe, Charles A.; Pritchard, Robin G.; Teat, Simon J.","Reaction of dimethylselenourea and selenourea with dibromine to produce selenourea‒dibromine, the ‘T’-shaped 1:1 molecular adduct N,N-dimethyl-2-selenourea‒dibromine, its solvent of crystallisation-containing analogue and the unusual ionic compound 5[(H2N)(Me2N)CBr]+[SeBr6]2−[Se2Br9]−2[Br3]−. A low temperature crystallographic reinvestigation of N-methylbenzothiazole-2-selone‒dibromine","Journal of the Chemical Society, Dalton Transactions","1999","","16","2845","","10.1039/a903564h","","","0.71069","MoKα","","0.2352","0.0759","","","0.0587","0.0839","","","","","","0.958","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027532","10.5396","0.0014","17.097","0.003","33.115","0.003","90","","93.671","0.01","90","","5954.9","1.4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C15 H40 Br26 N10 Se3 -","- C14.9736 H39.6824 Br25.9912 N9.9824 Se3 -","- C59.8944 H158.73 Br103.965 N39.9296 Se12 -","4","0.5","","Boyle, Philip D.; Cross, Wendy I.; Godfrey, Stephen M.; McAuliffe, Charles A.; Pritchard, Robin G.; Teat, Simon J.","Reaction of dimethylselenourea and selenourea with dibromine to produce selenourea‒dibromine, the ‘T’-shaped 1:1 molecular adduct N,N-dimethyl-2-selenourea‒dibromine, its solvent of crystallisation-containing analogue and the unusual ionic compound 5[(H2N)(Me2N)CBr]+[SeBr6]2−[Se2Br9]−2[Br3]−. A low temperature crystallographic reinvestigation of N-methylbenzothiazole-2-selone‒dibromine","Journal of the Chemical Society, Dalton Transactions","1999","","16","2845","","10.1039/a903564h","","","0.6875","","","0.0647","0.0458","","","0.1199","0.1267","","","","","","1.047","","","","has coordinates,has disorder","179981","2020-10-21","18:00:00",""
"7027533","11.095","0.002","11.395","0.002","20.22","0.002","79.86","0.03","80.42","0.03","72.31","0.03","2380","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C46 H41 Cl6 Cr O5 P2 Ta -","- C46 H41 Cl6 Cr O5 P2 Ta -","- C92 H82 Cl12 Cr2 O10 P4 Ta2 -","2","1","","Poulard, Cyril; Boni, Gilles; Richard, Philippe; Moïse, Claude","Bidentate metalloligands containing the phosphinocyclopentadienyl ligand. New heterobimetallic complexes and crystal structure of (C5Me5)(C5H4PPh2)Ta(CO)(μ-PPh2)Cr(CO)4","Journal of the Chemical Society, Dalton Transactions","1999","","16","2725","","10.1039/a903603b","","","0.71073","MoKα","","0.0451","0.0318","","0.0855","","0.08","","","1.045","","","1.053","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027534","10.127","0.001","13.846","0.001","14.428","0.001","68.4","0.02","83.32","0.02","87.45","0.02","1868.2","0.4","298.2","","298.2","","","","","","","","","5","P 1","P 1","1","","","","- C37.5 H55.5 Mn N3 O2 -","- C39 H59 Mn N3 O2 -","- C78 H118 Mn2 N6 O4 -","2","2","","Ho, Chi-Ming; Lau, Tai-Chu; Kwong, Hoi-Lun; Wong, Wing-Tak","Activation of manganese nitrido complexes by Brønsted and Lewis acids. Crystal structure and asymmetric alkene aziridination of a chiral salen manganese nitrido complex","Journal of the Chemical Society, Dalton Transactions","1999","","15","2411","","10.1039/a903605i","","","0.7107","MoKalpha","","","0.0868","","","0.1006","","","","","2.325","2.325","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027535","12.824","0.003","13.667","0.003","14.524","0.003","115.15","0.03","99.76","0.03","107.71","0.03","2059","1.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis{tri-o-tolylsilanethiolato(tri-phenylphosphine)silver(I)}bis(toluene)","","- C46 H44 Ag P S Si -","- C46 H44 Ag P S Si -","- C92 H88 Ag2 P2 S2 Si2 -","2","1","","Chojnacki, Jaroslaw; Becker, Barbara; Konitz, Atoni; Potrzebowski, Marek J.; Wojnowski, Wieslaw","Synthesis, X-ray and solid state NMR studies on silver(I) silanethiolates. Crystal structure of bis[(triphenylphosphine)(tri-o-tolylsilanethiolato)silver(I)]‒toluene(1/2), [{Ag[SSi(C6H4Me-o)3](PPh3)}2]·2C6H5Me †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3063","","10.1039/a903694f","","","0.71073","MoKα","","0.0927","0.0267","","","0.0716","0.0899","","","","","","0.998","","","","has coordinates,has disorder","179981","2020-10-21","18:00:00",""
"7027536","14.593","0.005","17.237","0.006","19.33","0.007","90","","108.11","0.03","90","","4621","3","178","2","178","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C50 H46 Ag Au2 Cl N2 O4 P2 -","- C50 H46 Ag Au2 Cl N2 O4 P2 -","- C200 H184 Ag4 Au8 Cl4 N8 O16 P8 -","4","0.5","","Casas, J. Enrique; Gimeno, M. Concepción; Jones, Peter G.; Laguna, Antonio; Laguna, Mariano","Synthesis and reactivity of [Au(2-CH2-6-RC5H3N)(PPh3)] (R = H, Me). X-Ray structure of [Ag{Au(2-CH2-6-MeC5H3N)(PPh3)}2][ClO4]","Journal of the Chemical Society, Dalton Transactions","1999","","16","2819","","10.1039/a903703i","","","0.71073","MoKα","","0.0469","0.0306","","","0.0711","0.0812","","","","","","1.075","","","","has coordinates,has disorder","179981","2020-10-21","18:00:00",""
"7027537","11.809","0.003","11.9047","0.0014","16.348","0.003","87.302","0.012","81.012","0.015","66.879","0.011","2087.4","0.7","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C48 H49 F5 Mo N2 O -","- C48 H49 F5 Mo N2 O -","- C96 H98 F10 Mo2 N4 O2 -","2","1","","Dilworth, Jonathan R.; Gibson, Vernon C.; Redshaw, Carl; White, Andrew J. P.; Williams, David J.","Molybdenum and tungsten mono-isodiazene complexes with alkyl ligands as ring-opening metathesis polymerisation procatalysts. Crystal and molecular structures of [Mo(CH2CMe2Ph)3(NNPh2)(OC6F5)], [W(CH2SiMe3)3(NNPh2)(OC6F5)] and [WCl2(NNPh2)(OC6F5)2(thf )]","Journal of the Chemical Society, Dalton Transactions","1999","","16","2701","","10.1039/a903770e","","","1.54178","CuKα","","0.0428","0.0408","","0.2221","0.11","","","","1.022","1.028","1.028","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027538","9.9973","0.0012","10.6644","0.0008","18.1009","0.0013","90.841","0.007","90.338","0.008","110.944","0.008","1802","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C30 H43 F5 N2 O Si3 W -","- C30 H43 F5 N2 O Si3 W -","- C60 H86 F10 N4 O2 Si6 W2 -","2","1","","Dilworth, Jonathan R.; Gibson, Vernon C.; Redshaw, Carl; White, Andrew J. P.; Williams, David J.","Molybdenum and tungsten mono-isodiazene complexes with alkyl ligands as ring-opening metathesis polymerisation procatalysts. Crystal and molecular structures of [Mo(CH2CMe2Ph)3(NNPh2)(OC6F5)], [W(CH2SiMe3)3(NNPh2)(OC6F5)] and [WCl2(NNPh2)(OC6F5)2(thf )]","Journal of the Chemical Society, Dalton Transactions","1999","","16","2701","","10.1039/a903770e","","","1.54178","CuKα","","0.0524","0.0458","","0.1261","0.1173","","","","1.069","1.08","1.08","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027539","10.908","0.002","13.007","0.002","21.66","0.004","90","","98.29","0.02","90","","3041","0.9","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C28 H18 Cl2 F10 N2 O3 W -","- C28 H18 Cl2 F10 N2 O3 W -","- C112 H72 Cl8 F40 N8 O12 W4 -","4","0.5","","Dilworth, Jonathan R.; Gibson, Vernon C.; Redshaw, Carl; White, Andrew J. P.; Williams, David J.","Molybdenum and tungsten mono-isodiazene complexes with alkyl ligands as ring-opening metathesis polymerisation procatalysts. Crystal and molecular structures of [Mo(CH2CMe2Ph)3(NNPh2)(OC6F5)], [W(CH2SiMe3)3(NNPh2)(OC6F5)] and [WCl2(NNPh2)(OC6F5)2(thf )]","Journal of the Chemical Society, Dalton Transactions","1999","","16","2701","","10.1039/a903770e","","","0.71073","MoKα","","0.0487","0.036","","0.0858","0.0803","","","","1.017","1.04","1.04","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027540","13.398","0.006","13.623","0.005","14.538","0.005","77.4","0.05","84.25","0.05","69.69","0.04","2427.7","1.8","293","2","290","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H36 Cl10 O4 P2 Rh2 -","- C42 H36 Cl10 O4 P2 Rh2 -","- C84 H72 Cl20 O8 P4 Rh4 -","2","1","","Estevan, Francisco; García-Bernabé, Abel; García-Granda, Santiago; Lahuerta, Pascual; Moreno, Eduardo; Pérez-Prieto, Julia; Sanaú, Mercedes; Ubeda, M. Angeles","A new structural type of dinuclear rhodium(II) compounds: synthesis by serendipity and design; catalytic behaviour in carbene transfer reactions †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3493","","10.1039/a903811f","","","0.71073","MoKα","","0.0587","0.0352","","","0.0947","0.1041","","","","","","1.04","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027541","17.9125","0.001","13.0427","0.0008","19.6074","0.0012","90","","94.89","0.001","90","","4564.2","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43.5 H43 Cl5 O6 P2 Rh2 -","- C43.5 H43 Cl5 O6 P2 Rh2 -","- C174 H172 Cl20 O24 P8 Rh8 -","4","1","","Estevan, Francisco; García-Bernabé, Abel; García-Granda, Santiago; Lahuerta, Pascual; Moreno, Eduardo; Pérez-Prieto, Julia; Sanaú, Mercedes; Ubeda, M. Angeles","A new structural type of dinuclear rhodium(II) compounds: synthesis by serendipity and design; catalytic behaviour in carbene transfer reactions †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3493","","10.1039/a903811f","","","0.71073","MoKα","","0.0952","0.0768","","0.2031","0.1895","","","","1.09","1.136","1.136","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027542","13.581","0.002","17.475","0.003","12.663","0.002","90","","104.772","0.001","90","","2906","0.8","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C27 H31 B Cl Mo N6 O3 S -","- C27 H31 B Cl Mo N6 O3 S -","- C108 H124 B4 Cl4 Mo4 N24 O12 S4 -","4","1","","Harden, Nicholas C.; Humphrey, Elizabeth R.; Jeffery, John C.; Lee, Siu-Ming; Marcaccio, Massimo; McCleverty, Jon A.; Rees, Leigh H.; Ward, Michael D.","Dinuclear oxomolybdenum(V) complexes which show strong electrochemical interactions across bis-phenolate bridging ligands: a combined spectroelectrochemical and computational study","Journal of the Chemical Society, Dalton Transactions","1999","","15","2417","","10.1039/a903841h","","","0.71073","MoKα","","0.0541","0.0459","","0.1043","0.1019","","","","1.247","1.313","1.313","","","","","has coordinates,has disorder","179981","2020-10-21","18:00:00",""
"7027543","10.8807","0.0012","15.5555","0.0013","16.969","0.003","80.708","0.01","79.243","0.014","76.397","0.007","2721.6","0.6","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C46 H61 B2 Cl4 Mo2 N12 O4 S -","- C46 H54 B2 Cl4 Mo2 N12 O4 S -","- C92 H108 B4 Cl8 Mo4 N24 O8 S2 -","2","1","","Harden, Nicholas C.; Humphrey, Elizabeth R.; Jeffery, John C.; Lee, Siu-Ming; Marcaccio, Massimo; McCleverty, Jon A.; Rees, Leigh H.; Ward, Michael D.","Dinuclear oxomolybdenum(V) complexes which show strong electrochemical interactions across bis-phenolate bridging ligands: a combined spectroelectrochemical and computational study","Journal of the Chemical Society, Dalton Transactions","1999","","15","2417","","10.1039/a903841h","","","0.71073","MoKα","","0.0817","0.0507","","0.1648","0.1459","","","","1.046","1.156","1.156","","","","","has coordinates,has disorder","179981","2020-10-21","18:00:00",""
"7027544","11.64","0.006","8.898","0.005","19.75","0.08","90","","98.03","0.04","90","","2026","8","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C15 H24 Cl3 N3 O3 Rh -","- C15 H24 Cl3 N3 O3 Rh -","- C60 H96 Cl12 N12 O12 Rh4 -","4","1","","Yu. Kukushkin, Vadim; Ilichev, Igor V.; Wagner, Gabriele; Fraústo da Silva, João J. R.; Pombeiro, Armando J. L.","Rhodium(III)-mediated oxime‒nitrile coupling giving chelated iminoacylated species †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3047","","10.1039/a903844b","","","0.71069","MoKα","","0.0588","0.045","","","0.1018","0.1075","","","","","","1.019","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7027545","11.512","0.002","9.724","0.002","15.694","0.003","90","","107.06","0.03","90","","1679.5","0.6","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C12 H21 Cl3 N3 O2 Rh -","- C12 H21 Cl3 N3 O2 Rh -","- C48 H84 Cl12 N12 O8 Rh4 -","4","1","","Yu. Kukushkin, Vadim; Ilichev, Igor V.; Wagner, Gabriele; Fraústo da Silva, João J. R.; Pombeiro, Armando J. L.","Rhodium(III)-mediated oxime‒nitrile coupling giving chelated iminoacylated species †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3047","","10.1039/a903844b","","","0.71073","MoKα","","0.0211","0.0211","","","0.0559","0.0559","","","","","","1.111","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027546","8.524","0.002","11.529","0.002","12.116","0.002","67.21","0.03","94.35","0.03","82.12","0.03","1076.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H27 Cl3 N4 O3.5 Rh -","- C14 H26 Cl3 N4 O3.5 Rh -","- C28 H52 Cl6 N8 O7 Rh2 -","2","1","","Yu. Kukushkin, Vadim; Ilichev, Igor V.; Wagner, Gabriele; Fraústo da Silva, João J. R.; Pombeiro, Armando J. L.","Rhodium(III)-mediated oxime‒nitrile coupling giving chelated iminoacylated species †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3047","","10.1039/a903844b","","","0.71073","MoKα","","0.0317","0.0316","","","0.0824","0.0828","","","","","","1.045","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027547","8.866","0.002","10.358","0.002","10.952","0.002","109.58","0.03","97.65","0.03","112.09","0.03","838.5","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H21 Cl1.5 N2 O2.5 Rh0.5 -","- C14 H14 Cl1.5 N2 O2.5 Rh0.5 -","- C28 H28 Cl3 N4 O5 Rh -","2","1","","Yu. Kukushkin, Vadim; Ilichev, Igor V.; Wagner, Gabriele; Fraústo da Silva, João J. R.; Pombeiro, Armando J. L.","Rhodium(III)-mediated oxime‒nitrile coupling giving chelated iminoacylated species †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3047","","10.1039/a903844b","","","0.71073","MoKα","","0.0332","0.0332","","","0.0907","0.0907","","","","","","1.079","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027548","18.0036","0.001","18.0036","0.001","105.495","0.006","90","","90","","120","","29613","3","160","2","160","2","","","","","","","","6","R -3 c :H","-R 3 2""c","167","","","","- C84 H78 Cl20 P6 Pt3 S2 -","- C84 H78 Cl20 P6 Pt3 S2 -","- C1008 H936 Cl240 P72 Pt36 S24 -","12","0.333333","","Capdevila, Mercè; Carrasco, Yolanda; Clegg, William; Coxall, Robert A.; González-Duarte, Pilar; Lledós, Agustí; Antonio Ramírez, José; Ramírez, Antonio","Extending knowledge on the nucleophilicity of the {Pt2S2} core: Ph2PCH2CH2PPh2 as an alternative terminal ligand in [L2Pt(μ-S)2PtL2] metalloligands †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3103","","10.1039/a903899j","","","0.71073","MoKα","","0.0421","0.0325","","0.0915","0.0787","","","","1.13","1.099","1.099","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027549","14.0572","0.0009","15.1519","0.0009","29.545","0.0019","90.343","0.002","99.877","0.001","115.552","0.002","5570.6","0.6","160","2","160","2","","","","","","","","8","P -1","-P 1","2","","","","- C128 H115 B2 N P6 Pd1.31 Pt1.68 S2 -","- C128 H115 B2 N P6 Pd1.315 Pt1.685 S2 -","- C256 H230 B4 N2 P12 Pd2.63 Pt3.37 S4 -","2","1","","Capdevila, Mercè; Carrasco, Yolanda; Clegg, William; Coxall, Robert A.; González-Duarte, Pilar; Lledós, Agustí; Antonio Ramírez, José; Ramírez, Antonio","Extending knowledge on the nucleophilicity of the {Pt2S2} core: Ph2PCH2CH2PPh2 as an alternative terminal ligand in [L2Pt(μ-S)2PtL2] metalloligands †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3103","","10.1039/a903899j","","","0.71073","MoKα","","0.0935","0.0624","","0.13","0.1121","","","","1.209","1.19","1.19","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027550","13.649","0.008","33.654","0.019","23.209","0.012","90","","90","","90","","10661","10","160","2","160","2","","","","","","","","8","C 2 2 21","C 2c 2","20","","","","- C104 H96 Cl2 O8 P8 Pt4 S4 Zn -","- C104 H96 Cl2 O8 P8 Pt4 S4 Zn -","- C416 H384 Cl8 O32 P32 Pt16 S16 Zn4 -","4","0.5","","Capdevila, Mercè; Carrasco, Yolanda; Clegg, William; Coxall, Robert A.; González-Duarte, Pilar; Lledós, Agustí; Antonio Ramírez, José; Ramírez, Antonio","Extending knowledge on the nucleophilicity of the {Pt2S2} core: Ph2PCH2CH2PPh2 as an alternative terminal ligand in [L2Pt(μ-S)2PtL2] metalloligands †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3103","","10.1039/a903899j","","","0.6865","synchrotron","","0.1239","0.1052","","","0.2223","0.2295","","","","","","1.219","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027551","13.59","0.003","33.847","0.006","22.927","0.004","90","","90","","90","","10546","4","160","2","160","2","","","","","","","","8","C 2 2 21","C 2c 2","20","","","","- C104 H96 Cd Cl2 O8 P8 Pt4 S4 -","- C104 H96 Cd Cl2 O8 P8 Pt4 S4 -","- C416 H384 Cd4 Cl8 O32 P32 Pt16 S16 -","4","0.5","","Capdevila, Mercè; Carrasco, Yolanda; Clegg, William; Coxall, Robert A.; González-Duarte, Pilar; Lledós, Agustí; Antonio Ramírez, José; Ramírez, Antonio","Extending knowledge on the nucleophilicity of the {Pt2S2} core: Ph2PCH2CH2PPh2 as an alternative terminal ligand in [L2Pt(μ-S)2PtL2] metalloligands †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3103","","10.1039/a903899j","","","0.71073","MoKα","","0.0702","0.0485","","","0.0972","0.1028","","","","","","1.009","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027552","16.7851","0.0008","16.9057","0.0008","22.1911","0.001","73.093","0.002","86.3","0.002","75.436","0.002","5831","0.5","160","2","160","2","","","","","","","","8","P -1","-P 1","2","","","","- C116 H124 Cd2 Cl4 O6 P8 Pt4 S4 -","- C116 H120 Cd2 Cl4 O6 P8 Pt4 S4 -","- C232 H240 Cd4 Cl8 O12 P16 Pt8 S8 -","2","1","","Capdevila, Mercè; Carrasco, Yolanda; Clegg, William; Coxall, Robert A.; González-Duarte, Pilar; Lledós, Agustí; Antonio Ramírez, José; Ramírez, Antonio","Extending knowledge on the nucleophilicity of the {Pt2S2} core: Ph2PCH2CH2PPh2 as an alternative terminal ligand in [L2Pt(μ-S)2PtL2] metalloligands †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3103","","10.1039/a903899j","","","0.71073","MoKα","","0.1155","0.0533","","","0.0947","0.1105","","","","","","0.965","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027553","19.4566","0.0007","19.4566","0.0007","27.244","0.001","90","","90","","90","","10313.5","0.6","160","2","160","2","","","","","","","","8","P -4 21 c","P -4 2n","114","","","","- C104 H96 Cl2 F6 Hg1.5 P9 Pt4 S4 -","- C104 H96 Cl2 F6 Hg1.5 P9 Pt4 S4 -","- C416 H384 Cl8 F24 Hg6 P36 Pt16 S16 -","4","0.5","","Capdevila, Mercè; Carrasco, Yolanda; Clegg, William; Coxall, Robert A.; González-Duarte, Pilar; Lledós, Agustí; Antonio Ramírez, José; Ramírez, Antonio","Extending knowledge on the nucleophilicity of the {Pt2S2} core: Ph2PCH2CH2PPh2 as an alternative terminal ligand in [L2Pt(μ-S)2PtL2] metalloligands †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3103","","10.1039/a903899j","","","0.71073","MoKα","","0.0464","0.0359","","0.0984","0.0923","","","","1.067","1.071","1.071","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027554","7.838","0.0002","19.8698","0.0005","9.5558","0.0003","90","","111.932","0.001","90","","1380.51","0.07","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 Mn2 N16 -","- C24 H24 Mn2 N16 -","- C48 H48 Mn4 N32 -","2","0.5","","Shen, Zhen; Zuo, Jing-Lin; Yu, Zhi; Zhang, Yong; Bai, Jun-Feng; Che, Chi-Ming; Fun, Hoong-Kun; Vittal, Jagadese J.; You, Xiao-Zeng","Crystal structures and magnetic properties of two alternating azide-bridged complexes [{M(dmbpy)(N3)2}n] (M = Mn or Cu; dmbpy = 4,4′-dimethyl-2,2′-bipyridine) †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3393","","10.1039/a903968f","","","0.71073","MoKα","","0.0543","0.0348","","0.0823","0.0735","","","","1.075","1.094","1.094","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027555","7.961","0.0006","9.392","0.0006","10.7626","0.0008","113.439","0.001","101.228","0.001","101.982","0.001","686.89","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H12 Cu N8 -","- C12 H12 Cu N8 -","- C24 H24 Cu2 N16 -","2","1","","Shen, Zhen; Zuo, Jing-Lin; Yu, Zhi; Zhang, Yong; Bai, Jun-Feng; Che, Chi-Ming; Fun, Hoong-Kun; Vittal, Jagadese J.; You, Xiao-Zeng","Crystal structures and magnetic properties of two alternating azide-bridged complexes [{M(dmbpy)(N3)2}n] (M = Mn or Cu; dmbpy = 4,4′-dimethyl-2,2′-bipyridine) †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3393","","10.1039/a903968f","","","0.71073","MoKα","","0.0582","0.0452","","","0.1151","0.1223","","","","","","1.032","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027556","15.072","0.005","11.309","0.007","31.994","0.013","90","","92.88","0.03","90","","5446","4","203","2","203","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H21 I4 P -","- C9 H21 I4 P -","- C108 H252 I48 P12 -","12","3","","Cross, Wendy I.; Godfrey, Stephen M.; McAuliffe, Charles A.; Pritchard, Robin G.; Sheffield, Joanne M.; Thompson, Graeme M.","The reaction of some tertiary phosphines with two mole equivalents of diiodine to produce the iodophosphonium triiodides [R3PI]I3; influence of R in causing subtle variations in solid state structures","Journal of the Chemical Society, Dalton Transactions","1999","","16","2795","","10.1039/a903974k","","","0.71073","MoKα","","0.1068","0.0739","","","0.1896","0.2186","","","","","","0.947","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027557","16.913","0.003","9.7437","0.0015","35.602","0.008","90","","94.02","0.02","90","","5852.6","1.9","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H42 I4 N3 P -","- C18 H42 I4 N3 P -","- C144 H336 I32 N24 P8 -","8","2","","Cross, Wendy I.; Godfrey, Stephen M.; McAuliffe, Charles A.; Pritchard, Robin G.; Sheffield, Joanne M.; Thompson, Graeme M.","The reaction of some tertiary phosphines with two mole equivalents of diiodine to produce the iodophosphonium triiodides [R3PI]I3; influence of R in causing subtle variations in solid state structures","Journal of the Chemical Society, Dalton Transactions","1999","","16","2795","","10.1039/a903974k","","","0.71069","MoKα","","0.1768","0.0695","","","0.123","0.1631","","","","","","0.994","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027558","15.937","0.002","15.9367","","21.982","0.005","90","","90","","90","","5583.1","1.5","301.2","","301.2","","","","","","","","","4","P 4/n :2","-P 4a","85","","","","- C128 H80 Cu8 Pt4 -","- C128 H80 Cu8 Pt4 -","- C256 H160 Cu16 Pt8 -","2","0.25","","Wing-Wah Yam, Vivian; Yu, Ka-Lai; Cheung, Kung-Kai","Luminescence and aggregation studies of hexanuclear platinum–copper acetylide complexes. Crystal structure of the luminescent metal–metal bonded dimer [Pt2Cu4(CCPh)8]2","Journal of the Chemical Society, Dalton Transactions","1999","","17","2913","","10.1039/a903986d","","","0.7107","MoKalpha","","","0.0357","","","0.052","","","","","1.754","1.754","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027559","7.29","0.002","8.009","0.004","14.473","0.002","90","","93.66","0.03","90","","843.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N-methyliminodi(methylenephosphonate","","- C3 H11 N O6 P2 -","- C3 H11 N O6 P2 -","- C12 H44 N4 O24 P8 -","4","1","","Matczak-Jon, Ewa; Kurzak, Barbara; Kamecka, Anna; Sawka-Dobrowolska, Wanda; Kafarski, Paweł","Interactions of zinc(II), magnesium(II) and calcium(II) with iminodimethylenediphosphonic acids in aqueous solutions †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3627","","10.1039/a903997j","","","0.71069","MoKα","","","0.0295","","","0.0811","","","","","","","1.038","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027560","18.761","0.004","18.761","0.004","7.524","0.004","90","","90","","90","","2648.3","1.6","153","2","153","2","","","","","","","","6","I -4","I -4","82","","","","- C6 H11 Cl Cu N3 O10.5 -","- C6 H6 Cl Cu N3 O10.5 -","- C48 H48 Cl8 Cu8 N24 O84 -","8","1","","Colacio, Enrique; López-Magaña, Carlos; McKee, Vickie; Romerosa, Antonio","Novel square-planar cyclic tetranuclear copper(II) complex containing oximate bridges. Synthesis, crystal structure and magnetic properties of tetrakis[diaqua(μ-1,3-dimethylviolurato)copper(II)] tetraperchlorate dihydrate","Journal of the Chemical Society, Dalton Transactions","1999","","17","2923","","10.1039/a904012i","","","0.71073","MoKα","","0.0911","0.0784","","","0.1633","0.1721","","","","","","1.095","","","","has coordinates,has disorder","288183","2023-12-08","14:43:00",""
"7027561","9.231","0.002","11.296","0.002","10.975","0.002","90","","106.06","0.03","90","","1099.7","0.4","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C18 H21 Br N O7 Re -","- C18 H21 Br N O7 Re -","- C36 H42 Br2 N2 O14 Re2 -","2","1","","Heard, Peter J.; King, Paul M.; Bain, Alex. D.; Hazendonk, Paul; Tocher, Derek A.","A detailed NMR study of the solution stereodynamics in tricarbonylrhenium(I) halide complexes of the non-racemic chiral ligand 2,6-bis[(4R,5R)-dimethyl-1,3-dioxan-2-yl]pyridine (L1) and the molecular structure of fac-[ReBr(CO)3(L1)] †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4495","","10.1039/a904026i","","","0.71073","MoKα","","0.0508","0.0435","","0.1225","0.1082","","","","1.03","0.996","0.996","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027562","16.219","0.005","9.486","0.002","13.656","0.004","90","","99.67","0.02","90","","2071.2","1","173","2","173","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C13 H36 K N3 Si3 -","- C13 H36 K N3 Si3 -","- C52 H144 K4 N12 Si12 -","4","1","","Al-Juaid, Salih S.; Eaborn, Colin; El-Hamruni, Salima; Farook, Adam; Hitchcock, Peter B.; Hopman, Martijn; Smith, J. David; Clegg, William; Izod, Keith; O’Shaughnessy, Paul","Tris(triorganosilyl)methyl derivatives of potassium and lithium bearing dimethylamino or methoxy substituents at silicon. Crystal structures of KC(SiMe3)2(SiMe2NMe2), KC(SiMe2NMe2)3 and [LiC(SiMe3)(SiMe2OMe)2]2","Journal of the Chemical Society, Dalton Transactions","1999","","18","3267","","10.1039/a904043i","","","0.71073","MoKα","","0.0427","0.0398","","0.1316","0.1182","","","","1.196","1.198","1.198","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027563","9.4021","0.0009","14.6824","0.0014","12.7646","0.0012","90","","92.586","0.002","90","","1760.3","0.3","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H30 K N Si3 -","- C11 H30 K N Si3 -","- C44 H120 K4 N4 Si12 -","4","1","","Al-Juaid, Salih S.; Eaborn, Colin; El-Hamruni, Salima; Farook, Adam; Hitchcock, Peter B.; Hopman, Martijn; Smith, J. David; Clegg, William; Izod, Keith; O’Shaughnessy, Paul","Tris(triorganosilyl)methyl derivatives of potassium and lithium bearing dimethylamino or methoxy substituents at silicon. Crystal structures of KC(SiMe3)2(SiMe2NMe2), KC(SiMe2NMe2)3 and [LiC(SiMe3)(SiMe2OMe)2]2","Journal of the Chemical Society, Dalton Transactions","1999","","18","3267","","10.1039/a904043i","","","0.71073","MoKα","","0.0291","0.0262","","0.0751","0.0728","","","","1.076","1.086","1.086","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027564","15.569","0.003","12.603","0.002","16.848","0.002","90","","90","","90","","3305.8","0.9","173","2","173","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- C20 H54 Li2 O4 Si6 -","- C20 H54 Li2 O4 Si6 -","- C80 H216 Li8 O16 Si24 -","4","","","Al-Juaid, Salih S.; Eaborn, Colin; El-Hamruni, Salima; Farook, Adam; Hitchcock, Peter B.; Hopman, Martijn; Smith, J. David; Clegg, William; Izod, Keith; O’Shaughnessy, Paul","Tris(triorganosilyl)methyl derivatives of potassium and lithium bearing dimethylamino or methoxy substituents at silicon. Crystal structures of KC(SiMe3)2(SiMe2NMe2), KC(SiMe2NMe2)3 and [LiC(SiMe3)(SiMe2OMe)2]2","Journal of the Chemical Society, Dalton Transactions","1999","","18","3267","","10.1039/a904043i","","","0.71073","MoKα","","0.0757","0.0582","","0.1673","0.1528","","","","1.048","1.09","1.09","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027565","11.36","0.004","20.099","0.005","15.366","0.008","90","","101.96","0.04","90","","3432","2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Al{Me3SiNC(tBu)CHSiMe3}2]","","","- C25 H59 Al N2 Si4 -","- C25 H59 Al N2 Si4 -","- C100 H236 Al4 N8 Si16 -","4","1","","Bourget, Laurence; Hitchcock, Peter B.; Lappert, Michael F.","Synthesis and structures of neutral and cationic 1-azaallylaluminium methyls †","Journal of the Chemical Society, Dalton Transactions","1999","","16","2645","","10.1039/a904138i","","","0.71073","MoKα","","0.0658","0.0429","","","0.0983","0.1095","","","","","","0.976","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027566","14.451","0.0001","16.7506","0.0002","24.8794","0.0004","90","","104.176","0.001","90","","5838.99","0.13","203","2","203","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","(u-methylene)bis(5,14-dihydro-6,8,15,17-tetramethyldibenzo[b,i][1,4,8,11]- tetraazacyclotetradecinatotin(IV))diiodide.lithium iodide.dihydrate. dichloroform solvate","","- C47 H54 Cl6 I3 Li N8 O3 Sn2 -","- C47 H48 Cl6 I3 Li N8 O3 Sn2 -","- C188 H192 Cl24 I12 Li4 N32 O12 Sn8 -","4","1","","Belcher, Warwick J.; Brothers, Penelope J.; Meredith, Anthony P.; Rickard, Clifton E. F.; Ware, David C.","Tin complexes of tetramethyltetraazadibenzo[14]annulene: organometallic derivatives","Journal of the Chemical Society, Dalton Transactions","1999","","16","2833","","10.1039/a904146j","","","0.71073","MoKα","","0.089","0.0561","","","0.1201","0.1372","","","","","","1.105","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027567","10.4459","0.0003","10.647","0.0002","28.3609","0.0007","90","","90","","90","","3154.23","0.13","203","2","203","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","(5,14-dihydro-6,8,15,17-tetramethyldibenzo[b,i][1,4,8,11]- tetraazacyclotetradecinato)methyltin(IV).dichloroform solvate","","- C25 H20 Cl6 I N4 Sn -","- C25 H20 Cl6 I N4 Sn -","- C100 H80 Cl24 I4 N16 Sn4 -","4","0.5","","Belcher, Warwick J.; Brothers, Penelope J.; Meredith, Anthony P.; Rickard, Clifton E. F.; Ware, David C.","Tin complexes of tetramethyltetraazadibenzo[14]annulene: organometallic derivatives","Journal of the Chemical Society, Dalton Transactions","1999","","16","2833","","10.1039/a904146j","","","0.71073","MoKα","","0.0427","0.0345","","","0.0871","0.0919","","","","","","1.063","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027568","12.011","0.0002","17.315","0.0002","18.972","0.0003","90","","104.209","0.0006","90","","3824.91","0.1","150","0.1","150","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H28 O10 P2 Si2 W2 -","- C32 H28 O10 P2 Si2 W2 -","- C128 H112 O40 P8 Si8 W8 -","4","1","","Huy, Ngoc Hoa Tran; Ricard, Louis; Mathey, François","Synthesis and structure of 2,2′-biphosphirenes","Journal of the Chemical Society, Dalton Transactions","1999","","15","2409","","10.1039/a904150h","","","0.7107","MoKα","","0.0227","0.02","","","0.0558","0.0612","","","","","","1.169","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027569","7.3548","0.0018","8.885","0.0017","16.79","0.003","84.371","0.016","86.844","0.018","78.253","0.017","1068.3","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","bis[μ-(acetoinato)]tetraethyldialuminum","","- C16 H34 Al2 O4 -","- C16 H34 Al2 O4 -","- C32 H68 Al4 O8 -","2","1","","Lewiński, Janusz; Justyniak, Iwona; Ochal, Zbigniew; Zachara, Janusz","Dramatic structural changes of donor-functionalized alkoxides of aluminium upon replacement of the ester functionality by ketone","Journal of the Chemical Society, Dalton Transactions","1999","","17","2909","","10.1039/a904176a","","","0.71073","MoKα","","0.0761","0.0592","","","0.1628","0.1769","","","","","","1.068","","","","has coordinates,has disorder","179981","2020-10-21","18:00:00",""
"7027570","8.3986","0.0002","9.7283","0.0003","13.0248","0.0004","80.512","0.002","82.187","0.003","84.719","0.002","1037.23","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","cis-bis-(3,3,3',3'-tetraethyl-1,1'-isophthaloyl-bis(thiourea))platinum(II)","","- C18 H24 N4 O2 Pt S2 -","- C18 H24 N4 O2 Pt S2 -","- C36 H48 N8 O4 Pt2 S4 -","2","1","","Koch, Klaus R.; Bourne, Susan A.; Coetzee, Anita; Miller, Jörn","Self-assembly of 2∶2 and 3∶3 metallamacrocyclic complexes of platinum(II) with symmetrical, bipodal N′,N′,N ‴N ‴-tetraalkyl-N,N ″-phenylenedicarbonylbis(thiourea)","Journal of the Chemical Society, Dalton Transactions","1999","","18","3157","","10.1039/a904181h","","","0.7107","MoKα","","0.0222","0.0197","","","0.0494","0.0512","","","","","","1.003","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027571","17.611","0.001","23.293","0.002","26.033","0.001","90","","94.261","0.002","90","","10649.6","1.2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","cis-tris-(3,3,3',3'-tetrabutyl-1,1'-terephthaloyl-bis(thiourea))platinum(II)'","","- C82 H132 Cl6 N12 O9 Pt3 S6 -","- C82 H120 Cl6 N12 O9 Pt3 S6 -","- C328 H480 Cl24 N48 O36 Pt12 S24 -","4","1","","Koch, Klaus R.; Bourne, Susan A.; Coetzee, Anita; Miller, Jörn","Self-assembly of 2∶2 and 3∶3 metallamacrocyclic complexes of platinum(II) with symmetrical, bipodal N′,N′,N ‴N ‴-tetraalkyl-N,N ″-phenylenedicarbonylbis(thiourea)","Journal of the Chemical Society, Dalton Transactions","1999","","18","3157","","10.1039/a904181h","","","0.7107","MoKα","","0.0934","0.0617","","","0.1713","0.1972","","","","","","1.099","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027572","6.442","0.003","21.148","0.008","7.065","0.003","90","","114.63","0.04","90","","874.9","0.7","140","2","140","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","α-Di-μ-chlorotrichloro-bis-(thionylchloride)dititanium(iv)","","","- Cl12 O2 S2 Ti2 -","- Cl12 O2 S2 Ti2 -","- Cl24 O4 S4 Ti4 -","2","0.5","","Calderazzo, Fausto; D'Attoma, Michele; Marchetti, Fabio; Pampaloni, Guido; Troyanov, Sergei I.","Labile adducts of TiCl4 with thionyl chloride structurally characterized at low temperature: a comparison with the zirconium and hafnium analogues, [MCl4(SOCl2)]2","Journal of the Chemical Society, Dalton Transactions","1999","","14","2275","","10.1039/a904186i","","","0.71073","MoKα","","0.045","0.036","","0.1236","0.0883","","","","1.12","1.134","1.134","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027573","6.179","0.003","7.675","0.004","10.714","0.007","107.73","0.04","91.33","0.04","112.77","0.04","440.5","0.5","140","2","140","2","","","","","","","","4","P -1","-P 1","2","β-Di-μ-chlorotrichloro-bis-(thionylchloride)dititanium(iv)","","","- Cl12 O2 S2 Ti2 -","- Cl12 O2 S2 Ti2 -","- Cl12 O2 S2 Ti2 -","1","0.5","","Calderazzo, Fausto; D'Attoma, Michele; Marchetti, Fabio; Pampaloni, Guido; Troyanov, Sergei I.","Labile adducts of TiCl4 with thionyl chloride structurally characterized at low temperature: a comparison with the zirconium and hafnium analogues, [MCl4(SOCl2)]2","Journal of the Chemical Society, Dalton Transactions","1999","","14","2275","","10.1039/a904186i","","","0.71073","MoKα","","0.0451","0.0333","","0.111","0.0837","","","","1.114","1.119","1.119","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027574","7.516","0.003","10.077","0.002","12.274","0.004","90","","103.56","0.04","90","","903.7","0.5","220","2","220","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","χ-Di-μ-chlorotrichloro-bis-(thionylchloride)dititanium(iv)","","","- Cl12 O2 S2 Ti2 -","- Cl12 O2 S2 Ti2 -","- Cl24 O4 S4 Ti4 -","2","0.5","","Calderazzo, Fausto; D'Attoma, Michele; Marchetti, Fabio; Pampaloni, Guido; Troyanov, Sergei I.","Labile adducts of TiCl4 with thionyl chloride structurally characterized at low temperature: a comparison with the zirconium and hafnium analogues, [MCl4(SOCl2)]2","Journal of the Chemical Society, Dalton Transactions","1999","","14","2275","","10.1039/a904186i","","","0.71073","MoKα","","0.0704","0.0444","","0.106","0.0701","","","","0.922","0.988","0.988","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027575","6.6876","0.0005","21.581","0.004","7.2813","0.0004","90","","114.654","0.005","90","","955.1","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Di-μ-chlorotrichloro-bis-(thionyl chloride)dihafnium(iv)","","- Cl12 Hf2 O2 S2 -","- Cl12 Hf2 O2 S2 -","- Cl24 Hf4 O4 S4 -","2","0.5","","Calderazzo, Fausto; D'Attoma, Michele; Marchetti, Fabio; Pampaloni, Guido; Troyanov, Sergei I.","Labile adducts of TiCl4 with thionyl chloride structurally characterized at low temperature: a comparison with the zirconium and hafnium analogues, [MCl4(SOCl2)]2","Journal of the Chemical Society, Dalton Transactions","1999","","14","2275","","10.1039/a904186i","","","0.71073","MoKα","","0.0648","0.0428","","","0.0998","0.1094","","","","","","1.072","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027576","7.419","0.003","11.048","0.003","11.21","0.007","93.33","0.03","101.51","0.03","92.61","0.03","897.3","0.7","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C14 H36 Cl8 N2 Na2 O6 Ru2 S5 -","- C14 H16 Cl8 N2 Na2 O6 Ru2 S5 -","- C14 H16 Cl8 N2 Na2 O6 Ru2 S5 -","1","0.5","","Iengo, Elisabetta; Mestroni, Giovanni; Geremia, Silvano; Calligaris, Mario; Alessio, Enzo","Novel ruthenium(III) dimers Na2[{trans-RuCl4(Me2SO-S )}2(μ-L)] and [{mer,cis-RuCl3(Me2SO-S )(Me2SO-O)}2(μ-L)] (L = bridging heterocyclic N-donor ligand) closely related to the antimetastatic complex Na[trans-RuCl4(Me2SO-S )(Him)] †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3361","","10.1039/a904264d","","","0.71073","MoKα","","0.288","0.1129","","","0.2194","0.2786","","","","","","1.068","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027577","11.371","0.001","14.613","0.001","22.578","0.002","90","","96.415","0.008","90","","3728.2","0.5","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C14 H36 Cl8 N2 Na2 O6 Ru2 S5 -","- C14 H36 Cl8 N2 Na2 O6 Ru2 S5 -","- C56 H144 Cl32 N8 Na8 O24 Ru8 S20 -","4","1","","Iengo, Elisabetta; Mestroni, Giovanni; Geremia, Silvano; Calligaris, Mario; Alessio, Enzo","Novel ruthenium(III) dimers Na2[{trans-RuCl4(Me2SO-S )}2(μ-L)] and [{mer,cis-RuCl3(Me2SO-S )(Me2SO-O)}2(μ-L)] (L = bridging heterocyclic N-donor ligand) closely related to the antimetastatic complex Na[trans-RuCl4(Me2SO-S )(Him)] †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3361","","10.1039/a904264d","","","0.71073","MoKα","","0.0753","0.0378","","","0.0866","0.0978","","","","","","1.025","","","","has coordinates,has disorder","179981","2020-10-21","18:00:00",""
"7027578","30.363","0.003","7.561","0.001","16.162","0.006","90","","119","0.02","90","","3245.2","1.5","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C14 H31.2 Cl8 N2 Na2 O7.6 Ru2 S2 -","- C14 H20 Cl8 N2 Na2 O7.594 Ru2 S2 -","- C56 H80 Cl32 N8 Na8 O30.376 Ru8 S8 -","4","0.5","","Iengo, Elisabetta; Mestroni, Giovanni; Geremia, Silvano; Calligaris, Mario; Alessio, Enzo","Novel ruthenium(III) dimers Na2[{trans-RuCl4(Me2SO-S )}2(μ-L)] and [{mer,cis-RuCl3(Me2SO-S )(Me2SO-O)}2(μ-L)] (L = bridging heterocyclic N-donor ligand) closely related to the antimetastatic complex Na[trans-RuCl4(Me2SO-S )(Him)] †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3361","","10.1039/a904264d","","","0.71073","MoKα","","0.0806","0.0435","","","0.0985","0.1109","","","","","","1.005","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027579","10.77","0.003","14.526","0.003","11.764","0.003","90","","100.07","0.01","90","","1812.1","0.8","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C14 H30 Cl12 N2 O4 Ru2 S4 -","- C14 H30 Cl12 N2 O4 Ru2 S4 -","- C28 H60 Cl24 N4 O8 Ru4 S8 -","2","0.5","","Iengo, Elisabetta; Mestroni, Giovanni; Geremia, Silvano; Calligaris, Mario; Alessio, Enzo","Novel ruthenium(III) dimers Na2[{trans-RuCl4(Me2SO-S )}2(μ-L)] and [{mer,cis-RuCl3(Me2SO-S )(Me2SO-O)}2(μ-L)] (L = bridging heterocyclic N-donor ligand) closely related to the antimetastatic complex Na[trans-RuCl4(Me2SO-S )(Him)] †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3361","","10.1039/a904264d","","","0.711","MoKα","","0.0627","0.0363","","","0.0796","0.0877","","","","","","1.034","","","","has coordinates,has disorder","179981","2020-10-21","18:00:00",""
"7027580","13.335","0.006","9.672","0.003","21.022","0.005","90","","102.87","0.03","90","","2643.2","1.6","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 I6 P S -","- C18 H15 I6 P S -","- C72 H60 I24 P4 S4 -","4","1","","Arca, Massimiliano; Demartin, Francesco; Devillanova, Francesco A.; Garau, Alessandra; Isaia, Francesco; Lippolis, Vito; Verani, Gaetano","A new assembly of diiodine molecules at the triphenylphosphine sulfide template †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3069","","10.1039/a904271g","","","0.71073","MoKα","","0.063","0.036","","","0.049","","","","1.681","1.904","1.904","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027581","11.555","0.005","12.087","0.004","13.347","0.004","81.7","0.03","72.34","0.03","83.89","0.03","1753.8","1.1","298.2","","298.2","","","","","","","","","6","P -1","-P 1","2","","","","- C35 H20 Cl7 N3 O3 Ru -","- C35 H20 Cl7 N3 O3 Ru -","- C70 H40 Cl14 N6 O6 Ru2 -","2","1","","Zhou, Xiang-Ge; Huang, Jie-Sheng; Ko, Po-Hung; Cheung, Kung-Kai; Che, Chi-Ming","Titanium and ruthenium binaphthyl Schiff base complexes as catalysts for asymmetric trimethylsilylcyanation of aldehydes","Journal of the Chemical Society, Dalton Transactions","1999","","18","3303","","10.1039/a904330f","","","0.7107","MoKalpha","","","0.0397","","","0.0498","","","","","1.845","1.845","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027582","17.938","0.005","17.96","0.005","9.335","0.005","78.86","0.03","74.24","0.03","78.84","0.02","2808","1.9","161","","161","","","","","","","","","4","P -1","-P 1","2","","","","- C40 H90 Nb4 O20 -","- C40 H90 Nb4 O20 -","- C80 H180 Nb8 O40 -","2","1","","Hubert-Pfalzgraf, Liliane G.; Abada, Valérie; Vaissermann, Jacqueline","Hydroxyethylmethacrylate as a source of ethyleneglycolate ligands. Synthesis and characterization of Nb4(μ,η1,η2-OC2H4O)2(μ3,η1,η2-OC2H4O)2(μ-OC2H4O)(OPri)10","Journal of the Chemical Society, Dalton Transactions","1999","","15","2407","","10.1039/a904344f","","","0.71069","MoKα","","","0.0692","","","0.0801","","","","","1.1257","1.1257","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027583","10.333","0.004","10.733","0.008","14.149","0.007","110.88","0.06","90.08","0.04","99.91","0.04","1440.9","1.5","293","2","293","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C63 H66 N2 O6 Si4 W -","- C63 H58 N2 O6 Si4 W -","- C63 H58 N2 O6 Si4 W -","1","0.5","","King, Lawrence; Motevalli, Majid; Sullivan, Alice C.","High oxidation state chromium, molybdenum and tungsten imido metallasiloxanes","Journal of the Chemical Society, Dalton Transactions","1999","","18","3225","","10.1039/a904429i","","","0.71073","MoKα","","0.0696","0.0638","","","0.1566","0.1619","","","","","","1.258","","","","has coordinates","209360","2020-10-21","18:00:00",""
"7027584","13.655","0.009","14.524","0.01","16.072","0.012","102.67","0.08","87.75","0.06","107.62","0.06","2963","4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C62 H59 Mo N3 O6 Si4 -","- C62 H59 Mo N3 O6 Si4 -","- C124 H118 Mo2 N6 O12 Si8 -","2","1","","King, Lawrence; Motevalli, Majid; Sullivan, Alice C.","High oxidation state chromium, molybdenum and tungsten imido metallasiloxanes","Journal of the Chemical Society, Dalton Transactions","1999","","18","3225","","10.1039/a904429i","","","0.71073","MoKα","","0.2446","0.113","","","0.2557","0.3015","","","","","","1.02","","","","has coordinates,has disorder","179981","2020-10-21","18:00:00",""
"7027585","13.931","0.007","15.948","0.009","16.469","0.008","68.08","0.06","111.08","0.05","89.96","0.07","3129","4","293","2","293","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C63 H66 Cr2 N2 O8 Si4 -","- C63 H66 Cr2 N2 O8 Si4 -","- C126 H132 Cr4 N4 O16 Si8 -","2","1","","King, Lawrence; Motevalli, Majid; Sullivan, Alice C.","High oxidation state chromium, molybdenum and tungsten imido metallasiloxanes","Journal of the Chemical Society, Dalton Transactions","1999","","18","3225","","10.1039/a904429i","","","0.71073","MoKα","","0.2487","0.0716","","","0.1543","0.2077","","","","","","0.946","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027586","5.988","0.002","16.777","0.003","23.539","0.003","90","","96.29","0.02","90","","2350.5","0.9","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C16.5 H9 Cl Co F4 I2 N2 S2 -","- C16.5 H9 Cl Co F4 I2 N2 S2 -","- C66 H36 Cl4 Co4 F16 I8 N8 S8 -","4","1","","Goodgame, David M. L.; Grachvogel, David A.; Holland, Stephanie; Long, Nicholas J.; White, Andrew J. P.; Williams, David J.","Diversity of chain, interwoven and network structures formed by metal complexes with 2,3,5,6-tetrafluoro-1,4-bis(4-pyridyl-sulfenyl)benzene †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3473","","10.1039/a904453a","","","0.71073","MoKα","","0.0867","0.0559","","0.1697","0.1354","","","","1.04","1.097","1.097","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027587","15.1019","0.0009","7.7834","0.0008","18.025","0.003","90","","101.445","0.007","90","","2076.6","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C38 H28 F8 Mn N6 O2 S6 -","- C38 H28 F8 Mn N6 O2 S6 -","- C76 H56 F16 Mn2 N12 O4 S12 -","2","0.5","","Goodgame, David M. L.; Grachvogel, David A.; Holland, Stephanie; Long, Nicholas J.; White, Andrew J. P.; Williams, David J.","Diversity of chain, interwoven and network structures formed by metal complexes with 2,3,5,6-tetrafluoro-1,4-bis(4-pyridyl-sulfenyl)benzene †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3473","","10.1039/a904453a","","","1.54178","CuKα","","0.1036","0.0697","","0.1966","0.1708","","","","1.075","1.153","1.153","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027588","14.7441","0.001","9.6438","0.0013","27.253","0.002","90","","90","","90","","3875.1","0.7","293","2","293","2","","","","","","","","8","P n a 21","P 2c -2n","33","","","","- C36 H28 Br2 F8 Mn N4 O2 S4 -","- C36 H26 Br2 F8 Mn N4 O2 S4 -","- C144 H104 Br8 F32 Mn4 N16 O8 S16 -","4","1","","Goodgame, David M. L.; Grachvogel, David A.; Holland, Stephanie; Long, Nicholas J.; White, Andrew J. P.; Williams, David J.","Diversity of chain, interwoven and network structures formed by metal complexes with 2,3,5,6-tetrafluoro-1,4-bis(4-pyridyl-sulfenyl)benzene †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3473","","10.1039/a904453a","","","1.54178","CuKα","","0.0832","0.0577","","0.1481","0.1306","","","","1.052","1.096","1.096","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027589","28.714","0.003","8.2439","0.0013","28.736","0.003","90","","96.633","0.009","90","","6756.7","1.5","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C25 H14 Cd Cl2 F6 N5 O6 S3 -","- C25 H12 Cd Cl2 F6 N5 O6 S3 -","- C200 H96 Cd8 Cl16 F48 N40 O48 S24 -","8","1","","Goodgame, David M. L.; Grachvogel, David A.; Holland, Stephanie; Long, Nicholas J.; White, Andrew J. P.; Williams, David J.","Diversity of chain, interwoven and network structures formed by metal complexes with 2,3,5,6-tetrafluoro-1,4-bis(4-pyridyl-sulfenyl)benzene †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3473","","10.1039/a904453a","","","1.54178","CuKα","","0.0761","0.0521","","0.1406","0.124","","","","1.036","1.073","1.073","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027590","8.776","0.003","11.218","0.002","14.186","0.003","76.904","0.014","79.31","0.03","79.08","0.03","1320.7","0.6","168","2","168","2","","","","","","","","7","P -1","-P 1","2","","trans(N)-bis(2-aminoisobutyrato)(2,2'-bipyridine)cobalt(III) perchlorate sodium perchlorate","","- C18 H25 Cl2 Co N4 Na O12.5 -","- C18 H25 Cl2 Co N4 Na O12.5 -","- C36 H50 Cl4 Co2 N8 Na2 O25 -","2","1","","Hartshorn, Richard M.; Telfer, Shane G.","Formation of trans(N)-bis(amino acidato)(2,2′-bipyridine)cobalt(III) complexes following the UV irradiation of amino acidatobis(2,2′bipyridine)cobalt(III) complexes in dimethyl sulfoxide","Journal of the Chemical Society, Dalton Transactions","1999","","18","3217","","10.1039/a904486h","","","0.71073","MoKα","","0.1596","0.0704","","","0.1096","0.1371","","","","","","1.01","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027591","10.556","0.007","10.345","0.007","18.62","0.03","90","","99.06","0.08","90","","2008","4","144","2","144","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","trans(N)-bis(alaninato)(2,2'-bipyridine)cobalt(III) perchlorate monohydrate","","- C16 H22 Cl Co N4 O9 -","- C16 H22 Cl Co N4 O9 -","- C64 H88 Cl4 Co4 N16 O36 -","4","1","","Hartshorn, Richard M.; Telfer, Shane G.","Formation of trans(N)-bis(amino acidato)(2,2′-bipyridine)cobalt(III) complexes following the UV irradiation of amino acidatobis(2,2′bipyridine)cobalt(III) complexes in dimethyl sulfoxide","Journal of the Chemical Society, Dalton Transactions","1999","","18","3217","","10.1039/a904486h","","","0.71073","MoKα","","0.1134","0.0595","","","0.1116","0.13","","","","","","1.035","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027592","11.776","0.003","12.172","0.002","9.949","0.001","106.28","0.01","108.82","0.01","80.96","0.02","1292.2","0.4","293.2","","293.2","","","","","","","","-","7","P -1","-P 1","2","","","","- C23 H24 Fe2 N2 O P2 S3 -","- C23 H24 Fe2 N2 O P2 S3 -","- C46 H48 Fe4 N4 O2 P4 S6 -","2","1","","St John Foreman, Mark; Mortimer, Roger J.; Slawin, Alexandra M. Z.; Woollins, J. Derek","Reactions of dithiadiphosphetane disulfides with organonitrogen compounds †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3419","","10.1039/a904592i","","","1.5418","CuKα","","","0.0421","","","","0.0393","","","","","","2.084","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027593","7.347","0.002","14.262","0.003","25.66","0.002","90","0.01","95.75","0.01","90","0.02","2675.2","0.9","293.2","","293.2","","","","","","","","-","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H25 Fe2 N P2 S3 -","- C27 H25 Fe2 N P2 S3 -","- C108 H100 Fe8 N4 P8 S12 -","4","1","","St John Foreman, Mark; Mortimer, Roger J.; Slawin, Alexandra M. Z.; Woollins, J. Derek","Reactions of dithiadiphosphetane disulfides with organonitrogen compounds †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3419","","10.1039/a904592i","","","1.5418","CuKα","","0.0596","0.0596","","0.0582","","0.0582","","","2.316","","","2.316","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027594","9.568","0.002","12.6641","0.0009","16.383","0.002","90.007","0.009","92.24","0.01","90.01","0.01","1983.6","0.5","293.2","","293.2","","","","","","","","-","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H21 Fe N2 P S -","- C22 H21 Fe N2 P S -","- C88 H84 Fe4 N8 P4 S4 -","4","1","","St John Foreman, Mark; Mortimer, Roger J.; Slawin, Alexandra M. Z.; Woollins, J. Derek","Reactions of dithiadiphosphetane disulfides with organonitrogen compounds †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3419","","10.1039/a904592i","","","1.5418","CuKα","","","0.0405","","","","0.0345","","","","","","1.984","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027595","12.2871","0.0017","10.5692","0.0012","25.1","0.004","90","","95.266","0.017","90","","3245.8","0.8","160","2","160","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C30 H25 F12 N7 P2 Ru -","- C30 H25 F12 N7 P2 Ru -","- C120 H100 F48 N28 P8 Ru4 -","4","2","","Aït-Haddou, Hassan; Bejan, Elena; Daran, Jean-Claude; Balavoine, Gilbert G. A.; Berruyer-Penaud, Florence; Bonazzola, Lydia; Smaoui-Chaabouni, Henda; Amouyal, Edmond","New ruthenium(II) heteroleptic complexes containing the 4-(2-pyridyl)pyrimidine ligand with amine and amino acid substituents","Journal of the Chemical Society, Dalton Transactions","1999","","17","3095","","10.1039/a904617h","","","0.71073","MoKα","","0.0412","0.0348","","","0.0844","0.0876","","","","","","1.022","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027596","10.562","0.005","18.902","0.002","11.236","","90","0.03","113.73","","90","","2053.5","1","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[V2(H)2{SiMe3N(CH2CH2NSiMe3)2}2]","","","- C26 H72 N6 Si6 V2 -","- C26 H72 N6 Si6 V2 -","- C52 H144 N12 Si12 V4 -","2","0.5","","Clancy, Gerald P.; Clark, Howard C. S.; Clentsmith, Guy K. B.; Cloke, F. Geoffrey N.; Hitchcock, Peter B.","Vanadium(III) complexes incorporating the silylamino(disilylamido) ligand [(Me3Si)N{CH2CH2N(SiMe3)}2]2− [N{N″}2]2−. Synthesis and crystal structure of the dimeric, non-metallocene vanadium(III) hydride [{V(N{N″}2)}2(μ-H)2]","Journal of the Chemical Society, Dalton Transactions","1999","","19","3345","","10.1039/a904627e","","","0.71073","MoKα","","0.0698","0.048","","0.1265","0.1125","","","","0.998","1.016","1.016","","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027597","9.4724","0.0019","24.866","0.005","14.625","0.003","90","","91.58","0.03","90","","3443.5","1.2","133","2","133","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C27 H50 Cl3 In Li N O3 Si -","- C27 H50 Cl3 In Li N O3 Si -","- C108 H200 Cl12 In4 Li4 N4 O12 Si4 -","4","1","","Prust, Jörg; Müller, Peter; Rennekamp, Carsten; Roesky, Herbert W.; Usón, Isabel","New approach to dichloroindium amides","Journal of the Chemical Society, Dalton Transactions","1999","","14","2265","","10.1039/a904655k","","","0.71073","MoKα","","0.0316","0.0262","","","0.0627","0.0681","","","","","","1.161","","","","has coordinates,has disorder","179981","2020-10-21","18:00:00",""
"7027598","9.495","0.002","9.5589","0.0008","9.4384","0.0013","90","","101.74","0.0003","90","","838.7","0.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- Al2 H4 K1.5 O10.75 P2 -","- Al2 K1.5 O10.74 P2 -","- Al8 K6 O42.96 P8 -","4","1","","Devi, R. Nandini; Vidyasagar, K.","Hydrothermal synthesis and characterization of new aluminophosphates with AlPO4-15 framework: A1.5[Al2P2O8.5(OH)0.5(H2O)]· xH2O (A = K or Rb) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3841","","10.1039/a904704b","","","1.54163","CuKα","","0.0572","0.0479","","0.1353","0.1252","","","","1.127","1.133","1.133","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027599","11.5184","0.0006","11.5184","0.0006","19.7666","0.0016","90","","90","","90","","2622.5","0.3","293","2","293","2","","","","","","","","6","P -4 21 c","P -4 2n","114","","","","- C28 H26 Cu O2 P S2 -","- C28 H26 Cu O2 P S2 -","- C112 H104 Cu4 O8 P4 S8 -","4","0.5","","Sampanthar, Jeyagowry T.; Vittal, Jagadese J.; Dean, Philip A. W.","Chemistry of thiocarboxylates: syntheses and characterization of silver and copper thiocarboxylate complexes, and the structures of [Ph4P][M(SC{O}Me)2] (M = Cu or Ag) and [Et3NH][Ag(SC{O}Ph)2]","Journal of the Chemical Society, Dalton Transactions","1999","","18","3153","","10.1039/a904718b","","","0.71073","MoKα","","0.1796","0.1072","","","0.1439","0.1654","","","","","","1.195","","","","has coordinates","179981","2020-10-21","18:00:00",""
"7027600","11.7596","0.0001","11.7596","0.0001","19.1859","0.0003","90","","90","","90","","2653.18","0.05","293","2","293","2","","","","","","","see text","6","P -4 21 c","P -4 2n","114","","","","- C28 H26 Ag O2 P S2 -","- C28 H26 Ag O2 P S2 -","- C112 H104 Ag4 O8 P4 S8 -","4","0.5","","Sampanthar, Jeyagowry T.; Vittal, Jagadese J.; Dean, Philip A. W.","Chemistry of thiocarboxylates: syntheses and characterization of silver and copper thiocarboxylate complexes, and the structures of [Ph4P][M(SC{O}Me)2] (M = Cu or Ag) and [Et3NH][Ag(SC{O}Ph)2]","Journal of the Chemical Society, Dalton Transactions","1999","","18","3153","","10.1039/a904718b","","","0.71073","MoKα","","0.0455","0.0332","","0.0851","0.0799","","","","1.061","1.11","1.11","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027601","11.1129","0.0002","19.9831","0.0004","10.7747","0.0001","90","","114.225","0.001","90","","2182.04","0.06","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 Ag N O2 S2 -","- C20 H26 Ag N O2 S2 -","- C80 H104 Ag4 N4 O8 S8 -","4","1","","Sampanthar, Jeyagowry T.; Vittal, Jagadese J.; Dean, Philip A. W.","Chemistry of thiocarboxylates: syntheses and characterization of silver and copper thiocarboxylate complexes, and the structures of [Ph4P][M(SC{O}Me)2] (M = Cu or Ag) and [Et3NH][Ag(SC{O}Ph)2]","Journal of the Chemical Society, Dalton Transactions","1999","","18","3153","","10.1039/a904718b","","","0.71073","MoKα","","0.091","0.0466","","0.119","0.0922","","","","1.023","1.141","1.141","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027602","19.66","0.01","20.414","0.007","10.185","0.004","90","","90","","90","","4088","3","123","","123","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C48 H54 Li3 N3 -","- C48 H54 Li3 N3 -","- C192 H216 Li12 N12 -","4","1","","Armstrong, David R.; Henderson, Kenneth W.; Kennedy, Alan R.; Kerr, William J.; Mair, Francis S.; Moir, Jennifer H.; Moran, Paul H.; Snaith, Ronald","Structural studies of the chiral lithium amides [{PhC(H)Me}2NLi] and [PhCH2{PhC(H)Me}NLi·THF] derived from α-methylbenzylamine †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4063","","10.1039/a904725e","","","0.7107","MoKalpha","","0.1116","0.0703","","0.0864","0.0754","","","","","1.913","1.913","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027603","16.55","0.005","19.729","0.005","10.455","0.0013","90","","90","","90","","3413.7","1.4","123","2","123","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C38 H48 Li2 N2 O2 -","- C38 H47 Li2 N2 O2 -","- C152 H188 Li8 N8 O8 -","4","1","","Armstrong, David R.; Henderson, Kenneth W.; Kennedy, Alan R.; Kerr, William J.; Mair, Francis S.; Moir, Jennifer H.; Moran, Paul H.; Snaith, Ronald","Structural studies of the chiral lithium amides [{PhC(H)Me}2NLi] and [PhCH2{PhC(H)Me}NLi·THF] derived from α-methylbenzylamine †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4063","","10.1039/a904725e","","","0.71069","MoKα","","0.1747","0.0654","","","0.1711","0.2136","","","","","","1.045","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027604","11.135","0.002","19.35","0.004","12.405","0.002","90","","98.48","0.03","90","","2643.6","0.9","298","","298","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H32 Fe N4 O6.5 -","- C24 H27 Fe N4 O6.5 -","- C96 H108 Fe4 N16 O26 -","4","1","","Henderson, William; Koh, Lip L.; Ranford, John D.; Robinson, Ward T.; Svensson, Jan O.; Vittal, Jagadese J.; Wang, Yu M.; Xu, Yan","Clusters in bis-tridentate tethered domains of an iron chelating drug †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3341","","10.1039/a904728j","","","0.71073","MoKα","","0.1164","0.0651","","","0.0639","0.0758","","","","","","1.9","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027605","11.9265","0.0003","13.6996","0.0003","18.6798","0.0002","72.145","0.001","85.219","0.001","87.09","0.001","2893.93","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C44 H56 Cl2 Fe2 N12 O14 -","- C44 H52 Cl2 Fe2 N12 O14 -","- C88 H104 Cl4 Fe4 N24 O28 -","2","1","","Henderson, William; Koh, Lip L.; Ranford, John D.; Robinson, Ward T.; Svensson, Jan O.; Vittal, Jagadese J.; Wang, Yu M.; Xu, Yan","Clusters in bis-tridentate tethered domains of an iron chelating drug †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3341","","10.1039/a904728j","","","0.71073","MoKα","","0.1308","0.0889","","","0.2311","0.2608","","","","","","1.057","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027606","11.26","0.001","22.998","0.008","12.0024","0.0009","90","","91.369","0.007","90","","3107.2","1.1","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C36 H43 Cl Fe N P Ru -","- C36 H43 Cl Fe N P Ru -","- C144 H172 Cl4 Fe4 N4 P4 Ru4 -","4","1","","Jalón, Félix A.; López-Agenjo, Ana; Manzano, Blanca R.; Moreno-Lara, Montserrat; Rodríguez, Ana; Sturm, Thomas; Weissensteiner, Walter","A comparative study of the synthesis, stereochemical characterization and reactivity of new chiral ruthenium(II) complexes with (aminoferrocenyl)phosphine ligands. X-Ray crystal structure of RuClH(cod)(PTFA) and Ru(η3-C8H13)Cl(PPFA) [PTFA = 1-diphenylphosphino-2,3-endo-(α-dimethylamino)tetramethyleneferrocene and PPFA = 2-(1-dimethylaminoethyl)-1-diphenylphosphinoferrocene] †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4031","","10.1039/a904832d","","","0.7107","MoKα","","0.0425","0.026","","0.0807","0.0608","","","","1.011","0.874","0.874","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027607","9.477","0.005","16.102","0.001","20.281","0.003","90","","103.57","0.02","90","","3008.5","1.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H41 Cl Fe N P Ru -","- C34 H41 Cl Fe N P Ru -","- C136 H164 Cl4 Fe4 N4 P4 Ru4 -","4","1","","Jalón, Félix A.; López-Agenjo, Ana; Manzano, Blanca R.; Moreno-Lara, Montserrat; Rodríguez, Ana; Sturm, Thomas; Weissensteiner, Walter","A comparative study of the synthesis, stereochemical characterization and reactivity of new chiral ruthenium(II) complexes with (aminoferrocenyl)phosphine ligands. X-Ray crystal structure of RuClH(cod)(PTFA) and Ru(η3-C8H13)Cl(PPFA) [PTFA = 1-diphenylphosphino-2,3-endo-(α-dimethylamino)tetramethyleneferrocene and PPFA = 2-(1-dimethylaminoethyl)-1-diphenylphosphinoferrocene] †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4031","","10.1039/a904832d","","","0.7107","MoKα","","0.0432","0.0248","","0.0835","0.0615","","","","0.8","0.687","0.687","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027608","13.6607","0.0008","17.9727","0.0016","23.6191","0.0016","90","","90","","90","","5799","0.7","223","2","223","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C26 H42 N5 O6 V -","- C26 H42 N5 O6 V -","- C208 H336 N40 O48 V8 -","8","1","","Süss-Fink, Georg; Stanislas, Sandrine; Shul’pin, Georgiy B.; Nizova, Galina V.; Stoeckli-Evans, Helen; Neels, Antonia; Bobillier, Christiane; Claude, Saturnin","Oxidative functionalisation of alkanes: synthesis, molecular structure and catalytic implications of anionic vanadium(V) oxo and peroxo complexes containing bidentate N,O ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","18","3169","","10.1039/a904844h","","","0.71073","MoKα","","0.0641","0.0333","","","0.0682","0.0736","","","","","","0.839","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027609","11.1906","0.0008","18.1294","0.0016","16.5682","0.001","90","","105.831","0.007","90","","3233.8","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H48 N3 O6 V -","- C30 H48 N3 O6 V -","- C120 H192 N12 O24 V4 -","4","1","","Süss-Fink, Georg; Stanislas, Sandrine; Shul’pin, Georgiy B.; Nizova, Galina V.; Stoeckli-Evans, Helen; Neels, Antonia; Bobillier, Christiane; Claude, Saturnin","Oxidative functionalisation of alkanes: synthesis, molecular structure and catalytic implications of anionic vanadium(V) oxo and peroxo complexes containing bidentate N,O ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","18","3169","","10.1039/a904844h","","","0.71073","MoKα","","0.0577","0.0383","","","0.0972","0.1028","","","","","","0.952","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027610","12.1752","0.0007","9.2884","0.0005","14.3963","0.0009","90","","111.386","0.006","90","","1515.95","0.16","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H14 N5 O9 V -","- C10 H14 N5 O9 V -","- C40 H56 N20 O36 V4 -","4","1","","Süss-Fink, Georg; Stanislas, Sandrine; Shul’pin, Georgiy B.; Nizova, Galina V.; Stoeckli-Evans, Helen; Neels, Antonia; Bobillier, Christiane; Claude, Saturnin","Oxidative functionalisation of alkanes: synthesis, molecular structure and catalytic implications of anionic vanadium(V) oxo and peroxo complexes containing bidentate N,O ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","18","3169","","10.1039/a904844h","","","0.71073","MoKα","","0.0339","0.026","","","0.0706","0.0731","","","","","","1.036","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027611","22.0685","0.0008","22.0685","0.0008","17.4908","0.0015","90","","90","","90","","8518.3","0.9","183","2","183","2","","","","","","","","6","P 4/n n c :2","-P 4a 2bc","126","","","","- C148 H192 Cl8 N16 O24 Pd8 -","- C148 H112 Cl8 N16 O24 Pd8 -","- C296 H224 Cl16 N32 O48 Pd16 -","2","0.125","","Colquhoun, Howard M.; Fairman, Richard A.; Tootell, Paula; Williams, David J.","An octanuclear pyromellitimidato(2−) palladium complex: coordinative assembly of a molecular box","Journal of the Chemical Society, Dalton Transactions","1999","","16","2651","","10.1039/a904857j","","","1.54178","CuKα","","0.0873","0.0501","","0.1277","0.108","","","","1.032","1.131","1.131","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027612","12.538","0.001","21.802","0.002","13.969","0.001","90","","106.38","0.01","90","","3663.5","0.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C31 H25 Cl3 N6 O12 Pt2 S -","- C31 H25 Cl3 N6 O12 Pt2 S -","- C124 H100 Cl12 N24 O48 Pt8 S4 -","4","1","","Annibale, Giuliano; Bergamini, Paola; Bertolasi, Valerio; Cattabriga, Michela; Lazzaro, Antonio; Marchi, Andrea; Vertuani, Gianni","Platinum assisted cyclization of S-methyl 3-acyl-2-methyldithiocarbazates under mild conditions. Crystal structure of [Pt2(μ-SMe)(terpy)2][ClO4]3 †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3877","","10.1039/a904859f","","","0.71069","MoKα","","0.1131","0.0509","","","0.1047","0.1389","","","","","","1.124","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027613","13.594","0.003","17.951","0.004","14.171","0.003","90","","114.445","0.01","90","","3148.1","1.2","293","2","293","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C24 H28 Cl F6 N4 O2 P Ru S -","- C24 H22 Cl F6 N4 O2 P Ru S -","- C96 H88 Cl4 F24 N16 O8 P4 Ru4 S4 -","4","1","","Hesek, Dusan; Inoue, Yoshihisa; Everitt, Simon R. L.; Ishida, Hitoshi; Kunieda, Mieko; Drew, Michael G. B.","Preparation and structural elucidation of novel cis ruthenium(II) bis(bipyridine) sulfoxide complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3701","","10.1039/a904862f","","","0.71069","MoKα","","0.0532","0.0434","","","0.1269","0.1356","","","","","","1.062","","","","has coordinates,has disorder","179982","2020-10-21","18:00:00",""
"7027614","8.171","0.0017","10.372","0.003","16.133","0.003","79.83","0.02","76.82","0.018","72.49","0.015","1261","0.5","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C22 H26 Cl I N4 O3 Ru S -","- C22 H22 Cl I N4 O3 Ru S -","- C44 H44 Cl2 I2 N8 O6 Ru2 S2 -","2","1","","Hesek, Dusan; Inoue, Yoshihisa; Everitt, Simon R. L.; Ishida, Hitoshi; Kunieda, Mieko; Drew, Michael G. B.","Preparation and structural elucidation of novel cis ruthenium(II) bis(bipyridine) sulfoxide complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3701","","10.1039/a904862f","","","0.71073","MoKα","","0.0452","0.0387","","","0.1022","0.1115","","","","","","1.085","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027615","9.201","0.002","12.02","0.003","21.405","0.005","79.77","0.02","84.24","0.03","72.31","0.02","2216.8","0.9","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C42 H30 Cl2 Fe O7 P2 Ru3 Se2 -","- C42 H28 Cl2 Fe O7 P2 Ru3 Se2 -","- C84 H56 Cl4 Fe2 O14 P4 Ru6 Se4 -","2","1","","Cauzzi, Daniele; Graiff, Claudia; Massera, Chiara; Predieri, Giovanni; Tiripicchio, Antonio; Acquotti, Domenico","Chelating versus bridging behaviour and NMR fluxionality of dppf in the nido clusters [M3Se2(CO)7(dppf )] [M = Fe or Ru, dppf = Fe(η5-C5H4PPh2)2]. Crystal structure of the chelated ruthenium derivative †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3515","","10.1039/a904866i","","","0.71069","MoKa","","0.1194","0.0425","","0.1449","0.1012","","","","0.561","0.68","0.68","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027616","13.55","0.005","10.891","0.004","24.876","0.006","90","","102.31","0.02","90","","3587","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H24 O7 P2 Ru3 Se2 -","- C33 H24 O7 P2 Ru3 Se2 -","- C132 H96 O28 P8 Ru12 Se8 -","4","1","","Cauzzi, Daniele; Graiff, Claudia; Massera, Chiara; Predieri, Giovanni; Tiripicchio, Antonio; Acquotti, Domenico","Chelating versus bridging behaviour and NMR fluxionality of dppf in the nido clusters [M3Se2(CO)7(dppf )] [M = Fe or Ru, dppf = Fe(η5-C5H4PPh2)2]. Crystal structure of the chelated ruthenium derivative †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3515","","10.1039/a904866i","","","0.71069","MoKα","","0.2953","0.0543","","","0.137","0.2664","","","","","","1.195","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027617","12.31","0.016","12.889","0.018","14.93","0.014","106.56","0.06","93.57","0.07","116.98","0.06","1972","5","203.15","","203","2","","","","","","","","6","P -1","-P 1","2","","carbonato(O,O')bis(triphenylphophine)platinum(II)","","- C39 H32 Cl6 O3 P2 Pt -","- C39 H32 Cl6 O3 P2 Pt -","- C78 H64 Cl12 O6 P4 Pt2 -","2","1","","Abram, Ulrich; Dell’Amico, Daniela Belli; Calderazzo, Fausto; Marchetti, Lorella; Strähle, Joachim","N,N-Diethylcarbamato tertiary phosphine complexes as precursors to carbonato and carbamoyl platinum(II) derivatives ‡","Journal of the Chemical Society, Dalton Transactions","1999","","22","4093","","10.1039/a904868e","","","0.7093","Mokα","","0.0287","0.0258","","0.0693","0.0673","","","","0.934","0.934","0.934","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027618","10.739","0.003","12.428","0.005","17.982","0.003","96.75","0.02","91.82","0.02","95.62","0.03","2369.6","1.2","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","trans-chloro(N,N-diethylcarbamoyl)bis(triphenilphosphine)platinum(II)","","- C55 H56 Cl N O P2 Pt -","- C55 H56 Cl N O P2 Pt -","- C110 H112 Cl2 N2 O2 P4 Pt2 -","2","1","","Abram, Ulrich; Dell’Amico, Daniela Belli; Calderazzo, Fausto; Marchetti, Lorella; Strähle, Joachim","N,N-Diethylcarbamato tertiary phosphine complexes as precursors to carbonato and carbamoyl platinum(II) derivatives ‡","Journal of the Chemical Society, Dalton Transactions","1999","","22","4093","","10.1039/a904868e","","","0.7093","MoKα","","0.0764","0.0499","","0.3845","0.1314","","","","1.093","0.979","0.979","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027619","9.5381","0.0002","12.0819","0.0002","13.0204","0.0002","76.461","0.001","82.001","0.001","80.014","0.001","1429.02","0.04","293","2","293","2","","","","","","","-","8","P -1","-P 1","2","","","","- C29 H31 Cl N O3 P Ru S2 -","- C29 H31 Cl N O3 P Ru S2 -","- C58 H62 Cl2 N2 O6 P2 Ru2 S4 -","2","1","","Bhattacharyya, Pravat; Loza, Maria L.; Parr, Jonathan; Slawin, Alexandra M. Z.","Complexes of ruthenium with tridentate [P,N,O] ligands","Journal of the Chemical Society, Dalton Transactions","1999","","17","2917","","10.1039/a904905c","","","0.71073","MoKα","","0.0409","0.0308","","0.0837","0.0765","","","","1.063","1.057","1.057","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027620","19.9054","0.0001","19.9054","0.0001","12.0417","0.0001","90","","90","","120","","4132","0.05","293","2","293","2","","","","","","","","7","P 31 2 1","P 31 2""","152","","","","- C56.2 H54.4 Cl0.4 N2 O4 P2 Ru -","- C56.2 H54 Cl0.4 N2 O4 P2 Ru -","- C168.6 H162 Cl1.2 N6 O12 P6 Ru3 -","3","0.5","","Bhattacharyya, Pravat; Loza, Maria L.; Parr, Jonathan; Slawin, Alexandra M. Z.","Complexes of ruthenium with tridentate [P,N,O] ligands","Journal of the Chemical Society, Dalton Transactions","1999","","17","2917","","10.1039/a904905c","","","0.71073","MoKα","","0.0698","0.0493","","0.1934","0.1281","","","","0.882","0.854","0.854","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027621","13.407","0.0006","15.4418","0.0005","20.7336","0.0009","90","","97.48","0.001","90","","4255.9","0.3","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C44 H35 Cl3 N2 O P2 Ru -","- C44 H35 Cl3 N2 O P2 Ru -","- C176 H140 Cl12 N8 O4 P8 Ru4 -","4","1","","Bhattacharyya, Pravat; Loza, Maria L.; Parr, Jonathan; Slawin, Alexandra M. Z.","Complexes of ruthenium with tridentate [P,N,O] ligands","Journal of the Chemical Society, Dalton Transactions","1999","","17","2917","","10.1039/a904905c","","","0.71073","MoKα","","0.3303","0.1032","","0.3947","0.2259","","","","0.926","1.068","1.068","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027622","9.7225","0.0002","10.4699","0.0002","16.2582","0.0004","107.859","0.001","90.136","0.001","98.515","0.001","1555.86","0.06","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C28 H26 Cl5 N O2 P Ru S -","- C28 H26 Cl5 N O2 P Ru S -","- C56 H52 Cl10 N2 O4 P2 Ru2 S2 -","2","1","","Bhattacharyya, Pravat; Loza, Maria L.; Parr, Jonathan; Slawin, Alexandra M. Z.","Complexes of ruthenium with tridentate [P,N,O] ligands","Journal of the Chemical Society, Dalton Transactions","1999","","17","2917","","10.1039/a904905c","","","0.71073","MoKα","","0.1034","0.0685","","0.1843","0.1522","","","","1.093","1.161","1.161","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027623","28.339","0.007","7.07","0.003","15.124","0.003","90","","111.75","0.02","90","","2814.5","1.5","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C13 H11 N2 O5 Re -","- C13 H11 N2 O5 Re -","- C104 H88 N16 O40 Re8 -","8","1","","Deloffre, Alexis; Halut, Sabine; Salles, Laurent; Brégeault, Jean-Marie; Gregorio, José Ribeiro; Denise, Bernard; Rudler, Henri","Synthesis, structural characterization and catalytic properties of a novel monomeric rhenium(V)methyl(oxo)bis(η2-picolinato) complex: [CH3Re(O)(pic)2] †","Journal of the Chemical Society, Dalton Transactions","1999","","17","2897","","10.1039/a904952e","","","0.71073","MoKα","","","0.032","","","0.0392","","","","","1.0467","1.0467","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027624","9.4999","0.0002","12.2367","0.0002","12.5765","0.0003","76.88","0.001","78.937","0.001","67.718","0.001","1308.39","0.05","293","2","293","2","","","","","","","see text","7","P -1","-P 1","2","","","","- C38 H22 Cu4 F18 N12 O12 S2 -","- C38 H22 Cu4 F18 N12 O12 S2 -","- C38 H22 Cu4 F18 N12 O12 S2 -","1","0.5","","Moubaraki, Boujemaa; Murray, Keith S.; Ranford, John D.; Vittal, Jagadese J.; Wang, Xiaobai; Xu, Yan","Preparation, characterisation and structures of copper(II) complexes of an asymmetric anti-cancer drug analogue †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3573","","10.1039/a905020e","","","0.71073","MoKα","","0.0644","0.0573","","0.1631","0.1574","","","","1.085","1.13","1.13","","","","","has coordinates,has disorder","179982","2020-10-21","18:00:00",""
"7027625","8.2376","0.0001","18.0917","0.0001","13.2848","0.0002","90","","95.604","0.001","90","","1970.4","0.04","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H13 Cu N9 O9 S -","- C13 H13 Cu N9 O9 S -","- C52 H52 Cu4 N36 O36 S4 -","4","1","","Moubaraki, Boujemaa; Murray, Keith S.; Ranford, John D.; Vittal, Jagadese J.; Wang, Xiaobai; Xu, Yan","Preparation, characterisation and structures of copper(II) complexes of an asymmetric anti-cancer drug analogue †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3573","","10.1039/a905020e","","","0.71073","MoKα","","0.0551","0.0384","","","0.0932","0.1028","","","","","","1.03","","","","has coordinates,has disorder","179982","2020-10-21","18:00:00",""
"7027626","7.4905","0.0003","8.3949","0.0003","21.9669","0.0009","98.635","0.001","90.821","0.001","107.117","0.001","1302.67","0.09","293","2","293","2","","","","","","","see text","7","P -1","-P 1","2","","","","- C13 H19 Cl3 Cu N6 O15 S -","- C13 H19 Cl3 Cu N6 O15 S -","- C26 H38 Cl6 Cu2 N12 O30 S2 -","2","1","","Moubaraki, Boujemaa; Murray, Keith S.; Ranford, John D.; Vittal, Jagadese J.; Wang, Xiaobai; Xu, Yan","Preparation, characterisation and structures of copper(II) complexes of an asymmetric anti-cancer drug analogue †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3573","","10.1039/a905020e","","","0.71073","MoKα","","0.0569","0.0462","","","0.1238","0.1318","","","","","","1.033","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027627","13.845","0.003","7.9","0.002","14.544","0.003","90","","90","","90","","1590.8","0.6","150","2","150","2","","","","","","","","4","C m c m","-C 2c 2","63","","pentakis(dimethylamido)tantalum(V)","","- C10 H30 N5 Ta -","- C10 H30 N5 Ta -","- C40 H120 N20 Ta4 -","4","0.25","","Batsanov, Andrei S.; Churakov, Andrei V.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Kingsley, Andrew J.; Neretin, Ivan S.; Wade, Ken","Transition metal dicarbollide complexes: synthesis, molecular, crystal and electronic structures of [M(C2B9H11)(NMe2)3] (M = Nb or Ta) and their insertion reactions with CO2 and CS2 †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3867","","10.1039/a905075b","","","0.71073","MoKα","","0.0269","0.0267","","","0.0656","0.0661","","","","","","1.217","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027628","13.4562","0.0007","15.6233","0.0012","16.9319","0.001","90","","90","","90","","3559.6","0.4","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","tris(dimethylamido)-η^5^-2,3-dicarbaundecaborane(11) niobium(V)","","- C8 H29 B9 N3 Nb -","- C8 H29 B9 N3 Nb -","- C64 H232 B72 N24 Nb8 -","8","2","","Batsanov, Andrei S.; Churakov, Andrei V.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Kingsley, Andrew J.; Neretin, Ivan S.; Wade, Ken","Transition metal dicarbollide complexes: synthesis, molecular, crystal and electronic structures of [M(C2B9H11)(NMe2)3] (M = Nb or Ta) and their insertion reactions with CO2 and CS2 †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3867","","10.1039/a905075b","","","0.71073","MoKα","","0.0581","0.0362","","0.0757","0.0625","","","","1.172","1.109","1.109","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027629","13.484","0.001","15.472","0.001","17.042","0.001","90","","90","","90","","3555.4","0.4","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","tris(dimethylamido)-η^5^-2,3-dicarbaundecaborane(11) tantalum(V)","","- C8 H29 B9 N3 Ta -","- C8 H29 B9 N3 Ta -","- C64 H232 B72 N24 Ta8 -","8","2","","Batsanov, Andrei S.; Churakov, Andrei V.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Kingsley, Andrew J.; Neretin, Ivan S.; Wade, Ken","Transition metal dicarbollide complexes: synthesis, molecular, crystal and electronic structures of [M(C2B9H11)(NMe2)3] (M = Nb or Ta) and their insertion reactions with CO2 and CS2 †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3867","","10.1039/a905075b","","","0.71073","MoKα","","0.0375","0.0284","","0.0687","0.0621","","","","1.083","1.049","1.049","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027630","9.879","0.003","11.637","0.003","13.957","0.004","98.77","0.01","97.42","0.01","113.04","0.01","1427.5","0.7","120","2","120","2","","","","","","","","8","P -1","-P 1","2","","tris(N,N-dimethyldithiocarbamato-S,S')-η^5^-2,3- dicarbaundecaborane(11)- niobium(V) dichlorodeuteromethylene","","- C12 H29 B9 Cl2 D2 N3 Nb S6 -","- C12 H31 B9 Cl2 N3 Nb S6 -","- C24 H62 B18 Cl4 N6 Nb2 S12 -","2","1","","Batsanov, Andrei S.; Churakov, Andrei V.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Kingsley, Andrew J.; Neretin, Ivan S.; Wade, Ken","Transition metal dicarbollide complexes: synthesis, molecular, crystal and electronic structures of [M(C2B9H11)(NMe2)3] (M = Nb or Ta) and their insertion reactions with CO2 and CS2 †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3867","","10.1039/a905075b","","","0.71073","MoKα","","0.0286","0.022","","","0.0507","0.0529","","","","","","1.04","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027631","12.297","0.002","17.424","0.003","13.308","0.003","90","","111.34","0.05","90","","2655.9","1.3","150","2","150","2","","","","","","","synthesis","6","P 1 21/c 1","-P 2ybc","14","","tris(N,N-dimethylcarbamato-O,O')-η^5^-2,3-dicarbaundecaborane(11)- tantalum(V) hemi-toluene","","- C14.5 H33 B9 N3 O6 Ta -","- C14.5 H33 B9 N3 O6 Ta -","- C58 H132 B36 N12 O24 Ta4 -","4","1","","Batsanov, Andrei S.; Churakov, Andrei V.; Howard, Judith A. K.; Hughes, Andrew K.; Johnson, Andrew L.; Kingsley, Andrew J.; Neretin, Ivan S.; Wade, Ken","Transition metal dicarbollide complexes: synthesis, molecular, crystal and electronic structures of [M(C2B9H11)(NMe2)3] (M = Nb or Ta) and their insertion reactions with CO2 and CS2 †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3867","","10.1039/a905075b","","","0.71073","MoKα","","0.0512","0.0329","","0.0978","0.0858","","","","1.119","1.142","1.142","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027632","9.6358","0.0001","14.5935","0.0002","15.1412","0.0001","90","","94.718","0.001","90","","2121.94","0.04","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H32 Cl2 Cu N4 O8 -","- C14 H32 Cl2 Cu N4 O8 -","- C56 H128 Cl8 Cu4 N16 O32 -","4","1","","Lu, Tian-Huey; Lin, Shih-Chi; Aneetha, Halikhedkar; Panneerselvam, Kaliyamoorthy; Chung, Chung-Sun","Copper(II) complexes of C-meso-1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane: syntheses, structures and properties †>","Journal of the Chemical Society, Dalton Transactions","1999","","19","3385","","10.1039/a905079e","","","0.71073","MoKα","","0.1215","0.1103","","","0.2865","0.2966","","","","","","1.174","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027633","7.3939","0.0001","16.1227","0.0003","8.5698","0.0002","90","","114.381","0.001","90","","930.5","0.03","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C14 H32 Cu N10 -","- C14 H32 Cu N10 -","- C28 H64 Cu2 N20 -","2","0.5","","Lu, Tian-Huey; Lin, Shih-Chi; Aneetha, Halikhedkar; Panneerselvam, Kaliyamoorthy; Chung, Chung-Sun","Copper(II) complexes of C-meso-1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane: syntheses, structures and properties †>","Journal of the Chemical Society, Dalton Transactions","1999","","19","3385","","10.1039/a905079e","","","0.71073","MoKα","","0.0567","0.0396","","","0.1004","0.109","","","","","","1.028","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027634","9.596","0.001","12.157","0.001","9.698","0.001","90","","108.1","0.01","90","","1075.37","0.19","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H36 Cu N6 O6 -","- C14 H36 Cu N6 O6 -","- C28 H72 Cu2 N12 O12 -","2","0.5","","Lu, Tian-Huey; Lin, Shih-Chi; Aneetha, Halikhedkar; Panneerselvam, Kaliyamoorthy; Chung, Chung-Sun","Copper(II) complexes of C-meso-1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane: syntheses, structures and properties †>","Journal of the Chemical Society, Dalton Transactions","1999","","19","3385","","10.1039/a905079e","","","0.71073","MoKα","","0.0611","0.0459","","","0.1342","0.1416","","","","","","1.061","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027635","8.973","0.001","11.864","0.004","9.614","0.004","90","","106.93","0.02","90","","979.1","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H36 Cl2 Cu N4 O2 -","- C14 H36 Cl2 Cu N4 O2 -","- C28 H72 Cl4 Cu2 N8 O4 -","2","0.5","","Lu, Tian-Huey; Lin, Shih-Chi; Aneetha, Halikhedkar; Panneerselvam, Kaliyamoorthy; Chung, Chung-Sun","Copper(II) complexes of C-meso-1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane: syntheses, structures and properties †>","Journal of the Chemical Society, Dalton Transactions","1999","","19","3385","","10.1039/a905079e","","","0.71073","MoKα","","0.0436","0.0313","","","0.0831","0.0869","","","","","","1.272","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027636","9.245","0.001","12.115","0.001","9.749","0.001","90","","107.24","0.01","90","","1042.86","0.19","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H36 Br2 Cu N4 O2 -","- C14 H36 Br2 Cu N4 O2 -","- C28 H72 Br4 Cu2 N8 O4 -","2","0.5","","Lu, Tian-Huey; Lin, Shih-Chi; Aneetha, Halikhedkar; Panneerselvam, Kaliyamoorthy; Chung, Chung-Sun","Copper(II) complexes of C-meso-1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane: syntheses, structures and properties †>","Journal of the Chemical Society, Dalton Transactions","1999","","19","3385","","10.1039/a905079e","","","0.71073","MoKα","","0.1703","0.114","","","0.527","0.5437","","","","","","1.299","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027637","8.5634","0.0003","13.1899","0.0005","10.2121","0.0004","90","","103.266","0.001","90","","1122.68","0.07","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C14 H36 Cu I2 N4 O2 -","- C14 H36 Cu I2 N4 O2 -","- C28 H72 Cu2 I4 N8 O4 -","2","0.5","","Lu, Tian-Huey; Lin, Shih-Chi; Aneetha, Halikhedkar; Panneerselvam, Kaliyamoorthy; Chung, Chung-Sun","Copper(II) complexes of C-meso-1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane: syntheses, structures and properties †>","Journal of the Chemical Society, Dalton Transactions","1999","","19","3385","","10.1039/a905079e","","","0.71073","MoKα","","0.0307","0.0275","","","0.0606","0.0628","","","","","","1.081","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027638","10.399","0.002","11.555","0.003","16.244","0.005","90","","98.63","0.02","90","","1929.8","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 O8 Re2 S -","- C14 H12 O8 Re2 S -","- C56 H48 O32 Re8 S4 -","4","1","","Egold, Hans; Schwarze, Detlef; Flörke, Ulrich","The reaction of [Re2(CO)8(MeCN)2] with thiols. Formation of hydrido sulfido bridged dirhenium cluster complexes [Re2(μ-H)(μ-SR)(CO)8] (R = H, n-Bu, Cy, Ph, C6H4F-p, C6F5 or 2-naphthyl)","Journal of the Chemical Society, Dalton Transactions","1999","","18","3203","","10.1039/a905111b","","","0.71073","MoKα","","0.0807","0.0469","","","0.0989","0.1116","","","","","","1.018","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027639","7.047","0.003","16.792","0.004","16.853","0.004","90","","91.23","0.02","90","","1993.8","1.1","210","2","210","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H8 O8 Re2 S -","- C18 H7 O8 Re2 S -","- C72 H28 O32 Re8 S4 -","4","1","","Egold, Hans; Schwarze, Detlef; Flörke, Ulrich","The reaction of [Re2(CO)8(MeCN)2] with thiols. Formation of hydrido sulfido bridged dirhenium cluster complexes [Re2(μ-H)(μ-SR)(CO)8] (R = H, n-Bu, Cy, Ph, C6H4F-p, C6F5 or 2-naphthyl)","Journal of the Chemical Society, Dalton Transactions","1999","","18","3203","","10.1039/a905111b","","","0.71073","MoKα","","0.0656","0.0452","","0.1274","0.1129","","","","0.998","1.032","1.032","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027640","11.5182","0.0013","12.435","0.003","14.8394","0.0017","85.642","0.014","68.17","0.009","64.389","0.014","1770","0.6","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H22 Au O8 P Re2 S -","- C36 H22 Au O8 P Re2 S -","- C72 H44 Au2 O16 P2 Re4 S2 -","2","1","","Egold, Hans; Schwarze, Detlef; Flörke, Ulrich","The reaction of [Re2(CO)8(MeCN)2] with thiols. Formation of hydrido sulfido bridged dirhenium cluster complexes [Re2(μ-H)(μ-SR)(CO)8] (R = H, n-Bu, Cy, Ph, C6H4F-p, C6F5 or 2-naphthyl)","Journal of the Chemical Society, Dalton Transactions","1999","","18","3203","","10.1039/a905111b","","","0.71073","MoKα","","0.0661","0.0548","","","0.137","0.1454","","","","","","1.067","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027641","11.38","0.002","12.439","0.002","14.722","0.004","76.8","0.02","67.37","0.02","64.24","0.02","1727.7","0.7","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","","","- C36 H22 Ag O8 P Re2 S -","- C36 H22 Ag O8 P Re2 S -","- C72 H44 Ag2 O16 P2 Re4 S2 -","2","1","","Egold, Hans; Schwarze, Detlef; Flörke, Ulrich","The reaction of [Re2(CO)8(MeCN)2] with thiols. Formation of hydrido sulfido bridged dirhenium cluster complexes [Re2(μ-H)(μ-SR)(CO)8] (R = H, n-Bu, Cy, Ph, C6H4F-p, C6F5 or 2-naphthyl)","Journal of the Chemical Society, Dalton Transactions","1999","","18","3203","","10.1039/a905111b","","","0.71073","MoKα","","0.0445","0.0309","","","0.0618","0.0658","","","","","","1.053","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027642","5.8871","0.0012","11.597","0.002","20.262","0.004","90","","91.02","0.03","90","","1383.1","0.5","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 Fe N2 O2 -","- C16 H16 Fe N2 O2 -","- C64 H64 Fe4 N8 O8 -","4","1","","Houlton, Andrew; Isaac, Christian J.; Gibson, Ashleigh E.; Horrocks, Benjamin R.; Clegg, William; Elsegood, Mark R. J.","Synthesis, structure and redox properties of ferrocenylmethylnucleobases","Journal of the Chemical Society, Dalton Transactions","1999","","18","3229","","10.1039/a905168f","","","0.71073","MoKα","","0.0702","0.0422","","0.0933","0.084","","","","1.04","1.107","1.107","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027643","17.0466","0.0019","7.3337","0.0008","10.6368","0.0012","90","","105.972","0.003","90","","1278.4","0.2","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 Fe N3 O -","- C15 H15 Fe N3 O -","- C60 H60 Fe4 N12 O4 -","4","1","","Houlton, Andrew; Isaac, Christian J.; Gibson, Ashleigh E.; Horrocks, Benjamin R.; Clegg, William; Elsegood, Mark R. J.","Synthesis, structure and redox properties of ferrocenylmethylnucleobases","Journal of the Chemical Society, Dalton Transactions","1999","","18","3229","","10.1039/a905168f","","","0.71073","MoKα","","0.0668","0.0409","","0.095","0.0848","","","","1.017","1.067","1.067","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027644","7.912","0.003","9.803","0.003","38.335","0.014","90","","92.622","0.008","90","","2970.2","1.8","160","2","160","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C16 H14 Cl Fe N5 -","- C16 H14 Cl Fe N5 -","- C128 H112 Cl8 Fe8 N40 -","8","1","","Houlton, Andrew; Isaac, Christian J.; Gibson, Ashleigh E.; Horrocks, Benjamin R.; Clegg, William; Elsegood, Mark R. J.","Synthesis, structure and redox properties of ferrocenylmethylnucleobases","Journal of the Chemical Society, Dalton Transactions","1999","","18","3229","","10.1039/a905168f","","","0.71073","MoKα","","0.1502","0.0769","","","0.151","0.1806","","","","","","1.012","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027645","7.4437","0.0007","11.2087","0.001","14.7197","0.0014","101.704","0.002","95.29","0.002","96.077","0.003","1187.66","0.19","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H24 Cl Fe2 N5 -","- C27 H23 Cl Fe2 N5 -","- C54 H46 Cl2 Fe4 N10 -","2","1","","Houlton, Andrew; Isaac, Christian J.; Gibson, Ashleigh E.; Horrocks, Benjamin R.; Clegg, William; Elsegood, Mark R. J.","Synthesis, structure and redox properties of ferrocenylmethylnucleobases","Journal of the Chemical Society, Dalton Transactions","1999","","18","3229","","10.1039/a905168f","","","0.71073","MoKα","","0.0954","0.0719","","","0.1606","0.1694","","","","","","1.172","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027646","10.6304","0.001","11.3735","0.001","13.3561","0.0012","90","","107.155","0.002","90","","1543","0.2","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H14 Cl Fe N5 -","- C16 H14 Cl Fe N5 -","- C64 H56 Cl4 Fe4 N20 -","4","1","","Houlton, Andrew; Isaac, Christian J.; Gibson, Ashleigh E.; Horrocks, Benjamin R.; Clegg, William; Elsegood, Mark R. J.","Synthesis, structure and redox properties of ferrocenylmethylnucleobases","Journal of the Chemical Society, Dalton Transactions","1999","","18","3229","","10.1039/a905168f","","","0.71073","MoKα","","0.034","0.0274","","","0.0662","0.0694","","","","","","1.029","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027647","10.2282","0.0009","7.1859","0.0006","22.3765","0.0019","90","","102.597","0.002","90","","1605.1","0.2","160","2","160","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H17 Fe N5 O2 -","- C18 H17 Fe N5 O2 -","- C72 H68 Fe4 N20 O8 -","4","1","","Houlton, Andrew; Isaac, Christian J.; Gibson, Ashleigh E.; Horrocks, Benjamin R.; Clegg, William; Elsegood, Mark R. J.","Synthesis, structure and redox properties of ferrocenylmethylnucleobases","Journal of the Chemical Society, Dalton Transactions","1999","","18","3229","","10.1039/a905168f","","","0.71073","MoKα","","0.041","0.0301","","","0.0729","0.0743","","","","","","0.944","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027648","22.443","0.003","7.6933","0.0011","23.913","0.003","90","","90","","90","","4128.8","1","160","2","160","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H24 Fe N6 O3 -","- C21 H24 Fe N6 O3 -","- C168 H192 Fe8 N48 O24 -","8","1","","Houlton, Andrew; Isaac, Christian J.; Gibson, Ashleigh E.; Horrocks, Benjamin R.; Clegg, William; Elsegood, Mark R. J.","Synthesis, structure and redox properties of ferrocenylmethylnucleobases","Journal of the Chemical Society, Dalton Transactions","1999","","18","3229","","10.1039/a905168f","","","0.71073","MoKα","","0.0907","0.0441","","","0.0853","0.1033","","","","","","1.034","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027649","26.229","0.003","16.301","0.002","23.696","0.003","90","","105.88","0.002","90","","9745","2","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C59 H40 N4 P2 Ru -","- C59 H40 N4 P2 Ru -","- C472 H320 N32 P16 Ru8 -","8","2","","Bruce, Michael I.; Hall, Ben C.; Kelly, Brian D.; Low, Paul J.; Skelton, Brian W.; White, Allan H.","An efficient synthesis of polyynyl and polyynediyl complexes of ruthenium(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3719","","10.1039/a905174k","","","0.71073","MoKα","","0.131","0.058","","0.068","","0.054","","","1.211","","","1.337","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027650","11.831","0.001","14.195","0.001","17.632","0.002","95.453","0.001","104.238","0.001","112.847","0.001","2584.1","0.4","153","","153","","","","","","","","","7","P -1","-P 1","2","","","","- C58 H42 Cl2 Co2 O6 P2 Ru -","- C58 H42 Cl2 Co2 O6 P2 Ru -","- C116 H84 Cl4 Co4 O12 P4 Ru2 -","2","1","","Bruce, Michael I.; Hall, Ben C.; Kelly, Brian D.; Low, Paul J.; Skelton, Brian W.; White, Allan H.","An efficient synthesis of polyynyl and polyynediyl complexes of ruthenium(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3719","","10.1039/a905174k","","","0.71073","MoKα","","0.056","0.038","","0.049","","0.046","","","1.234","","","1.349","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027651","19.42","0.0014","14.889","0.0012","17.173","0.0015","90","","112.851","0.001","90","","4575.8","0.6","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C54 H48 P2 Ru Si -","- C54 H48 P2 Ru Si -","- C216 H192 P8 Ru4 Si4 -","4","1","","Bruce, Michael I.; Hall, Ben C.; Kelly, Brian D.; Low, Paul J.; Skelton, Brian W.; White, Allan H.","An efficient synthesis of polyynyl and polyynediyl complexes of ruthenium(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3719","","10.1039/a905174k","","","0.71073","MoKα","","0.093","0.058","","0.076","","0.072","","","1.644","","","1.94","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027652","26.078","0.003","12.559","0.0012","37.015","0.004","90","","110.218","0.002","90","","11376","2","293","","293","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C70 H62 N4 P2 Ru -","- C70 H62 N4 P2 Ru -","- C560 H496 N32 P16 Ru8 -","8","1","","Bruce, Michael I.; Hall, Ben C.; Kelly, Brian D.; Low, Paul J.; Skelton, Brian W.; White, Allan H.","An efficient synthesis of polyynyl and polyynediyl complexes of ruthenium(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3719","","10.1039/a905174k","","","0.71073","MoKα","","0.108","0.068","","0.1","","0.092","","","2.13","","","2.496","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027653","14.825","0.003","14.561","0.003","18.613","0.004","90","","100.446","0.003","90","","3951.3","1.4","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C51 H40 P2 Ru -","- C51 H40 P2 Ru -","- C204 H160 P8 Ru4 -","4","1","","Bruce, Michael I.; Hall, Ben C.; Kelly, Brian D.; Low, Paul J.; Skelton, Brian W.; White, Allan H.","An efficient synthesis of polyynyl and polyynediyl complexes of ruthenium(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3719","","10.1039/a905174k","","","0.71073","MoKα","","0.099","0.044","","0.049","","0.043","","","0.981","","","1.152","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027654","23.514","0.01","14.71","0.009","25.874","0.009","90","","118.11","0.03","90","","7894","7","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C94 H86 O2 P4 Ru2 -","- C94 H86 O2 P4 Ru2 -","- C376 H344 O8 P16 Ru8 -","4","1","","Bruce, Michael I.; Hall, Ben C.; Kelly, Brian D.; Low, Paul J.; Skelton, Brian W.; White, Allan H.","An efficient synthesis of polyynyl and polyynediyl complexes of ruthenium(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3719","","10.1039/a905174k","","","0.71073","MoKα","","0.15","0.083","","0.09","","0.083","","","2.135","","","2.967","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027655","21.542","0.006","11.463","0.003","29.377","0.015","90","","90","","90","","7254","5","293","","293","","","","","","","","","5","P c c a","-P 2a 2ac","54","","","","- C86.8 H73.3 O0.8 P4 Ru2 -","- C86.8 H70 O0.8 P4 Ru2 -","- C347.2 H280 O3.2 P16 Ru8 -","4","0.5","","Bruce, Michael I.; Hall, Ben C.; Kelly, Brian D.; Low, Paul J.; Skelton, Brian W.; White, Allan H.","An efficient synthesis of polyynyl and polyynediyl complexes of ruthenium(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3719","","10.1039/a905174k","","","0.71073","MoKα","","0.151","0.058","","0.068","","0.053","","","1.342","","","1.767","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027656","17.474","0.003","17.164","0.003","22.453","0.004","90","","111.223","0.005","90","","6277.5","1.9","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C74 H58 Co2 O4 P4 Ru -","- C74 H58 Co2 O4 P4 Ru -","- C296 H232 Co8 O16 P16 Ru4 -","4","1","","Bruce, Michael I.; Hall, Ben C.; Kelly, Brian D.; Low, Paul J.; Skelton, Brian W.; White, Allan H.","An efficient synthesis of polyynyl and polyynediyl complexes of ruthenium(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3719","","10.1039/a905174k","","","0.71073","MoKα","","0.285","0.082","","0.098","","0.071","","","1.029","","","1.511","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027657","12.408","0.001","15.398","0.002","21.246","0.003","90","","97.833","0.002","90","","4021.4","0.8","153","","153","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C92 H78 Cl8 P4 Ru2 -","- C92 H78 Cl8 P4 Ru2 -","- C184 H156 Cl16 P8 Ru4 -","2","0.5","","Bruce, Michael I.; Hall, Ben C.; Kelly, Brian D.; Low, Paul J.; Skelton, Brian W.; White, Allan H.","An efficient synthesis of polyynyl and polyynediyl complexes of ruthenium(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3719","","10.1039/a905174k","","","0.71073","MoKα","","0.122","0.054","","0.063","","0.054","","","1.075","","","1.256","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027658","17.554","0.001","7.617","0.001","17.1","0.001","90","","108.266","0.007","90","","2171.2","0.3","296.2","","296.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H17 Mo N2 O4 P -","- C21 H17 Mo N2 O4 P -","- C84 H68 Mo4 N8 O16 P4 -","4","1","","Jalil, M. Abdul; Fujinami, Shuhei; Nishikawa, Hiroaki","A convenient method for selective substitutions at the backbone of a co-ordinated imidazolylphosphine P‒N ligand. Single crystal X-ray analyses of [Mo(CO)4(MeImCH2PPh2)] and its ethyl substituted derivative [Mo(CO)4(MeImCHEtPPh2)] †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3499","","10.1039/a905186d","","","0.7107","MoKα","","","0.0263","","","0.0504","","","","","1.313","1.313","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027659","11.453","0.001","10.396","0.002","19.428","0.002","90","","93.33","0.01","90","","2309.3","0.5","296.2","","296.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H21 Mo N2 O4 P -","- C23 H21 Mo N2 O4 P -","- C92 H84 Mo4 N8 O16 P4 -","4","1","","Jalil, M. Abdul; Fujinami, Shuhei; Nishikawa, Hiroaki","A convenient method for selective substitutions at the backbone of a co-ordinated imidazolylphosphine P‒N ligand. Single crystal X-ray analyses of [Mo(CO)4(MeImCH2PPh2)] and its ethyl substituted derivative [Mo(CO)4(MeImCHEtPPh2)] †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3499","","10.1039/a905186d","","","0.7107","MoKα","","","0.0269","","","0.0445","","","","","1.008","1.008","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027660","11.779","0.004","13.233","0.003","14.732","0.003","90","","100.03","0.02","90","","2261.2","1","294.2","","294","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C18 H29 Cl N4 Ni O5 S2 -","- C18 H29 Cl N4 Ni O5 S2 -","- C72 H116 Cl4 N16 Ni4 O20 S8 -","4","1","","Bhattacharyya, Sudeep; Ghosh, Dipesh; Endo, Akira; Shimizu, Kunio; Weakley, Timothy J. R.; Chaudhury, Muktimoy","Nickel(II)-induced activation of a carbon‒nitrogen single bond(s) of a co-ordinated ligand by hydroxylated substrates: generation of mono- and bi-nuclear complexes with modified ligand frameworks †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3859","","10.1039/a905268b","","","0.71073","MoKα","","","0.044","","","0.045","","","","","1.8","1.8","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027661","7.8562","0.0012","20.9125","0.0016","12.727","0.0013","90","","99.381","0.011","90","","2063","0.4","295","","295","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C16 H25 Cl N4 Ni O4 S2 -","- C16 H25 Cl N4 Ni O4 S2 -","- C64 H100 Cl4 N16 Ni4 O16 S8 -","4","1","","Bhattacharyya, Sudeep; Ghosh, Dipesh; Endo, Akira; Shimizu, Kunio; Weakley, Timothy J. R.; Chaudhury, Muktimoy","Nickel(II)-induced activation of a carbon‒nitrogen single bond(s) of a co-ordinated ligand by hydroxylated substrates: generation of mono- and bi-nuclear complexes with modified ligand frameworks †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3859","","10.1039/a905268b","","","0.71073","MoKα","","0.066","0.048","","0.062","","0.061","","","2.49","","","2.73","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027662","18.732","0.002","11.284","0.001","16.048","0.002","90","","90","","90","","3392.1","0.6","295","","295","","","","","","","","","7","I b a 2","I 2 -2c","45","","","","- C25 H41 Cl N6 Ni2 O4 S4 -","- C25 H41 Cl2 N6 Ni2 O8 S4 -","- C100 H164 Cl8 N24 Ni8 O32 S16 -","4","0.5","","Bhattacharyya, Sudeep; Ghosh, Dipesh; Endo, Akira; Shimizu, Kunio; Weakley, Timothy J. R.; Chaudhury, Muktimoy","Nickel(II)-induced activation of a carbon‒nitrogen single bond(s) of a co-ordinated ligand by hydroxylated substrates: generation of mono- and bi-nuclear complexes with modified ligand frameworks †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3859","","10.1039/a905268b","","","0.71073","MoKα","","","0.041","","","0.042","","","","","2.17","2.17","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027663","10.878","0.001","15.302","0.0015","17.119","0.002","90","","103.89","0.0013","90","","2766.2","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H11 F17 Mo O4 S -","- C25 H11 F17 Mo O4 S -","- C100 H44 F68 Mo4 O16 S4 -","4","1","","Agh-Atabay, Naz M.; Davidson, Jack L.; Dullweber, Uta; Douglas, Graeme; Muir, Kenneth W.","Reactions of alkynes with molybdenum and tungsten bis(alkyne) complexes [M(SR)(CF3CCCF3)2(η5-C5H5)] (M = Mo, R = C6F5; M = W, R = C6H4Me-4): crystal and molecular structure of [Mo{η4-C(CF3)C(CF3)C(CO2Me)C(CO2Me)(SC6F5)}(CF3CCCF3)(η5-C5H5)] †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3883","","10.1039/a905297f","","","0.71073","MoKα","","0.092","0.0367","","0.0975","0.085","","","","0.987","1.138","1.138","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027664","7.6191","0.0015","12.213","0.002","18.533","0.004","70.909","0.002","85.774","0.002","83.702","0.002","1618.5","0.5","158","2","158","2","","","","","","","","4","P 1","P 1","1","","","","- C25 H21 Co3 O19 -","- C25 H21 Co3 O19 -","- C50 H42 Co6 O38 -","2","2","","Kerr, Joy L.; Robinson, Brian H.; Simpson, Jim","Carbohydrates tagged with the CCo3(CO)9 cluster †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4165","","10.1039/a905300j","","","0.71073","MoKα","","0.0943","0.0734","","","0.1807","0.1896","","","","","","0.978","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027665","7.402","0.005","11.785","0.005","12.52","0.004","90","","96.01","0.04","90","","1086.1","0.9","493.2","","493.2","","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C14 H33 I2 O P2 Rh -","- C14 H33 I2 O P2 Rh -","- C28 H66 I4 O2 P4 Rh2 -","2","1","","Rankin, Joanne; Benyei, Attila C.; Poole, Andrew D.; Cole-Hamilton, David J.","The carbonylation of methanol catalysed by [RhI(CO)(PEt3)2]; crystal and molecular structure of [RhMeI2(CO)(PEt3)2] †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3771","","10.1039/a905308e","","","0.7107","MoKalpha","","","0.0263","","","0.0272","","","","","4.042","4.042","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027666","10.3643","0.0003","10.5035","0.0001","17.0828","0.0004","90","","103.309","0.001","90","","1809.71","0.07","293","2","293","2","","","","","","","-","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H14 Mn N2 O7 -","- C19 H14 Mn N2 O7 -","- C76 H56 Mn4 N8 O28 -","4","1","","Plater, M. John; Foreman, Mark R. St. J.; Coronado, Eugenio; Gómez-García, Carlos J.; Slawin, Alexandra M. Z.","Crystallisation of H3BTC, H3TPO or H2SDA with MII (M = Co, Mn or Zn) and 2,2′-bipyridyl: design and control of co-ordination architecture, and magnetic properties (H3BTC = benzene-1,3,5-tricarboxylic acid, H3TPO = tris(4-carboxylphenyl)phosphine oxide, H2SDA = cis-stilbene-4,4′-dicarboxylic acid) †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4209","","10.1039/a905332h","","","0.71073","MoKα","","0.0581","0.0314","","0.0841","0.067","","","","0.907","0.968","0.968","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027667","9.5599","0.0005","10.1135","0.0005","10.8358","0.0005","98.549","0.001","111.596","0.001","104.921","0.001","906.05","0.08","293","2","293","2","","","","","","","-","5","P -1","-P 1","2","","","","- C19 H14 Co N2 O7 -","- C19 H14 Co N2 O7 -","- C38 H28 Co2 N4 O14 -","2","1","","Plater, M. John; Foreman, Mark R. St. J.; Coronado, Eugenio; Gómez-García, Carlos J.; Slawin, Alexandra M. Z.","Crystallisation of H3BTC, H3TPO or H2SDA with MII (M = Co, Mn or Zn) and 2,2′-bipyridyl: design and control of co-ordination architecture, and magnetic properties (H3BTC = benzene-1,3,5-tricarboxylic acid, H3TPO = tris(4-carboxylphenyl)phosphine oxide, H2SDA = cis-stilbene-4,4′-dicarboxylic acid) †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4209","","10.1039/a905332h","","","0.71073","MoKα","","0.0398","0.0284","","0.0779","0.0632","","","","0.984","1.033","1.033","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027668","9.4616","0.0001","9.4818","0.0002","11.4619","0.0003","111.95","","93.091","0.001","101.878","0.001","923.57","0.03","293","2","293","2","","","","","","","-","5","P -1","-P 1","2","","","","- C19 H14 N2 O7 Zn -","- C19 H14 N2 O7 Zn -","- C38 H28 N4 O14 Zn2 -","2","1","","Plater, M. John; Foreman, Mark R. St. J.; Coronado, Eugenio; Gómez-García, Carlos J.; Slawin, Alexandra M. Z.","Crystallisation of H3BTC, H3TPO or H2SDA with MII (M = Co, Mn or Zn) and 2,2′-bipyridyl: design and control of co-ordination architecture, and magnetic properties (H3BTC = benzene-1,3,5-tricarboxylic acid, H3TPO = tris(4-carboxylphenyl)phosphine oxide, H2SDA = cis-stilbene-4,4′-dicarboxylic acid) †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4209","","10.1039/a905332h","","","0.71073","MoKα","","0.0407","0.0295","","0.1069","0.0767","","","","0.841","0.832","0.832","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027669","10.0443","0.0007","10.3414","0.0007","12.1092","0.0009","74.719","0.002","74.947","0.002","79.909","0.002","1163.98","0.14","293","2","293","2","","","","","","","-","5","P -1","-P 1","2","","","","- C19 H25 Co1.5 N2 O11 -","- C19 H13 Co1.5 N2 O11 -","- C38 H26 Co3 N4 O22 -","2","1","","Plater, M. John; Foreman, Mark R. St. J.; Coronado, Eugenio; Gómez-García, Carlos J.; Slawin, Alexandra M. Z.","Crystallisation of H3BTC, H3TPO or H2SDA with MII (M = Co, Mn or Zn) and 2,2′-bipyridyl: design and control of co-ordination architecture, and magnetic properties (H3BTC = benzene-1,3,5-tricarboxylic acid, H3TPO = tris(4-carboxylphenyl)phosphine oxide, H2SDA = cis-stilbene-4,4′-dicarboxylic acid) †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4209","","10.1039/a905332h","","","0.71073","MoKα","","0.1405","0.0482","","0.1437","0.0938","","","","0.571","0.879","0.879","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027670","10.9103","0.001","11.4372","0.0011","13.7163","0.0013","110.791","0.002","93.652","0.001","99.355","0.002","1565.1","0.3","293","2","293","2","","","","","","","-","6","P -1","-P 1","2","","","","- C62 H54 Co3 N4 O21 P2 -","- C62 H48 Co3 N4 O21 P2 -","- C62 H48 Co3 N4 O21 P2 -","1","0.5","","Plater, M. John; Foreman, Mark R. St. J.; Coronado, Eugenio; Gómez-García, Carlos J.; Slawin, Alexandra M. Z.","Crystallisation of H3BTC, H3TPO or H2SDA with MII (M = Co, Mn or Zn) and 2,2′-bipyridyl: design and control of co-ordination architecture, and magnetic properties (H3BTC = benzene-1,3,5-tricarboxylic acid, H3TPO = tris(4-carboxylphenyl)phosphine oxide, H2SDA = cis-stilbene-4,4′-dicarboxylic acid) †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4209","","10.1039/a905332h","","","0.71073","MoKα","","0.1592","0.0736","","0.2604","0.1997","","","","1.015","1.119","1.119","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027671","11.238","0.0001","13.5519","0.0002","14.5787","0.0003","90","","94.497","0.001","90","","2213.45","0.06","293","2","293","2","","","","","","","-","5","P 1 21/a 1","-P 2yab","14","","","","- C26 H20 Co N2 O5 -","- C26 H20 Co N2 O5 -","- C104 H80 Co4 N8 O20 -","4","1","","Plater, M. John; Foreman, Mark R. St. J.; Coronado, Eugenio; Gómez-García, Carlos J.; Slawin, Alexandra M. Z.","Crystallisation of H3BTC, H3TPO or H2SDA with MII (M = Co, Mn or Zn) and 2,2′-bipyridyl: design and control of co-ordination architecture, and magnetic properties (H3BTC = benzene-1,3,5-tricarboxylic acid, H3TPO = tris(4-carboxylphenyl)phosphine oxide, H2SDA = cis-stilbene-4,4′-dicarboxylic acid) †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4209","","10.1039/a905332h","","","0.71073","MoKα","","0.0493","0.0327","","0.1402","0.0781","","","","1.047","1.108","1.108","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027672","17.5361","0.0005","20.2736","0.0006","21.7395","0.0006","117.477","0.001","109.025","0.001","91.382","0.001","6340.5","0.3","123","1","123","1","","","","","","","","6","P -1","-P 1","2","[Al13O4(OH)36(H2O)12][(sodium-(18- crown-6)-dihydrate). bis(p-sulfonatocalix[4]arene)]0.5[p-sulfonatocalix[4]arene](H20)29","","","- C124 H325 Al26 Na O210 S16 -","- C124 H104 Al26 Na O210 S16 -","- C124 H104 Al26 Na O210 S16 -","1","0.5","","Drljaca, Alexander; Hardie, Michaele J.; Raston, Colin L.","Selective isolation of Keggin ions using self-assembled superanion capsules †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3639","","10.1039/a905436g","","","0.71073","MoKα","","0.1415","0.0928","","","0.2293","0.2721","","","","","","1.029","","","","has coordinates,has disorder","287753","2023-11-23","09:34:44",""
"7027673","7.66","0.004","19.209","0.003","7.265","0.004","90","","90","","90","","1069","0.8","493.2","","493.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H16 Cu N4 O4 -","- C6 H16 Cu N4 O4 -","- C24 H64 Cu4 N16 O16 -","4","1","","Comba, Peter; Gavrish, Sergey P.; Lampeka, Yaroslaw D.; Lightfoot, Philip; Peters, Alexander","Dimerization of a copper(II) compound with a tetradentate diaminodiamide ligand †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4099","","10.1039/a905437e","","","0.7107","MoKalpha","","","0.0438","","","0.0511","","","","","2.478","2.478","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027674","10.977","0.005","15.243","0.004","13.878","0.004","90","","100.53","0.03","90","","2283","1.4","293.2","","293.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H36 Cu2 N8 O10 -","- C12 H36 Cu2 N8 O10 -","- C48 H144 Cu8 N32 O40 -","4","1","","Comba, Peter; Gavrish, Sergey P.; Lampeka, Yaroslaw D.; Lightfoot, Philip; Peters, Alexander","Dimerization of a copper(II) compound with a tetradentate diaminodiamide ligand †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4099","","10.1039/a905437e","","","0.7107","MoKalpha","","","0.0456","","","0.0438","","","","","3.527","3.527","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027675","24.188","0.005","24.412","0.005","20.087","0.004","90","","113.81","0.03","90","","10851","5","170","1","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H66 Ce Li N4 O19 P4 -","- C36 H44 Ce N4 O19.105 P4 -","- C288 H352 Ce8 N32 O152.84 P32 -","8","2","","Rohovec, Jan; Vojtíšek, Pavel; Hermann, Petr; Mosinger, Jiří; Žák, Zdirad; Lukeš, Ivan","Synthesis, crystal structures and NMR and luminescence spectra of lanthanide complexes of 1,4,7,10-tetraazacyclododecane with N-methylene(phenyl)phosphinic acid pendant arms †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3585","","10.1039/a905460j","","","0.71073","MoKα","","0.169","0.1395","","","0.3719","0.4262","","","","","","1.719","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027676","24.145","0.002","24.458","0.001","20.16","0.002","90","","113.855","0.009","90","","10888.2","1.7","170","1","170","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C36 H66 La Li N4 O19 P4 -","- C36 H44 La N4 O18.675 P4 -","- C288 H352 La8 N32 O149.4 P32 -","8","2","","Rohovec, Jan; Vojtíšek, Pavel; Hermann, Petr; Mosinger, Jiří; Žák, Zdirad; Lukeš, Ivan","Synthesis, crystal structures and NMR and luminescence spectra of lanthanide complexes of 1,4,7,10-tetraazacyclododecane with N-methylene(phenyl)phosphinic acid pendant arms †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3585","","10.1039/a905460j","","","0.71073","MoKα","","0.156","0.1239","","","0.3412","0.3942","","","","","","1.546","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027677","9.332","0.003","10.682","0.004","17.87","0.005","89.36","0.03","79.07","0.03","65.26","0.03","1583.9","1","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H49 Li N O2 P Si2 -","- C27 H49 Li N O2 P Si2 -","- C54 H98 Li2 N2 O4 P2 Si4 -","2","1","","Hitchcock, Peter B.; Lappert, Michael F.; Uiterweerd, Patrick G. H.; Wang, Zhong-Xia","The synthesis and molecular structures of the crystalline 1-aza-2-phospha(V)allyllithium compounds [Li(LL ′ )(OEt2)2] and [Li(LL ′ )]2 [LL ′ = CH(SiMe3)P(Ph)2NSiMe3] and the preparation and characterisation of the new phosphinimines CH(R1)(R2)P(Ph)2 NSiMe3 [R1 = R2 = SiMe3; R1 = H, R2 = Si(Me)2NEt2] †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3413","","10.1039/a905464b","","","0.71073","MoKα","","0.0708","0.0536","","0.1453","0.1325","","","","1.022","1.05","1.05","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027678","10.988","0.002","11.478","0.002","18.753","0.003","100.75","0.01","94.93","0.01","108.83","0.01","2171.9","0.7","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C38 H58 Li2 N2 P2 Si4 -","- C38 H58 Li2 N2 P2 Si4 -","- C76 H116 Li4 N4 P4 Si8 -","2","1","","Hitchcock, Peter B.; Lappert, Michael F.; Uiterweerd, Patrick G. H.; Wang, Zhong-Xia","The synthesis and molecular structures of the crystalline 1-aza-2-phospha(V)allyllithium compounds [Li(LL ′ )(OEt2)2] and [Li(LL ′ )]2 [LL ′ = CH(SiMe3)P(Ph)2NSiMe3] and the preparation and characterisation of the new phosphinimines CH(R1)(R2)P(Ph)2 NSiMe3 [R1 = R2 = SiMe3; R1 = H, R2 = Si(Me)2NEt2] †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3413","","10.1039/a905464b","","","0.71073","MoKα","","0.1154","0.0638","","0.1762","0.1434","","","","1.037","1.074","1.074","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027679","40.162","0.003","9.466","0.004","19.354","0.003","90","","112.937","0.007","90","","6776","3","296.2","","296.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H40 O4 P2 Ru -","- C36 H40 O4 P2 Ru -","- C288 H320 O32 P16 Ru8 -","8","1","","Bennett, Martin A.; Chung, Guandolina; Hockless, David C. R.; Neumann, Horst; Willis, Anthony C.","Bis(acetylacetonato)bis(cyclooctene)ruthenium(II), cis-[Ru(acac)2(η2-C8H14)2]: a synthetic precursor to trans- and cis-bis(acetylacetonato)ruthenium(II) complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3451","","10.1039/a905492h","","","0.7107","MoKα","","","0.033","","","","0.023","","","","","","1.78","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027680","12.27","0.002","15.443","0.004","17.748","0.003","90","","90.46","0.01","90","","3362.9","1.2","296.2","","296.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H40 O4 P2 Ru -","- C36 H40 O4 P2 Ru -","- C144 H160 O16 P8 Ru4 -","4","0.5","","Bennett, Martin A.; Chung, Guandolina; Hockless, David C. R.; Neumann, Horst; Willis, Anthony C.","Bis(acetylacetonato)bis(cyclooctene)ruthenium(II), cis-[Ru(acac)2(η2-C8H14)2]: a synthetic precursor to trans- and cis-bis(acetylacetonato)ruthenium(II) complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3451","","10.1039/a905492h","","","0.7107","MoKα","","","0.029","","","","0.022","","","","","","1.86","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027681","10.571","0.003","13.108","0.004","13.278","0.004","61.84","0.02","69.52","0.02","85.32","0.03","1511.8","0.9","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C62 H62 Cl4 O4 P4 Ru -","- C62 H62 Cl4 O4 P4 Ru -","- C62 H62 Cl4 O4 P4 Ru -","1","0.5","","Bennett, Martin A.; Chung, Guandolina; Hockless, David C. R.; Neumann, Horst; Willis, Anthony C.","Bis(acetylacetonato)bis(cyclooctene)ruthenium(II), cis-[Ru(acac)2(η2-C8H14)2]: a synthetic precursor to trans- and cis-bis(acetylacetonato)ruthenium(II) complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3451","","10.1039/a905492h","","","0.7107","MoKα","","0.069","0.0452","","0.0528","","0.0507","","","2.092","","","2.319","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027682","10.774","0.002","11.362","0.003","13.463","0.003","66.78","0.02","74.2","0.01","86.95","0.02","1454.6","0.6","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C61 H60 Cl2 O4 P4 Ru -","- C61 H60 Cl2 O4 P4 Ru -","- C61 H60 Cl2 O4 P4 Ru -","1","0.5","","Bennett, Martin A.; Chung, Guandolina; Hockless, David C. R.; Neumann, Horst; Willis, Anthony C.","Bis(acetylacetonato)bis(cyclooctene)ruthenium(II), cis-[Ru(acac)2(η2-C8H14)2]: a synthetic precursor to trans- and cis-bis(acetylacetonato)ruthenium(II) complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3451","","10.1039/a905492h","","","0.7107","MoKα","","0.0765","0.0378","","0.0411","","0.0371","","","1.459","","","1.62","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027683","7.516","0.002","7.649","0.002","18.973","0.003","90","","95.2","0.02","90","","1086.3","0.4","203","2","203","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 Cl2 N O2 S2 -","- C8 H7 Cl2 N O2 S2 -","- C32 H28 Cl8 N4 O8 S8 -","4","1","","Boyle, Philip D.; Godfrey, Stephen M.; Pritchard, Robin G.","The reaction of N-methylbenzothiazole-2-selone and 1,1-dimethylselenourea with sulfuryl chloride and dichlorine †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4245","","10.1039/a905552e","","","0.71073","MoKα","","0.0893","0.0689","","","0.148","0.1582","","","","","","1.218","","","","has coordinates,has disorder","179982","2020-10-21","18:00:00",""
"7027684","6.0267","0.001","16.367","0.002","18.116","0.002","90","","97.8","0.02","90","","1770.4","0.4","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C6 H16 Cl6 N4 Se2 -","- C6 H16 Cl6 N4 Se2 -","- C24 H64 Cl24 N16 Se8 -","4","1","","Boyle, Philip D.; Godfrey, Stephen M.; Pritchard, Robin G.","The reaction of N-methylbenzothiazole-2-selone and 1,1-dimethylselenourea with sulfuryl chloride and dichlorine †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4245","","10.1039/a905552e","","","0.71073","MoKα","","0.1207","0.0596","","","0.1232","0.1484","","","","","","1.036","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027685","13.974","0.003","7.633","0.002","10.23","0.002","90","","90","","90","","1091.2","0.4","203","2","203","2","","","","","","","","5","P m n 21","P 2ac -2","31","","","","- C7 H18 Cl10 N4 Se -","- C7 Cl10 N4 Se -","- C14 Cl20 N8 Se2 -","2","0.5","","Boyle, Philip D.; Godfrey, Stephen M.; Pritchard, Robin G.","The reaction of N-methylbenzothiazole-2-selone and 1,1-dimethylselenourea with sulfuryl chloride and dichlorine †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4245","","10.1039/a905552e","","","0.71073","MoKα","","0.0751","0.0467","","","0.1147","0.1314","","","","","","1.028","","","","has coordinates,has disorder","179982","2020-10-21","18:00:00",""
"7027686","7.555","0.002","15.516","0.002","9.9151","0.001","90","","90","","90","","1162.3","0.4","203","2","203","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C3 H8 Cl6 N2 Se -","- C3 H8 Cl6 N2 Se -","- C12 H32 Cl24 N8 Se4 -","4","0.5","","Boyle, Philip D.; Godfrey, Stephen M.; Pritchard, Robin G.","The reaction of N-methylbenzothiazole-2-selone and 1,1-dimethylselenourea with sulfuryl chloride and dichlorine †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4245","","10.1039/a905552e","","","0.71073","MoKα","","0.2377","0.0549","","","0.0909","0.14","","","","","","0.866","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027687","22.4593","0.0007","9.4978","0.0003","21.4978","0.0006","90","","113.094","0.0014","90","","4218.3","0.2","180","2","180","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C34 H45 Cl7 N2 P2 Si2 Ti -","- C34 H45 Cl7 N2 P2 Si2 Ti -","- C136 H180 Cl28 N8 P8 Si8 Ti4 -","4","1","","Sarsfield, Mark J.; Thornton-Pett, Mark; Bochmann, Manfred","Facile formation of a titanium‒carbon bond from TiCl4 by HCl elimination: the synthesis and structure of TiCl3[Me3SiNP(Ph)2CHCH2P(Ph)2NSiMe3] †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3329","","10.1039/a905574f","","","0.71073","MoKα","","0.0505","0.0476","","","0.1176","0.1201","","","","","","1.041","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027688","7.8614","0.0007","7.9384","0.0005","10.4874","0.0006","89.938","0.003","81.778","0.005","70.111","0.005","608.33","0.08","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H26 Cu2 N14 O10 -","- C10 H26 Cu2 N14 O10 -","- C10 H26 Cu2 N14 O10 -","1","0.5","","Goodgame, David M. L.; Hussain, Izhar; White, Andrew J. P.; Williams, David J.","Synthesis and structure of a copper(II) melamine complex, [Cu(C3H6N6)(μ-OCH3)(ONO2)(HOCH3)]2, with direct Cu–melamine coordination","Journal of the Chemical Society, Dalton Transactions","1999","","17","2899","","10.1039/a905576b","","","1.54178","CuKα","","0.0446","0.0357","","0.1194","0.0918","","","","1.12","1.133","1.133","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027689","8.91","0.012","26.75","0.03","9.245","0.009","90","","117.61","0.01","90","","1953","4","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","L3","","","- C21 H26 N2 O2 -","- C21 H26 N2 O2 -","- C84 H104 N8 O8 -","4","1","","Iveson, Peter B.; Drew, Michael G. B.; Hudson, Michael J.; Madic, Charles","Structural studies of lanthanide complexes with new hydrophobic malonamide solvent extraction agents †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3605","","10.1039/a905579g","","","0.71073","MoKα","","0.0699","0.0527","","","0.1465","0.1596","","","","","","1.081","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027690","9.08","0.009","9.666","0.012","13.158","0.014","76.504","0.01","81.19","0.01","61.322","0.01","984.1","1.9","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H26 N2 O3 -","- C21 H26 N2 O3 -","- C42 H52 N4 O6 -","2","1","","Iveson, Peter B.; Drew, Michael G. B.; Hudson, Michael J.; Madic, Charles","Structural studies of lanthanide complexes with new hydrophobic malonamide solvent extraction agents †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3605","","10.1039/a905579g","","","0.71073","MoKα","","0.0866","0.0571","","","0.1641","0.1837","","","","","","1.085","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027691","26.48","0.03","9.833","0.012","18.58","0.02","90","","96.725","0.01","90","","4805","10","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C42 H52 N7 Nd O13 -","- C42 H52 N7 Nd O13 -","- C168 H208 N28 Nd4 O52 -","4","0.5","","Iveson, Peter B.; Drew, Michael G. B.; Hudson, Michael J.; Madic, Charles","Structural studies of lanthanide complexes with new hydrophobic malonamide solvent extraction agents †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3605","","10.1039/a905579g","","","0.71073","MoKα","","0.0647","0.0503","","","0.1253","0.1333","","","","","","1.05","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027692","27.76","0.03","18.22","0.02","19.12","0.02","90","","97.73","0.01","90","","9583","18","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H52 N7 Nd O15 -","- C42.5 H51.5 N7 Nd O15.5 -","- C340 H412 N56 Nd8 O124 -","8","2","","Iveson, Peter B.; Drew, Michael G. B.; Hudson, Michael J.; Madic, Charles","Structural studies of lanthanide complexes with new hydrophobic malonamide solvent extraction agents †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3605","","10.1039/a905579g","","","0.71073","MoKα","","0.1254","0.0709","","","0.1716","0.2022","","","","","","1.04","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027693","27.79","0.03","18.26","0.02","19.16","0.02","90","","97.797","0.01","90","","9633","18","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C42 H52 N7 O15 Pr -","- C42 H52 N7 O15 Pr -","- C336 H416 N56 O120 Pr8 -","8","2","","Iveson, Peter B.; Drew, Michael G. B.; Hudson, Michael J.; Madic, Charles","Structural studies of lanthanide complexes with new hydrophobic malonamide solvent extraction agents †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3605","","10.1039/a905579g","","","0.71073","MoKα","","0.1922","0.1119","","","0.1504","0.1745","","","","","","1.107","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027694","11.197","0.002","12.727","0.002","18.012","0.003","90","","90","","90","","2566.8","0.7","294","2","294","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C14 H40 B16 Fe N2 -","- C14 H40 B16 Fe N2 -","- C56 H160 B64 Fe4 N8 -","4","1","","Grüner, Bohumír; Teixidor, Francesc; Viñas, Clara; Sillanpää, Reijo; Kivekäs, Raikko; Štíbr, Bohumil","Ferratricarbollide design for molecular assemblies: complexes [9,9′-(ButHN)2-commo-2,2′-M-closo-1,7,9-(C3B8H10)-1′,7′,9′-(C3B8H10)] (where M = Fe or Ru), the first examples of double-cluster metallatricarbollides †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3337","","10.1039/a905606h","","","0.71069","MoKα","","0.0478","0.0347","","","0.0943","0.1013","","","","","","1.04","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027695","11.846","0.002","19.816","0.002","11.089","0.002","90","","90","","90","","2603","0.7","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H40 B16 N2 Ru -","- C14 H40 B16 N2 Ru -","- C56 H160 B64 N8 Ru4 -","4","1","","Grüner, Bohumír; Teixidor, Francesc; Viñas, Clara; Sillanpää, Reijo; Kivekäs, Raikko; Štíbr, Bohumil","Ferratricarbollide design for molecular assemblies: complexes [9,9′-(ButHN)2-commo-2,2′-M-closo-1,7,9-(C3B8H10)-1′,7′,9′-(C3B8H10)] (where M = Fe or Ru), the first examples of double-cluster metallatricarbollides †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3337","","10.1039/a905606h","","","0.71069","MoKα","","0.0396","0.0302","","","0.0762","0.0813","","","","","","1.041","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027696","12.8413","0.0003","23.9689","0.0003","14.0305","0.0005","90","","90","","90","","4318.47","0.19","150","2","150","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C28 H40 F18 N11 P3 Ru -","- C28 H40 F18 N11 P3 Ru -","- C112 H160 F72 N44 P12 Ru4 -","4","1","","Coe, Benjamin J.; Harris, James A.; Asselberghs, Inge; Persoons, André; Jeffery, John C.; Rees, Leigh H.; Gelbrich, Thomas; Hursthouse, Michael B.","Tuning of charge-transfer absorption and molecular quadratic non-linear optical properties in ruthenium(II) ammine complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3617","","10.1039/a905652a","","","0.71073","MoKα","","0.0972","0.0482","","","0.0867","0.0979","","","","","","0.958","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027697","7.273","0.001","10.691","0.001","11.229","0.001","103.77","0.02","105.76","0.02","99.61","0.02","790.7","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H20 Cl6 Cu O6 -","- C32 H20 Cl6 Cu O6 -","- C32 H20 Cl6 Cu O6 -","1","0.5","","Balogh-Hergovich, Éva; Kaizer, József; Speier, Gábor; Argay, Gyula; Párkányi, László","Kinetic studies on the copper(II)-mediated oxygenolysis of the flavonolate ligand. Crystal structures of [Cu(fla)2] (fla = flavonolate) and [Cu(O-bs)2(py)3] (O-bs = O-benzoylsalicylate) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3847","","10.1039/a905684j","","","1.5418","CuKa","","0.0714","0.0529","","0.1717","0.1472","","","","0.488","0.501","0.501","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027698","30.948","0.003","9.641","0.001","16.159","0.001","90","","115.53","0.01","90","","4350.6","0.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C47.59 H37.59 Cu N3.92 O8 -","- C47.584 H37.584 Cu N3.916 O8 -","- C190.336 H150.336 Cu4 N15.664 O32 -","4","0.5","","Balogh-Hergovich, Éva; Kaizer, József; Speier, Gábor; Argay, Gyula; Párkányi, László","Kinetic studies on the copper(II)-mediated oxygenolysis of the flavonolate ligand. Crystal structures of [Cu(fla)2] (fla = flavonolate) and [Cu(O-bs)2(py)3] (O-bs = O-benzoylsalicylate) †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3847","","10.1039/a905684j","","","1.5418","CuKα","","0.0486","0.0463","","","0.1376","0.1404","","","","","","1.057","","","","has coordinates,has disorder","179982","2020-10-21","18:00:00",""
"7027699","8.899","0.002","14.465","0.002","11.046","0.002","90","","91.44","0.01","90","","1421.4","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H5 As2 Co Mo O5 -","- C10 H5 As2 Co Mo O5 -","- C40 H20 As8 Co4 Mo4 O20 -","4","1","","Adams, Katherine V.; Choi, Nick; Conole, Gráinne; Davies, John E.; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Raithby, Paul R.","Synthesis, reactivity and structural characterization of some heterometallic complexes containing naked arsenic ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3679","","10.1039/a905688b","","","0.71073","MoKα","","0.1101","0.0409","","0.1831","0.0959","","","","1.025","1.081","1.081","","","","","has coordinates","179982","2020-10-21","18:00:00",""
"7027700","8.899","0.002","14.471","0.003","11.046","0.002","90","","91.42","0.03","90","","1422","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C10 H5 As2 Co O5 W -","- C10 H5 As2 Co O5 W -","- C40 H20 As8 Co4 O20 W4 -","4","1","","Adams, Katherine V.; Choi, Nick; Conole, Gráinne; Davies, John E.; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Raithby, Paul R.","Synthesis, reactivity and structural characterization of some heterometallic complexes containing naked arsenic ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3679","","10.1039/a905688b","","","0.71073","MoKα","","0.081","0.0428","","0.1347","0.1122","","","","0.9","0.887","0.887","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027701","12.772","0.001","20.831","0.002","10.493","0.002","90.43","0.01","103.48","0.01","90.82","0.01","2714.3","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C27 H20 As2 Co O4 P W -","- C27 H20 As2 Co O4 P W -","- C108 H80 As8 Co4 O16 P4 W4 -","4","2","","Adams, Katherine V.; Choi, Nick; Conole, Gráinne; Davies, John E.; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Raithby, Paul R.","Synthesis, reactivity and structural characterization of some heterometallic complexes containing naked arsenic ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3679","","10.1039/a905688b","","","0.71073","MoKα","","0.1131","0.0539","","","0.1457","0.1715","","","","","","1.024","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027702","8.913","0.004","19.628","0.006","16.694","0.004","90","","99.77","0.03","90","","2878.2","1.7","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H5 As2 Co Cr2 Mo O15 -","- C20 As2 Co Cr2 Mo O15 -","- C80 As8 Co4 Cr8 Mo4 O60 -","4","1","","Adams, Katherine V.; Choi, Nick; Conole, Gráinne; Davies, John E.; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Raithby, Paul R.","Synthesis, reactivity and structural characterization of some heterometallic complexes containing naked arsenic ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3679","","10.1039/a905688b","","","0.71073","MoKα","","0.1815","0.0746","","","0.1284","0.156","","","","","","0.921","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027703","14.042","0.002","7.513","0.0015","20.877","0.004","90","","91.762","0.009","90","","2201.4","0.7","295","2","295","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C21 H15 As Mo O6 W2 -","- C21 As Mo1.005 O6 W2.005 -","- C84 As4 Mo4.02 O24 W8.02 -","4","1","","Adams, Katherine V.; Choi, Nick; Conole, Gráinne; Davies, John E.; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Raithby, Paul R.","Synthesis, reactivity and structural characterization of some heterometallic complexes containing naked arsenic ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3679","","10.1039/a905688b","","","0.71073","MoKα","","0.0949","0.0625","","","0.1595","0.1803","","","","","","1.049","","","","has coordinates,has disorder","179983","2020-10-21","18:00:00",""
"7027704","18.016","0.003","10.071","0.003","22.979","0.004","90","","105.838","0.014","90","","4011","1.6","295","","295","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C35 H37 Cl3 F6 O4 P3 Ru -","- C35 H37 Cl3 F6 O4 P3 Ru -","- C140 H148 Cl12 F24 O16 P12 Ru4 -","4","1","","Chang, Chao-Wan; Lin, Ying-Chih; Lee, Gene-Hsiang; Wang, Yu","Reactions of ruthenium acetylide complexes with benzylidenemalonitrile †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4223","","10.1039/a905788i","","","0.71073","MolybdenumKα","","0.084","0.045","","0.05","0.047","","","","","1.83","1.83","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027705","12.1184","0.0018","14.917","0.008","13.498","0.003","90","","92.155","0.014","90","","2438.3","1.5","295","","295","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C26 H24 N2 O3 P Ru -","- C26 H24 N2 O3 P Ru -","- C104 H96 N8 O12 P4 Ru4 -","4","1","","Chang, Chao-Wan; Lin, Ying-Chih; Lee, Gene-Hsiang; Wang, Yu","Reactions of ruthenium acetylide complexes with benzylidenemalonitrile †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4223","","10.1039/a905788i","","","0.71073","MolybdenumKα","","0.139","0.058","","0.059","0.052","","","","","1.69","1.69","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027706","11.3426","0.0014","31.489","0.005","11.0026","0.0018","90","","104.206","0.012","90","","3809.6","1","295","","295","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C44 H40 N2 O3 P2 Ru -","- C44 H40 N2 O3 P2 Ru -","- C176 H160 N8 O12 P8 Ru4 -","4","1","","Chang, Chao-Wan; Lin, Ying-Chih; Lee, Gene-Hsiang; Wang, Yu","Reactions of ruthenium acetylide complexes with benzylidenemalonitrile †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4223","","10.1039/a905788i","","","0.71073","MolybdenumKα","","0.12","0.043","","0.05","0.04","","","","","1.21","1.21","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027707","10.4298","0.0014","13.883","0.003","18.082","0.004","107.468","0.022","91.791","0.02","108.375","0.015","2347.1","0.9","295","","295","","","","","","","","","6","P -1","-P 1","2","","","","- C53 H42 N4 O4 P2 Ru -","- C53 H42 N4 O4 P2 Ru -","- C106 H84 N8 O8 P4 Ru2 -","2","1","","Chang, Chao-Wan; Lin, Ying-Chih; Lee, Gene-Hsiang; Wang, Yu","Reactions of ruthenium acetylide complexes with benzylidenemalonitrile †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4223","","10.1039/a905788i","","","0.71073","MolybdenumKα","","0.11","0.044","","0.041","0.035","","","","","1.24","1.24","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027708","14.9993","0.0008","15.351","0.001","15.4699","0.0009","102.912","0.009","106.361","0.009","103.676","0.009","3156.1","0.5","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C144 H166 O13 P4 -","- C144 H152 O12.5 P4 -","- C144 H152 O12.5 P4 -","1","0.5","","Dieleman, Cedric B.; Marsol, Claire; Matt, Dominique; Kyritsakas, Nathalie; Harriman, Anthony; Kintzinger, Jean-Pierre","Co-ordination chemistry of macrocyclic compounds with dangling phosphines. Unusual NMR shifts in metallo-calix[4]arenes †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4139","","10.1039/a905814a","","","0.71073","Mo-Kα","","0.177","0.085","","0.181","","0.109","","","2.047","","","1.225","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027709","12.571","0.001","22.5546","0.0003","26.4894","0.0003","90","","90","","90","","7510.6","0.6","173","","173","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C146 H170 Cl16 O9 P4 Pt2 -","- C146 H152 Cl16 O9 P4 Pt2 -","- C292 H304 Cl32 O18 P8 Pt4 -","2","0.5","","Dieleman, Cedric B.; Marsol, Claire; Matt, Dominique; Kyritsakas, Nathalie; Harriman, Anthony; Kintzinger, Jean-Pierre","Co-ordination chemistry of macrocyclic compounds with dangling phosphines. Unusual NMR shifts in metallo-calix[4]arenes †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4139","","10.1039/a905814a","","","0.71073","Mo-Kα","","0.068","0.05","","0.371","","0.068","","","5.859","","","1.028","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7027710","10.3178","0.0018","16.64","0.004","25.407","0.005","90","","90.651","0.014","90","","4361.8","1.6","143","2","143","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C46 H32 Au2 F10 N2 P2 -","- C46 H32 Au2 F10 N2 P2 -","- C184 H128 Au8 F40 N8 P8 -","4","1","","Bella, Pedro A.; Crespo, Olga; Fernández, Eduardo J.; Fischer, Axel K.; Jones, Peter G.; Laguna, Antonio; López-de-Luzuriaga, José M.; Monge, Miguel","Gold complexes of 3,4-bis(diphenylphosphinoamino)toluene and 1,2-bis(diphenylphosphinoamino)benzene. A comparative study †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4009","","10.1039/a905857e","","","0.71073","MoKα","","0.0824","0.0488","","","0.0975","0.1141","","","","","","1.019","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027711","12.155","0.004","20.02","0.005","15.609","0.004","90","","110.08","0.03","90","","3567.5","1.9","173","2","173","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C66 H60 Au2 Cl4 F6 N4 O6 P4 S2 -","- C66 H60 Au2 Cl4 F6 N4 O6 P4 S2 -","- C132 H120 Au4 Cl8 F12 N8 O12 P8 S4 -","2","0.5","","Bella, Pedro A.; Crespo, Olga; Fernández, Eduardo J.; Fischer, Axel K.; Jones, Peter G.; Laguna, Antonio; López-de-Luzuriaga, José M.; Monge, Miguel","Gold complexes of 3,4-bis(diphenylphosphinoamino)toluene and 1,2-bis(diphenylphosphinoamino)benzene. A comparative study †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4009","","10.1039/a905857e","","","0.71073","MoKα","","0.0871","0.0468","","0.1002","0.0905","","","","0.929","1.054","1.054","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027712","13.641","0.004","29.735","0.008","17.361","0.006","90","","98.26","0.03","90","","6969","4","143","2","143","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C66 H64 Au Cl9 N4 O4 P4 -","- C66 H58 Au Cl9 N4 O4 P4 -","- C264 H232 Au4 Cl36 N16 O16 P16 -","4","1","","Bella, Pedro A.; Crespo, Olga; Fernández, Eduardo J.; Fischer, Axel K.; Jones, Peter G.; Laguna, Antonio; López-de-Luzuriaga, José M.; Monge, Miguel","Gold complexes of 3,4-bis(diphenylphosphinoamino)toluene and 1,2-bis(diphenylphosphinoamino)benzene. A comparative study †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4009","","10.1039/a905857e","","","0.71073","MoKα","","0.1333","0.076","","0.1945","0.1603","","","","1.025","1.069","1.069","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027713","11.342","0.003","14.518","0.003","22.25","0.005","94.1","0.02","102.22","0.02","106.32","0.02","3402.8","1.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C73 H42 Au2 F30 N2 P2 -","- C73 H42 Au2 F30 N2 P2 -","- C146 H84 Au4 F60 N4 P4 -","2","1","","Bella, Pedro A.; Crespo, Olga; Fernández, Eduardo J.; Fischer, Axel K.; Jones, Peter G.; Laguna, Antonio; López-de-Luzuriaga, José M.; Monge, Miguel","Gold complexes of 3,4-bis(diphenylphosphinoamino)toluene and 1,2-bis(diphenylphosphinoamino)benzene. A comparative study †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4009","","10.1039/a905857e","","","0.71073","MoKα","","0.0908","0.0518","","0.125","0.1139","","","","0.91","1.06","1.06","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027714","13.651","0.002","16.877","0.002","17.226","0.002","104.44","0.02","104.18","0.02","90.93","0.02","3713.5","1","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C72 H35 Au2 Cl4 F30 N2 P2 S2 -","- C72 H25 Au2 Cl4 F30 N2 P2 S2 -","- C144 H50 Au4 Cl8 F60 N4 P4 S4 -","2","1","","Bella, Pedro A.; Crespo, Olga; Fernández, Eduardo J.; Fischer, Axel K.; Jones, Peter G.; Laguna, Antonio; López-de-Luzuriaga, José M.; Monge, Miguel","Gold complexes of 3,4-bis(diphenylphosphinoamino)toluene and 1,2-bis(diphenylphosphinoamino)benzene. A comparative study †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4009","","10.1039/a905857e","","","0.71073","MoKα","","0.2037","0.0939","","","0.1925","0.2291","","","","","","0.939","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027715","15.0004","0.001","15.307","0.002","23.393","0.003","87.517","0.01","72.928","0.01","62.925","0.01","4546.1","1","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C96 H68 Au3 F30 N2 O2 P3 -","- C96 H65.647 Au3 F30 N2 O2 P3 -","- C192 H131.294 Au6 F60 N4 O4 P6 -","2","1","","Bella, Pedro A.; Crespo, Olga; Fernández, Eduardo J.; Fischer, Axel K.; Jones, Peter G.; Laguna, Antonio; López-de-Luzuriaga, José M.; Monge, Miguel","Gold complexes of 3,4-bis(diphenylphosphinoamino)toluene and 1,2-bis(diphenylphosphinoamino)benzene. A comparative study †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4009","","10.1039/a905857e","","","0.71073","MoKα","","0.0824","0.0445","","","0.0724","0.0836","","","","","","1.041","","","","has coordinates,has disorder","179983","2020-10-21","18:00:00",""
"7027716","16.955","0.004","16.955","0.004","17.853","0.006","90","","90","","120","","4445","2","200","2","293","2","","","","","","","","5","R -3 :H","-R 3","148","","","","- C45 H86 O13 Si8 Ti -","- C44.98 H85.98 O13 Si8 Ti -","- C134.94 H257.94 O39 Si24 Ti3 -","3","0.166667","","Crocker, Mark; Herold, Ruud H. M.; Orpen, A. Guy; Overgaag, Martijn T. A.","Synthesis and characterisation of titanium silasesquioxane complexes: soluble models for the active site in titanium silicate epoxidation catalysts †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3791","","10.1039/a905887g","","","0.71073","MoKα","","0.1535","0.1071","","0.3075","0.2692","","","","1.397","1.655","1.655","","","","","has coordinates,has disorder","179983","2020-10-21","18:00:00",""
"7027717","21.085","0.008","22.498","0.008","27.786","0.01","73.86","0.03","77.13","0.03","87.37","0.03","12341","8","200","2","200","2","","","","","","","","5","P -1","-P 1","2","","","","- C97 H180 O24 Si16 Ti -","- C97 H146 O24 Si16 Ti -","- C388 H584 O96 Si64 Ti4 -","4","2","","Crocker, Mark; Herold, Ruud H. M.; Orpen, A. Guy; Overgaag, Martijn T. A.","Synthesis and characterisation of titanium silasesquioxane complexes: soluble models for the active site in titanium silicate epoxidation catalysts †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3791","","10.1039/a905887g","","","0.71073","MoKα","","0.2097","0.1342","","0.3476","0.3042","","","","1.414","1.695","1.695","","","","","has coordinates,has disorder","179983","2020-10-21","18:00:00",""
"7027718","10.866","0.0005","11.514","0.0003","14.591","0.0007","90","","98.092","0.002","90","","1807.32","0.13","150","","150","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H2 B F15 O -","- C18 H2 B F15 O -","- C72 H8 B4 F60 O4 -","4","1","","Doerrer, Linda H.; Green, Malcolm L. H.","Oxidation of [M(η-C5H5)2], M = Cr, Fe or Co, by the new Brønsted acid H2O·B(C6F5)3 yielding the salts [M(η-C5H5)2]+A−, where A− = [(C6F5)3B(μ-OH)B(C6F5)3]− or [(C6F5)3BOH · · · H2OB(C6F5)3]− †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4325","","10.1039/a905892c","","","0.71069","MoKα","","","0.0765","","","","0.0505","","","","","","1.1206","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027719","14.231","0.003","24.002","0.005","14.202","0.003","90","","90.63","0.03","90","","4850.7","1.8","150","","0","","","","","","","","?","7","C 1 2/c 1","-C 2yc","15","","","","- C23.5 H7 B Cl Cr0.5 F15 O -","- C23.5 H7 B Cl Cr0.5 F15 O -","- C188 H56 B8 Cl8 Cr4 F120 O8 -","8","1","","Doerrer, Linda H.; Green, Malcolm L. H.","Oxidation of [M(η-C5H5)2], M = Cr, Fe or Co, by the new Brønsted acid H2O·B(C6F5)3 yielding the salts [M(η-C5H5)2]+A−, where A− = [(C6F5)3B(μ-OH)B(C6F5)3]− or [(C6F5)3BOH · · · H2OB(C6F5)3]− †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4325","","10.1039/a905892c","","","0.71073","MoKα","","","0.0949","","","","0.0601","","","","","","0.9257","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027720","14.254","0.003","23.887","0.005","14.073","0.003","90","","90.52","0.03","90","","4791.5","1.8","125","","125","","","","","","","","?","7","C 1 2/c 1","-C 2yc","15","","","","- C23.25 H7 B Cl0.5 F15 Fe0.5 O -","- C23.25 H7 B Cl0.5 F15 Fe0.5 O -","- C186 H56 B8 Cl4 F120 Fe4 O8 -","8","1","","Doerrer, Linda H.; Green, Malcolm L. H.","Oxidation of [M(η-C5H5)2], M = Cr, Fe or Co, by the new Brønsted acid H2O·B(C6F5)3 yielding the salts [M(η-C5H5)2]+A−, where A− = [(C6F5)3B(μ-OH)B(C6F5)3]− or [(C6F5)3BOH · · · H2OB(C6F5)3]− †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4325","","10.1039/a905892c","","","0.71073","MoKα","","","0.0551","","","","0.0629","","","","","","0.7758","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027721","14.253","0.0009","24.178","0.0009","14.135","0.0008","90","","90","0.003","90","","4871","0.5","150","","150","","","","","","","","?","7","C 1 2/c 1","-C 2yc","15","","","","- C23.5 H7 B Cl Co0.5 F15 O -","- C23.5 H7 B Cl Co0.5 F15 O -","- C188 H56 B8 Cl8 Co4 F120 O8 -","8","1","","Doerrer, Linda H.; Green, Malcolm L. H.","Oxidation of [M(η-C5H5)2], M = Cr, Fe or Co, by the new Brønsted acid H2O·B(C6F5)3 yielding the salts [M(η-C5H5)2]+A−, where A− = [(C6F5)3B(μ-OH)B(C6F5)3]− or [(C6F5)3BOH · · · H2OB(C6F5)3]− †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4325","","10.1039/a905892c","","","0.71069","MoKα","","","0.0792","","","","0.0874","","","","","","0.8863","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027722","10.271","0.002","10.675","0.002","11.517","0.002","102.19","0.03","102.93","0.03","117.93","0.03","1011.5","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H10 Fe2 O6 P S -","- C18 H10 Fe2 O6 P S -","- C36 H20 Fe4 O12 P2 S2 -","2","1","","Choi, Nick; Conole, Gráinne; Kessler, Margalith; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Pateman, Giles E.; Solan, Gregory A.","Synthesis of a sulfido-capped triiron cluster with bridging phosphido ligands and its reactions with alkynes, phosphites and phosphines †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3941","","10.1039/a905931h","","","0.71073","MoKα","","0.0812","0.0449","","0.0986","0.0845","","","","1.023","1.082","1.082","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027723","12.574","0.002","16.1199","0.0013","18.8859","0.0015","90","","90","","90","","3828","0.7","293","2","570","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C38 H31 Fe3 O6 P3 S -","- C38 H31 Fe3 O6 P3 S -","- C152 H124 Fe12 O24 P12 S4 -","4","1","","Choi, Nick; Conole, Gráinne; Kessler, Margalith; King, Jason D.; Mays, Martin J.; McPartlin, Mary; Pateman, Giles E.; Solan, Gregory A.","Synthesis of a sulfido-capped triiron cluster with bridging phosphido ligands and its reactions with alkynes, phosphites and phosphines †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3941","","10.1039/a905931h","","","0.71073","MoKα","","0.0818","0.0473","","","0.076","0.0893","","","","","","1.016","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027724","16.464","0.003","14.203","0.002","19.59","0.002","90","","91.844","0.009","90","","4578.5","1.2","270","2","270","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H67 N O11 U -","- C42 H60 N O11 U -","- C168 H240 N4 O44 U4 -","4","1","","Thuéry, Pierre; Nierlich, Martine; Masci, Bernardo; Asfari, Zouhair; Vicens, Jacques","An unprecedented trigonal coordination geometry for the uranyl ion in its complex with p-tert-butylhexahomotrioxacalix[3]arene","Journal of the Chemical Society, Dalton Transactions","1999","","18","3151","","10.1039/a905939c","","","0.71073","MoKα","","0.1384","0.0816","","","0.172","0.2008","","","","","","1.078","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027725","16.481","0.002","14.2749","0.0015","20.314","0.002","90","","90.02","0.003","90","","4779.2","0.9","270","2","270","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C45 H70 N2 O11 U -","- C45 H57 N2 O11 U -","- C180 H228 N8 O44 U4 -","4","1","","Thuéry, Pierre; Nierlich, Martine; Masci, Bernardo; Asfari, Zouhair; Vicens, Jacques","An unprecedented trigonal coordination geometry for the uranyl ion in its complex with p-tert-butylhexahomotrioxacalix[3]arene","Journal of the Chemical Society, Dalton Transactions","1999","","18","3151","","10.1039/a905939c","","","0.71073","MoKα","","0.1606","0.0744","","","0.1528","0.1891","","","","","","1.051","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027726","35.97","0.003","9.9454","0.0005","5.3287","0.0003","90","","92.66","0.008","90","","1904.2","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H32 S18 -","- C23 H32 S18 -","- C46 H64 S36 -","2","0.5","","Robertson, Neil; Vukojevic, Sascha; Liu, Xiaoming; Yellowlees, Lesley J.; Parsons, Simon","Synthesis and complexation of tetrathiafulvalene derivatives functionalised with [15]aneS5 thioether crowns †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3913","","10.1039/a905996b","","","0.71073","MoKα","","0.0453","0.0349","","","0.0897","0.0951","","","","","","1.018","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027727","7.272","0.001","9.336","0.001","13.605","0.001","83.05","0.01","84.24","0.01","83.45","0.01","907.38","0.17","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","1,10-Phenanthroline-5,6-dione","","- C12 H6 N2 O2 -","- C12 H6 N2 O2 -","- C48 H24 N8 O8 -","4","2","","Calderazzo, Fausto; Marchetti, Fabio; Pampaloni, Guido; Passarelli, Vincenzo","Co-ordination properties of 1,10-phenanthroline-5,6-dione towards group 4 and 5 metals in low and high oxidation states †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4389","","10.1039/a906016b","","","0.71073","MoKα","","0.0774","0.0436","","","0.1003","0.1154","","","","","","1.049","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027728","11.0751","0.0009","11.7693","0.001","13.5004","0.0011","104.461","0.002","104.083","0.002","93.135","0.002","1640.2","0.2","160","2","160","2","","","","","","","","5","P -1","-P 1","2","","","","- C72 H88 B2 Ba O14 -","- C72 H88 B2 Ba O14 -","- C72 H88 B2 Ba O14 -","1","0.5","","Errington, R. John; Tombul, Mustafa; Walker, Gary L. P.; Clegg, William; Heath, Sarah L.; Horsburgh, Lynne","Tetraphenoxoborate complexes of barium: crystal structures of the metalloborates [Ba(thf )4{B(OPh)4}2] and [Ba(dme)2{B(OPh)4}2] †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3533","","10.1039/a906089h","","","0.71073","MoKα","","0.029","0.0289","","0.0785","0.0783","","","","1.076","1.076","1.076","","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027729","11.2348","0.0006","20.0431","0.0011","25.0246","0.0013","90","","90.881","0.002","90","","5634.4","0.5","160","2","160","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C58 H65 B2 Ba O13 -","- C56 H60 B2 Ba O12 -","- C224 H240 B8 Ba4 O48 -","4","1","","Errington, R. John; Tombul, Mustafa; Walker, Gary L. P.; Clegg, William; Heath, Sarah L.; Horsburgh, Lynne","Tetraphenoxoborate complexes of barium: crystal structures of the metalloborates [Ba(thf )4{B(OPh)4}2] and [Ba(dme)2{B(OPh)4}2] †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3533","","10.1039/a906089h","","","0.71073","MoKα","","0.0874","0.0443","","","0.0868","0.0985","","","","","","0.977","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027730","10.312","0.003","12.391","0.002","13.02","0.003","63.94","0.01","84.54","0.02","80.56","0.02","1473.8","0.6","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C24 H27 Cl3 N2 O10 Re -","- C24 H24 Cl3 N2 O10 Re -","- C48 H48 Cl6 N4 O20 Re2 -","2","1","","Bélanger, Suzanne; Gilbertson, Michelle; Yoon, Dong I.; Stern, Charlotte L.; Dang, Xiaojun; Hupp, Joseph T.","A luminescent tricarbonylchlororhenium(I) complex featuring a flexible “crown ether” ligand. Manipulation of photoexcited state properties via binding of small cations †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3407","","10.1039/a906106a","","","0.7107","MoKα","","0.1203","","","0.1269","","","","","1.804","1.804","1.804","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027731","14.8661","0.0011","16.9066","0.0012","11.6709","0.0008","90","","111.654","0.001","90","","2726.3","0.3","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H24 Cl N2 O11 Re -","- C23 H24 Cl N2 O11 Re -","- C92 H96 Cl4 N8 O44 Re4 -","4","1","","Bélanger, Suzanne; Gilbertson, Michelle; Yoon, Dong I.; Stern, Charlotte L.; Dang, Xiaojun; Hupp, Joseph T.","A luminescent tricarbonylchlororhenium(I) complex featuring a flexible “crown ether” ligand. Manipulation of photoexcited state properties via binding of small cations †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3407","","10.1039/a906106a","","","0.7107","MoKα","","0.0658","","","0.083","","","","","1.428","1.428","1.428","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027732","13.277","0.004","13.61","0.003","13.053","0.003","96.97","0.02","103.869","0.01","101.16","0.02","2211.5","1","290.2","","290.2","","","","","","","","","6","P -1","-P 1","2","","","","- C49 H62 B P2 Ru S -","- C49 H62 B P2 Ru S -","- C98 H124 B2 P4 Ru2 S2 -","2","1","","Coto, Alberto; de los Ríos, Isaac; Tenorio, Manuel Jiménez; Puerta, M. Carmen; Valerga, Pedro","S‒H Bond cleavage versus thiol co-ordination in half-sandwich ruthenium complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4309","","10.1039/a906110j","","","1.5418","CuKalpha","","","0.0584","","","0.0744","","","","","3.361","3.361","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027733","19.449","0.004","17.442","0.002","15.578","0.002","90","","90","","90","","5284.5","1.4","290.2","","290.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C25 H42 P2 Ru S -","- C25 H42 P2 Ru S -","- C200 H336 P16 Ru8 S8 -","8","1","","Coto, Alberto; de los Ríos, Isaac; Tenorio, Manuel Jiménez; Puerta, M. Carmen; Valerga, Pedro","S‒H Bond cleavage versus thiol co-ordination in half-sandwich ruthenium complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4309","","10.1039/a906110j","","","0.7107","MoKalpha","","","0.0503","","","0.0624","","","","","1.912","1.912","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027734","8.374","0.001","21.546","0.003","11.939","0.002","90","","92.98","0.02","90","","2151.2","0.5","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22 H19 Cl2 Cu N5 -","- C22 H19 Cl2 Cu N5 -","- C88 H76 Cl8 Cu4 N20 -","4","1","","Hemmert, Catherine; Renz, Michael; Gornitzka, Heinz; Meunier, Bernard","Synthesis, characterization and crystal structures of copper(II) complexes containing multidentate polypyridine ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3989","","10.1039/a906118e","","","0.71073","MoKα","","0.086","0.0433","","","0.0964","0.1051","","","","","","0.768","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027735","12.506","0.001","12.998","0.001","15.891","0.002","90","","105.98","0.01","90","","2483.3","0.4","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H27 Cu N5 O6 S -","- C24 H27 Cu N5 O6 S -","- C96 H108 Cu4 N20 O24 S4 -","4","1","","Hemmert, Catherine; Renz, Michael; Gornitzka, Heinz; Meunier, Bernard","Synthesis, characterization and crystal structures of copper(II) complexes containing multidentate polypyridine ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3989","","10.1039/a906118e","","","0.71073","MoKα","","0.0559","0.0324","","","0.0605","0.064","","","","","","0.824","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027736","15.009","0.001","15.807","0.002","22.516","0.002","90","","99.45","0.01","90","","5269.4","0.9","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H22 B2 Cu F8 N6 -","- C24 H22 B2 Cu F8 N6 -","- C192 H176 B16 Cu8 F64 N48 -","8","1","","Hemmert, Catherine; Renz, Michael; Gornitzka, Heinz; Meunier, Bernard","Synthesis, characterization and crystal structures of copper(II) complexes containing multidentate polypyridine ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3989","","10.1039/a906118e","","","0.71073","MoKα","","0.0443","0.0362","","","0.0987","0.1015","","","","","","1.055","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027737","8.405","0.001","8.828","0.001","14.235","0.002","76.23","0.02","80.61","0.02","77.32","0.02","994","0.2","163","2","163","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H16 B F4 N5 -","- C22 H16 B F4 N5 -","- C44 H32 B2 F8 N10 -","2","1","","Hemmert, Catherine; Renz, Michael; Gornitzka, Heinz; Meunier, Bernard","Synthesis, characterization and crystal structures of copper(II) complexes containing multidentate polypyridine ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3989","","10.1039/a906118e","","","0.71073","MoKα","","0.0735","0.0462","","","0.1081","0.1218","","","","","","1.022","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027738","8.184","0.001","17.278","0.002","15.242","0.002","90","","90.61","0.02","90","","2155.1","0.5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H19 Cl2 Cu N5 O -","- C23 H19 Cl2 Cu N5 O -","- C92 H76 Cl8 Cu4 N20 O4 -","4","1","","Hemmert, Catherine; Renz, Michael; Gornitzka, Heinz; Meunier, Bernard","Synthesis, characterization and crystal structures of copper(II) complexes containing multidentate polypyridine ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3989","","10.1039/a906118e","","","0.71073","MoKα","","0.0676","0.0387","","","0.0762","0.0813","","","","","","0.806","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027739","12.726","0.001","41.705","0.004","12.571","0.001","90","","113.57","0.02","90","","6115.3","1.3","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis(acetonitrile)tris(mu-pyridazine)dicopper(I) acetonitrile adduct (1/0.5)","","- C18 H21 B2 Cu2 F8 N9 -","- C18 H12 B2 Cu2 F8 N9 -","- C144 H96 B16 Cu16 F64 N72 -","8","1","","Batsanov, Andrei S.; Begley, Michael J.; George, Michael W.; Hubberstey, Peter; Munakata, Meguma; Russell, Claire E.; Walton, Paul H.","The role of hydrogen-bonding interactions in stabilising trigonal planar copper(I) in Cu(BF4)‒pyridazine‒nitrile systems †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4251","","10.1039/a906192d","","","0.71073","MoKα","","","0.0946","","","0.1008","","","","","1.0952","1.0952","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027740","25.289","0.004","8.514","0.002","14.211","0.003","90","","114.31","0.03","90","","2788.5","1.2","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","bis(acetonitrile)tris(mu-2-methylpyridazine)dicopper(I)","","- C9.5 H12 B Cu F4 N4 -","- C9.5 H12 B Cu F4.02 N4 -","- C76 H96 B8 Cu8 F32.16 N32 -","8","1","","Batsanov, Andrei S.; Begley, Michael J.; George, Michael W.; Hubberstey, Peter; Munakata, Meguma; Russell, Claire E.; Walton, Paul H.","The role of hydrogen-bonding interactions in stabilising trigonal planar copper(I) in Cu(BF4)‒pyridazine‒nitrile systems †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4251","","10.1039/a906192d","","","0.71073","MoKα","","","0.0828","","","0.0933","","","","","1.086","1.086","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027741","12.9323","0.0012","13.1382","0.0012","18.8","0.002","92.45","0.01","91.86","0.01","90.07","0.01","3189.6","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","bis(benzonitrile)-tris(μ-pyridiazine)dicopper(I) tetrafluoroborate","","- C26 H22 B2 Cu2 F8 N8 -","- C26 H22 B2 Cu2 F8 N8 -","- C104 H88 B8 Cu8 F32 N32 -","4","2","","Batsanov, Andrei S.; Begley, Michael J.; George, Michael W.; Hubberstey, Peter; Munakata, Meguma; Russell, Claire E.; Walton, Paul H.","The role of hydrogen-bonding interactions in stabilising trigonal planar copper(I) in Cu(BF4)–pyridazine–nitrile systems †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4251","","10.1039/a906192d","","","0.71073","MoKα","","0.1165","0.0619","","0.1735","0.1393","","","","1.034","1.123","1.123","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027742","10.814","0.004","15.523","0.004","26.746","0.007","86.86","0.03","100.39","0.02","100.91","0.02","4335","2","298","2","298","2","","","","","","","","7","P -1","-P 1","2","","Bis(triphenylphosphine)bis(pyridazine)copper(I) tetrafluoroborate","","- C44 H38 B Cu F4 N4 P2 -","- C44 H38 B Cu F4 N4 P2 -","- C176 H152 B4 Cu4 F16 N16 P8 -","4","2","","Batsanov, Andrei S.; Begley, Michael J.; George, Michael W.; Hubberstey, Peter; Munakata, Meguma; Russell, Claire E.; Walton, Paul H.","The role of hydrogen-bonding interactions in stabilising trigonal planar copper(I) in Cu(BF4)‒pyridazine‒nitrile systems †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4251","","10.1039/a906192d","","","0.71073","MoKα","","","0.069","","","0.088","","","","","1.0188","1.0188","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027743","29.281","0.009","8.567","0.003","21.389","0.007","90","","90","","90","","5365","3","298","2","298","2","","","","","","","","7","P n a m","-P 2c 2n","62","","Bis(triphenylphosphine)tris(mu-pyridazine)dicopper(I) hexafluorophosphate dichloromethane adduct (1/1)","","- C49 H44 Cl2 Cu2 F12 N6 P4 -","- C49 H44 Cl2 Cu2 F12 N6 P4 -","- C196 H176 Cl8 Cu8 F48 N24 P16 -","4","0.5","","Batsanov, Andrei S.; Begley, Michael J.; George, Michael W.; Hubberstey, Peter; Munakata, Meguma; Russell, Claire E.; Walton, Paul H.","The role of hydrogen-bonding interactions in stabilising trigonal planar copper(I) in Cu(BF4)–pyridazine–nitrile systems †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4251","","10.1039/a906192d","","","0.71073","MoKα","","","0.063","","","0.09","","","","","1.0223","1.0223","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027744","26.321","0.0001","17.5855","0.0001","26.9526","0.0003","90","","114.158","0.001","90","","11382.9","0.17","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ti17O24(OPri)20","","","- C60 H140 O44 Ti17 -","- C60 O44 Ti17 -","- C240 O176 Ti68 -","4","1","","Steunou, Nathalie; Kickelbick, Guido; Boubekeur, Kamal; Sanchez, Clément","A new polyoxo‒alkoxo titanium cluster of the Keggin family: synthesis and characterization by X-ray diffraction and NMR spectroscopy","Journal of the Chemical Society, Dalton Transactions","1999","","21","3653","","10.1039/a906198c","","","0.71069","MoKα","","0.2269","0.1467","","","0.3905","0.4422","","","","","","1.372","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027745","12.0858","0.0002","30.0403","0.0003","17.695","0.0003","90","","108.709","0.0006","90","","6084.9","0.16","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C42 H49 N12 O Pd4 S4 -","- C42 H49 N12 O Pd4 S4 -","- C168 H196 N48 O4 Pd16 S16 -","4","1","","Vila, José M.; Pereira, Ma Teresa; Ortigueira, Juan M.; Graña, María; Lata, Darío; Suárez, Antonio; Fernández, Jesús J.; Fernández, Alberto; López-Torres, Margarita; Adams, Harry","Formation, characterization, and structural studies of novel thiosemicarbazone palladium(II) complexes. Crystal structures of [{Pd[C6H4C(Et)NNC(S)NH2]}4], [Pd{C6H4C(Et)NN C(S)NH2}(PMePh2)] and [{Pd[C6H4C(Et)NNC(S)NH2]}2(μ-Ph2PCH2PPh2)]","Journal of the Chemical Society, Dalton Transactions","1999","","23","4193","","10.1039/a906276i","","","0.71073","MoKα","","0.0728","0.0576","","","0.1561","0.1622","","","","","","1.093","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027746","15.366","0.003","9.174","0.002","18.525","0.003","90","","104.2","0.02","90","","2531.6","0.9","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H26 Cl2 N3 P Pd S -","- C24 H26 Cl2 N3 P Pd S -","- C96 H104 Cl8 N12 P4 Pd4 S4 -","4","1","","Vila, José M.; Pereira, Ma Teresa; Ortigueira, Juan M.; Graña, María; Lata, Darío; Suárez, Antonio; Fernández, Jesús J.; Fernández, Alberto; López-Torres, Margarita; Adams, Harry","Formation, characterization, and structural studies of novel thiosemicarbazone palladium(II) complexes. Crystal structures of [{Pd[C6H4C(Et)NNC(S)NH2]}4], [Pd{C6H4C(Et)NN C(S)NH2}(PMePh2)] and [{Pd[C6H4C(Et)NNC(S)NH2]}2(μ-Ph2PCH2PPh2)]","Journal of the Chemical Society, Dalton Transactions","1999","","23","4193","","10.1039/a906276i","","","0.71073","MoKα","","0.0587","0.05","","0.1468","0.1393","","","","1.15","1.189","1.189","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027747","13.8547","0.0002","17.8565","0.0002","21.1184","0.0001","93.937","0.001","90.993","0.001","92.3","","5207.03","0.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C51 H56 N6 O2 P2 Pd2 S2 -","- C51 H56 N6 O2 P2 Pd2 S2 -","- C204 H224 N24 O8 P8 Pd8 S8 -","4","2","","Vila, José M.; Pereira, Ma Teresa; Ortigueira, Juan M.; Graña, María; Lata, Darío; Suárez, Antonio; Fernández, Jesús J.; Fernández, Alberto; López-Torres, Margarita; Adams, Harry","Formation, characterization, and structural studies of novel thiosemicarbazone palladium(II) complexes. Crystal structures of [{Pd[C6H4C(Et)NNC(S)NH2]}4], [Pd{C6H4C(Et)NN C(S)NH2}(PMePh2)] and [{Pd[C6H4C(Et)NNC(S)NH2]}2(μ-Ph2PCH2PPh2)]","Journal of the Chemical Society, Dalton Transactions","1999","","23","4193","","10.1039/a906276i","","","0.71073","MoKα","","0.1334","0.0613","","","0.1121","0.1424","","","","","","1.025","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027748","8.726","0.0005","10.5384","0.0006","34.657","0.002","90","","90","","90","","3187","0.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C27 H32 Cd Cl2 N6 O10 -","- C27 H32 Cd Cl2 N6 O10 -","- C108 H128 Cd4 Cl8 N24 O40 -","4","1","","Adams, Harry; Bastida, Rufina; Fenton, David E.; Macías, Alejandro; Spey, Sharon E.; Valencia, Laura","Zinc and cadmium complexes of an 18-membered N4O2 oxaaza-Schiff base macrocycle and the corresponding reduced form †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4131","","10.1039/a906372b","","","0.71073","MoKα","","0.043","0.0349","","","0.0731","0.0826","","","","","","0.994","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027749","7.9479","0.0013","12.605","0.002","23.682","0.004","90","","95.467","0.018","90","","2361.7","0.7","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 Cd N6 O8 -","- C23 H22 Cd N6 O8 -","- C92 H88 Cd4 N24 O32 -","4","1","","Adams, Harry; Bastida, Rufina; Fenton, David E.; Macías, Alejandro; Spey, Sharon E.; Valencia, Laura","Zinc and cadmium complexes of an 18-membered N4O2 oxaaza-Schiff base macrocycle and the corresponding reduced form †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4131","","10.1039/a906372b","","","0.71073","MoKα","","0.0478","0.037","","","0.0897","0.0952","","","","","","0.983","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027750","31.382","0.007","10.683","0.002","18.127","0.004","90","","116.983","0.006","90","","5416","2","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C23 H26 Cd Cl2 N4 O12 -","- C23 H26 Cd Cl2 N4 O12 -","- C184 H208 Cd8 Cl16 N32 O96 -","8","1","","Adams, Harry; Bastida, Rufina; Fenton, David E.; Macías, Alejandro; Spey, Sharon E.; Valencia, Laura","Zinc and cadmium complexes of an 18-membered N4O2 oxaaza-Schiff base macrocycle and the corresponding reduced form †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4131","","10.1039/a906372b","","","0.71073","MoKα","","0.0623","0.0453","","","0.1053","0.1134","","","","","","0.972","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027751","21.7074","0.0003","12.1388","0.0002","7.9913","0.0002","90","","90","","90","","2105.72","0.07","293","2","293","2","","","","","","","","4","C m c 21","C 2c -2","36","","10,16-dioxa-3,13,,23,29-tetraazatetraciclo[23.3.1.0^4,9^.0^17,22^] nonacosa-1(29),4(9),5,7,17,19,21,25,27-nonaene","","- C23 H28 N4 O3 -","- C23 H28 N4 O3 -","- C92 H112 N16 O12 -","4","0.5","","Adams, Harry; Bastida, Rufina; Fenton, David E.; Macías, Alejandro; Spey, Sharon E.; Valencia, Laura","Zinc and cadmium complexes of an 18-membered N4O2 oxaaza-Schiff base macrocycle and the corresponding reduced form †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4131","","10.1039/a906372b","","","0.71073","MoKα","","0.0471","0.0365","","","0.0856","0.0947","","","","","","1.035","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027752","11.891","0.005","12.824","0.006","16.724","0.007","90","","105.48","0.03","90","","2457.7","1.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H26 Cd N6 O8 -","- C23 H26 Cd N6 O8 -","- C92 H104 Cd4 N24 O32 -","4","1","","Adams, Harry; Bastida, Rufina; Fenton, David E.; Macías, Alejandro; Spey, Sharon E.; Valencia, Laura","Zinc and cadmium complexes of an 18-membered N4O2 oxaaza-Schiff base macrocycle and the corresponding reduced form †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4131","","10.1039/a906372b","","","0.71073","MoKα","","0.1153","0.0657","","","0.1715","0.2119","","","","","","0.925","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027753","19.5154","0.001","12.2075","0.0006","22.3744","0.0012","90","","96.822","0.001","90","","5292.6","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H48 Cl3 N9 O17 Zn2 -","- C48 H48 Cl3 N9 O17 Zn2 -","- C192 H192 Cl12 N36 O68 Zn8 -","4","1","","Adams, Harry; Bastida, Rufina; Fenton, David E.; Macías, Alejandro; Spey, Sharon E.; Valencia, Laura","Zinc and cadmium complexes of an 18-membered N4O2 oxaaza-Schiff base macrocycle and the corresponding reduced form †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4131","","10.1039/a906372b","","","0.71073","MoKα","","0.0903","0.0534","","","0.1337","0.1539","","","","","","0.868","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027754","13.32","0.001","18.325","0.009","16.197","0.001","90","","98.093","0.007","90","","3914","2","293","2","293","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","[1,2-Bis(methoxycarbonyl)vinyl-C,O-][2-(diphenylphosphanyl)phenylamido-N,P]- methoxycarbonyl(triphenylphosphane)iridium(III)","","- C44 H40 Ir N O6 P2 -","- C44 H40 Ir N O6 P2 -","- C176 H160 Ir4 N4 O24 P8 -","4","1","","Dahlenburg, Lutz; Herbst, Konrad","Rhodium and iridium complexes with 2-(diphenylphosphanyl)anilido ligands: reactions with phenylacetylene and dimethyl acetylenedicarboxylate †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3935","","10.1039/a906430c","","","0.71073","MoKα","","0.0918","0.0422","","0.0734","0.0621","0.0735","","","1.051","","","1.051","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027755","24.985","0.002","24.985","0.002","16.219","0.003","90","","90","","120","","8768.3","1.9","223","2","223","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C63 H63 O6 P3 Pd3 S3 -","- C63 H63 O6 P3 Pd3 S3 -","- C378 H378 O36 P18 Pd18 S18 -","6","0.333333","","Arifhodzic-Radojevic, Sanja; Burrows, Andrew D.; Choi, Nick; McPartlin, Mary; Mingos, D. Michael P.; Tarlton, Stephen V.; Vilar, Ramón","Reactivity of the palladium dimer [Pd2(μ-SO2)(μ-dba)(PBz3)2]. Syntheses and structural characterisation of [Pd3(μ-SO2)3(PBz3)3], [Pd2(μ-SO2)(μ-dppm)(PBz3)2], [Pd(SO2)(PBz3)2], [Pd3(μ-CO)2(μ-SO2)(PBz3)3] and [Pd3(μ-SO2)2(CNBut )2(PBz3)3] (Bz = benzyl) †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3981","","10.1039/a906444c","","","0.71073","MoKα","","0.0827","0.0491","","","0.1105","0.14","","","","","","1.052","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027756","22.498","0.007","14.064","0.003","23.376","0.013","90","","112.47","0.03","90","","6835","5","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C74 H64 O6 P4 Pd2 S -","- C74 H64 O6 P4 Pd2 S -","- C296 H256 O24 P16 Pd8 S4 -","4","1","","Arifhodzic-Radojevic, Sanja; Burrows, Andrew D.; Choi, Nick; McPartlin, Mary; Mingos, D. Michael P.; Tarlton, Stephen V.; Vilar, Ramón","Reactivity of the palladium dimer [Pd2(μ-SO2)(μ-dba)(PBz3)2]. Syntheses and structural characterisation of [Pd3(μ-SO2)3(PBz3)3], [Pd2(μ-SO2)(μ-dppm)(PBz3)2], [Pd(SO2)(PBz3)2], [Pd3(μ-CO)2(μ-SO2)(PBz3)3] and [Pd3(μ-SO2)2(CNBut )2(PBz3)3] (Bz = benzyl) †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3981","","10.1039/a906444c","","","0.71073","MoKα","","0.1604","0.0748","","","0.1679","0.1977","","","","","","0.958","","","","has coordinates,has disorder","179983","2020-10-21","18:00:00",""
"7027757","9.931","0.003","11.331","0.002","19.275","0.004","84.427","0.012","87.305","0.016","64.216","0.014","1943.8","0.8","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C43 H44 Cl2 O2 P2 Pd S -","- C43 H44 Cl2 O2 P2 Pd S -","- C86 H88 Cl4 O4 P4 Pd2 S2 -","2","1","","Arifhodzic-Radojevic, Sanja; Burrows, Andrew D.; Choi, Nick; McPartlin, Mary; Mingos, D. Michael P.; Tarlton, Stephen V.; Vilar, Ramón","Reactivity of the palladium dimer [Pd2(μ-SO2)(μ-dba)(PBz3)2]. Syntheses and structural characterisation of [Pd3(μ-SO2)3(PBz3)3], [Pd2(μ-SO2)(μ-dppm)(PBz3)2], [Pd(SO2)(PBz3)2], [Pd3(μ-CO)2(μ-SO2)(PBz3)3] and [Pd3(μ-SO2)2(CNBut )2(PBz3)3] (Bz = benzyl) †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3981","","10.1039/a906444c","","","0.71073","MoKα","","0.1098","0.087","","","0.2234","0.2344","","","","","","1.249","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027758","22.985","0.009","24.213","0.01","26.926","0.016","90","","90","","90","","14985","12","299","2","299","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C73 H82 N2 O4.5 P3 Pd3 S2 -","- C73 H82 N2 O4.5 P3 Pd3 S2 -","- C584 H656 N16 O36 P24 Pd24 S16 -","8","1","","Arifhodzic-Radojevic, Sanja; Burrows, Andrew D.; Choi, Nick; McPartlin, Mary; Mingos, D. Michael P.; Tarlton, Stephen V.; Vilar, Ramón","Reactivity of the palladium dimer [Pd2(μ-SO2)(μ-dba)(PBz3)2]. Syntheses and structural characterisation of [Pd3(μ-SO2)3(PBz3)3], [Pd2(μ-SO2)(μ-dppm)(PBz3)2], [Pd(SO2)(PBz3)2], [Pd3(μ-CO)2(μ-SO2)(PBz3)3] and [Pd3(μ-SO2)2(CNBut )2(PBz3)3] (Bz = benzyl) †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3981","","10.1039/a906444c","","","0.71073","MoKα","","0.2803","0.0821","","0.2949","0.1798","","","","0.921","1.24","1.24","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027759","10.465","0.002","25.267","0.005","10.905","0.002","90","","112.21","0.03","90","","2669.5","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C18 H31 Cl4 N5 O2 Re -","- C18 H31 Cl4 N5 O2 Re -","- C72 H124 Cl16 N20 O8 Re4 -","4","1","","Wagner, Gabriele; Pombeiro, Armando J. L.; Bokach, Nadezhda A.; Kukushkin, Vadim Yu.","Facile rhenium(IV)-mediated coupling of acetonitrile and oximes †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4083","","10.1039/a906455i","","","0.71073","MoKα","","0.0254","0.0254","","","0.0677","0.0677","","","","","","1.172","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027760","9.89","0.002","16.46","0.003","19.921","0.004","90","","90","","90","","3242.9","1.1","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H44 Cl4 N4 O2 Re -","- C24 H44 Cl4 N4 O2 Re -","- C96 H176 Cl16 N16 O8 Re4 -","4","1","","Wagner, Gabriele; Pombeiro, Armando J. L.; Bokach, Nadezhda A.; Kukushkin, Vadim Yu.","Facile rhenium(IV)-mediated coupling of acetonitrile and oximes †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4083","","10.1039/a906455i","","","0.71073","MoKα","","0.0292","0.0292","","","0.0743","0.0743","","","","","","1.033","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027761","14.231","0.007","7.716","0.003","13.409","0.006","90","","101.41","0.04","90","","1443.3","1.1","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Cl3 N4 O Re -","- C10 H10 Cl3 N4 O Re -","- C40 H40 Cl12 N16 O4 Re4 -","4","1","","Chakraborty, Indranil; Bhattacharyya, Sibaprasad; Banerjee, Sangeeta; Kumar Dirghangi, Bimal; Chakravorty, Animesh","Synthesis, structure and properties of [ReVL(O)Cl3], [ReVL(NR)Cl3], [ReIIIL(OPPh3)Cl3], and [ReIIIL(PPh3)Cl3] [L = 2-(arylazo)-1-methylimidazole, R = aryl] †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3747","","10.1039/a906460e","","","0.71073","MoKα","","0.045","0.0301","","0.0693","0.0637","","","","1.045","1.068","1.068","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027762","28.204","0.006","11.364","0.002","14.954","0.003","90","","90","","90","","4792.9","1.6","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C21 H22 Cl3 N5 Re -","- C21 H22 Cl3 N5 Re -","- C168 H176 Cl24 N40 Re8 -","8","1","","Chakraborty, Indranil; Bhattacharyya, Sibaprasad; Banerjee, Sangeeta; Kumar Dirghangi, Bimal; Chakravorty, Animesh","Synthesis, structure and properties of [ReVL(O)Cl3], [ReVL(NR)Cl3], [ReIIIL(OPPh3)Cl3], and [ReIIIL(PPh3)Cl3] [L = 2-(arylazo)-1-methylimidazole, R = aryl] †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3747","","10.1039/a906460e","","","0.71073","MoKα","","0.0852","0.0434","","0.1192","0.0948","","","","1.038","1.101","1.101","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027763","11.588","0.006","15.007","0.005","17.661","0.008","90","","96.52","0.04","90","","3051","2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 Cl4 N4 O P Re -","- C28 H24 Cl4 N4 O P Re -","- C112 H96 Cl16 N16 O4 P4 Re4 -","4","1","","Chakraborty, Indranil; Bhattacharyya, Sibaprasad; Banerjee, Sangeeta; Kumar Dirghangi, Bimal; Chakravorty, Animesh","Synthesis, structure and properties of [ReVL(O)Cl3], [ReVL(NR)Cl3], [ReIIIL(OPPh3)Cl3], and [ReIIIL(PPh3)Cl3] [L = 2-(arylazo)-1-methylimidazole, R = aryl] †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3747","","10.1039/a906460e","","","0.71073","MoKα","","0.1354","0.0658","","0.2205","0.1582","","","","1.113","1.117","1.117","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027764","9.785","0.002","21.183","0.008","14.937","0.005","90","","109","0.02","90","","2927.4","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H24 Cl4 N4 P Re -","- C28 H24 Cl4 N4 P Re -","- C112 H96 Cl16 N16 P4 Re4 -","4","1","","Chakraborty, Indranil; Bhattacharyya, Sibaprasad; Banerjee, Sangeeta; Kumar Dirghangi, Bimal; Chakravorty, Animesh","Synthesis, structure and properties of [ReVL(O)Cl3], [ReVL(NR)Cl3], [ReIIIL(OPPh3)Cl3], and [ReIIIL(PPh3)Cl3] [L = 2-(arylazo)-1-methylimidazole, R = aryl] †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3747","","10.1039/a906460e","","","0.71073","MoKα","","0.0824","0.0477","","0.1332","0.1063","","","","1.119","1.091","1.091","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027765","11.616","0.0003","19.2122","0.0003","14.3978","0.0003","90","","93.281","0.001","90","","3207.87","0.12","296","2","296","2","","","","","","","see text","6","P 1 21/n 1","-P 2yn","14","","","","- C30 H31 O4 P S3 Zn -","- C30 H31 O4 P S3 Zn -","- C120 H124 O16 P4 S12 Zn4 -","4","1","","Sampanthar, Jeyagowry T.; Deivaraj, Theivanayagam C.; Vittal, Jagadese J.; Dean, Philip A. W.","Thioacetate complexes of Group 12 metals. Structures of [Ph4P][Zn(SC{O}Me)3(H2O)] and [Ph4P][Cd(SC{O}Me)3] †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4419","","10.1039/a906494j","","","0.71073","MoKα","","0.0981","0.0552","","0.1157","0.1003","","","","1.04","1.145","1.145","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027766","10.7195","0.0001","13.0561","0.0002","11.2199","0.0002","90","","100.701","0.001","90","","1542.97","0.04","296","2","296","2","","","","","","","see text","6","P 1 21 1","P 2yb","4","","","","- C30 H29 Cd O3 P S3 -","- C30 H29 Cd O3 P S3 -","- C60 H58 Cd2 O6 P2 S6 -","2","1","","Sampanthar, Jeyagowry T.; Deivaraj, Theivanayagam C.; Vittal, Jagadese J.; Dean, Philip A. W.","Thioacetate complexes of Group 12 metals. Structures of [Ph4P][Zn(SC{O}Me)3(H2O)] and [Ph4P][Cd(SC{O}Me)3] †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4419","","10.1039/a906494j","","","0.71073","MoKα","","0.0309","0.0271","","0.0678","0.0656","","","","1.023","1.036","1.036","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027767","11.511","0.001","13.315","0.001","18.735","0.002","70.27","0.01","73.87","0.01","72.15","0.01","2523.6","0.4","223","2","223","2","","","","","","","","7","P -1","-P 1","2","","","","- C54.5 H57 Cl N2 O2 P2 Ru -","- C54.5 H57 Cl N2 O2 P2 Ru -","- C109 H114 Cl2 N4 O4 P4 Ru2 -","2","1","","Klaß, Katrin; Fröhlich, Roland; Erker, Gerhard","Formation and structural properties of 1,1′,2,2′-tetra(tert-butylcarbamoyl)-ferrocene and -ruthenocene †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4457","","10.1039/a906553i","","","0.71073","MoKα","","0.1582","0.0864","","","0.2214","0.2369","","","","","","0.959","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027768","12.458","0.004","15.758","0.003","18.019","0.002","90","","96.61","0.02","90","","3513.9","1.4","223","2","223","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C36 H52 N4 O4 Ru -","- C36 H52 N4 O4 Ru -","- C144 H208 N16 O16 Ru4 -","4","0.5","","Klaß, Katrin; Fröhlich, Roland; Erker, Gerhard","Formation and structural properties of 1,1′,2,2′-tetra(tert-butylcarbamoyl)-ferrocene and -ruthenocene †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4457","","10.1039/a906553i","","","0.71073","MoKα","","0.1716","0.0557","","","0.1125","0.1261","","","","","","0.925","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027769","6.793","0.001","10.902","0.001","11.208","0.001","92.05","0.01","99.78","0.01","107.58","0.01","776.41","0.16","198","2","198","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H46 Fe N4 O4 -","- C30 H46 Fe N4 O4 -","- C30 H46 Fe N4 O4 -","1","0.5","","Klaß, Katrin; Fröhlich, Roland; Erker, Gerhard","Formation and structural properties of 1,1′,2,2′-tetra(tert-butylcarbamoyl)-ferrocene and -ruthenocene †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4457","","10.1039/a906553i","","","0.71073","MoKα","","0.0392","0.036","","","0.0969","0.099","","","","","","1.067","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027770","14.618","0.002","14.771","0.002","21.583","0.003","90","","108.13","0.03","90","","4428.9","1.3","223","2","223","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","Potassium-[18]crown-6-Salt of Nonaplumbide(4-)","","","- C28.5 H56 K2 N O12 Pb4.5 -","- C28.5 H44 K2 N O12 Pb4.5 -","- C114 H176 K8 N4 O48 Pb18 -","4","1","","Fässler, Thomas F.; Hoffmann, Rudolf","Novel synthetic route to soluble polyanions: synthesis and crystal structure of [K(18-crown-6)]4[Pb9]·en·tol †","Journal of the Chemical Society, Dalton Transactions","1999","","19","3339","","10.1039/a906586e","","","0.71079","MoK/a","","0.081","0.0427","","","0.0845","0.0972","","","","","","0.92","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027771","11.148","0.002","18.141","0.004","17.411","0.003","90","","94.33","0.03","90","","3511.1","1.2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H39 Co Mo O9 P2 S -","- C32 H39 Co Mo O9 P2 S -","- C128 H156 Co4 Mo4 O36 P8 S4 -","4","1","","King, Jason D.; Mays, Martin J.; Pateman, Giles E.; Raithby, Paul R.; Rennie, Moira A.; Solan, Gregory A.; Choi, Nick; Conole, Gráinne; McPartlin, Mary","The formation and transformation of metallacycles containing phosphorus or sulfur on molybdenum‒ or tungsten‒cobalt mixed-metal backbones ‡","Journal of the Chemical Society, Dalton Transactions","1999","","24","4447","","10.1039/a906607a","","","0.71073","MoKα","","0.0623","0.041","","0.1455","0.115","","","","1.196","1.108","1.108","","","","","has coordinates,has disorder","179983","2020-10-21","18:00:00",""
"7027772","9.517","0.002","9.699","0.002","40.567","0.008","90","","91.39","0.03","90","","3743.5","1.3","290","2","290","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C38 H36 Co Mo O8 P S -","- C38 H36 Co Mo O8 P S -","- C152 H144 Co4 Mo4 O32 P4 S4 -","4","1","","King, Jason D.; Mays, Martin J.; Pateman, Giles E.; Raithby, Paul R.; Rennie, Moira A.; Solan, Gregory A.; Choi, Nick; Conole, Gráinne; McPartlin, Mary","The formation and transformation of metallacycles containing phosphorus or sulfur on molybdenum‒ or tungsten‒cobalt mixed-metal backbones ‡","Journal of the Chemical Society, Dalton Transactions","1999","","24","4447","","10.1039/a906607a","","","0.71073","MoKα","","0.1603","0.0481","","0.5203","0.0814","","","","0.967","1.097","1.097","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027773","9.555","0.002","10.419","0.002","19.358","0.004","76.22","0.03","76.57","0.03","73.19","0.03","1763.8","0.7","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C37 H32 Co O6 P S2 W -","- C37 H32 Co O6 P S2 W -","- C74 H64 Co2 O12 P2 S4 W2 -","2","1","","King, Jason D.; Mays, Martin J.; Pateman, Giles E.; Raithby, Paul R.; Rennie, Moira A.; Solan, Gregory A.; Choi, Nick; Conole, Gráinne; McPartlin, Mary","The formation and transformation of metallacycles containing phosphorus or sulfur on molybdenum‒ or tungsten‒cobalt mixed-metal backbones ‡","Journal of the Chemical Society, Dalton Transactions","1999","","24","4447","","10.1039/a906607a","","","0.71073","MoKα","","0.0824","0.0509","","0.1224","0.1078","","","","1.027","1.062","1.062","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027774","9.169","0.004","13.666","0.005","22.173","0.01","90","","93.05","0.03","90","","2774","2","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C52 H82 Li4 N4 Na2 O10 -","- C52 H78 Li4 N4 Na2 O10 -","- C104 H156 Li8 N8 Na4 O20 -","2","0.5","","Holland, Rebecca; Jeffery, John C.; Russell, Christopher A.","Model for a superbase: synthesis and crystal structure of the mixed-metal/mixed-anion aggregate [NaLi2{N(H)R}2(OR′)]2†","Journal of the Chemical Society, Dalton Transactions","1999","","19","3331","","10.1039/a906649g","","","0.71073","MoKα","","0.1684","0.1347","","0.3471","0.3322","","","","1.236","1.442","1.442","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027775","11.585","0.001","7.487","0.001","19.069","0.002","90","","98.37","0.01","90","","1636.4","0.3","149","2","149","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","O-Trichlorsilyl-N,N-dimethylhydroxylamin","","- C2 H6 Cl3 N O Si -","- C2 H6 Cl3 N O Si -","- C16 H48 Cl24 N8 O8 Si8 -","8","2","","Losehand, Udo; Mitzel, Norbert W.; Rankin, David W. H.","Synthesis and molecular structures of N,N-dimethylhydroxylamino-trichlorosilane and -germane †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4291","","10.1039/a906688h","","","0.71073","MoKα","","0.0478","0.0355","","0.1029","0.0897","","","","1.103","1.128","1.128","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027776","13.079","0.002","15.19","0.003","16.187","0.003","76.844","0.005","86.659","0.006","84.66","0.006","3115.6","1","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C114 H162 Li4 N8 O20 Sr2 -","- C114 H134 Li4 N8 O20 Sr2 -","- C114 H134 Li4 N8 O20 Sr2 -","1","0.5","","Clague, Nicholas P.; Crane, Jonathan D.; Moreton, David J.; Sinn, Ekkehard; Teat, Simon J.; Young, Nigel A.","A mixed lithium‒strontium polynuclear complex formed within the hexa-deprotonated calix[8]arene framework; the synthesis and structure of Li4Sr2(H2L)(O2CC4H9)2(dmf )8 [H8L = p-Pri- or p-Bui-calix[8]arene] †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3535","","10.1039/a906694b","","","0.6875","Synchrotron","","0.1048","0.0897","","","0.2483","0.2795","","","","","","1.047","","","","has coordinates,has disorder","179983","2020-10-21","18:00:00",""
"7027777","13.3348","0.0005","15.2025","0.0005","18.5975","0.0007","70.644","0.002","73.347","0.002","79.079","0.002","3389.2","0.2","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C122 H178 Li4 N8 O20 Sr2 -","- C120 H32 Li4 N8 O20 Sr2 -","- C120 H32 Li4 N8 O20 Sr2 -","1","0.5","","Clague, Nicholas P.; Crane, Jonathan D.; Moreton, David J.; Sinn, Ekkehard; Teat, Simon J.; Young, Nigel A.","A mixed lithium‒strontium polynuclear complex formed within the hexa-deprotonated calix[8]arene framework; the synthesis and structure of Li4Sr2(H2L)(O2CC4H9)2(dmf )8 [H8L = p-Pri- or p-Bui-calix[8]arene] †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3535","","10.1039/a906694b","","","0.6875","Synchrotron","","0.1231","0.0961","","","0.2661","0.2844","","","","","","1.021","","","","has coordinates,has disorder","179983","2020-10-21","18:00:00",""
"7027778","16.6236","0.0005","17.0227","0.0006","18.064","0.0008","90","","91.978","0.005","90","","5108.7","0.3","150","0.1","150","0.1","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","Ru(OSO2CF3)(CN)(dppe)2","","- C54 H48 F3 N O3 P4 Ru S -","- C54 H48 F3 N O3 P4 Ru S -","- C216 H192 F12 N4 O12 P16 Ru4 S4 -","4","1","","Fong, Tina P.; Forde, Cameron E.; Lough, Alan J.; Morris, Robert H.; Rigo, Pierluigi; Rocchini, Eliana; Stephan, Tim","Synthesis of the acidic dihydrogen complexes trans-[M(H2)(CN)L2]+ and trans-[M(H2)(CNH)L2]2+ where M = Fe, Ru, Os and L = dppm, dppe, dppp, depe, and dihydrogen substitution by the trifluoromethanesulfonate anion to give trans-[Ru(OTf )(CN)L2] or trans-[Ru(OTf )(CNH)L2]OTf †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4475","","10.1039/a906717e","","","0.71073","MoKα","","0.1241","0.0669","","","0.1619","0.1832","","","","","","1.02","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027779","16.547","0.005","19.404","0.012","13.657","0.004","90","","90","","90","","4385","3","210","2","210","2","","","","","","","Treatment of [Cu(NCMe)4][BF4] with dmp and cnge in dichloromethane; crystallisation by ether diffusion techniques.","7","P b c n","-P 2n 2ab","60","","(2,9-dimethyl-1,10-phenanthroline)(2-cyanoguanidine)copper(I) tetrafluoroborate ether adduct (2/1)","","- C18 H21 B Cu F4 N6 O0.5 -","- C18 H21 B Cu F4 N6 O0.5 -","- C144 H168 B8 Cu8 F32 N48 O4 -","8","1","","Blake, Alexander J.; Hubberstey, Peter; Li, Wan-Sheung; Quinlan, Daniel J.; Russell, Claire E.; Sampson, Claire L.","The role of π–π stacking interactions in stabilising trigonal planar copper(I) in Cu(BF4)–2,9-dimethyl-1,10-phenanthroline–nitrile systems†","Journal of the Chemical Society, Dalton Transactions","1999","","23","4261","","10.1039/a906781g","","","0.71069","MoKα","","0.1335","0.0741","","0.1411","0.0922","","","","","","","1.2031","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027780","14.959","0.005","20","0.014","6.803","0.006","90","","92.35","0.05","90","","2034","2","150","1","150","1","","","","","","","Treatment of [Cu(NCMe)4][BF4] with dmp and cnge in MeCN; crystallisation by ether diffusion techniques.","6","P 1 21/c 1","-P 2ybc","14","","(2,9-dimethyl-1,10-phenanthroline)(2-cyanoguanidine)copper(I) tetrafluoroborate acetonitrile adduct (1/1)","","- C18 H19 B Cu F4 N7 -","- C18 H19 B Cu F4 N7 -","- C72 H76 B4 Cu4 F16 N28 -","4","1","","Blake, Alexander J.; Hubberstey, Peter; Li, Wan-Sheung; Quinlan, Daniel J.; Russell, Claire E.; Sampson, Claire L.","The role of π–π stacking interactions in stabilising trigonal planar copper(I) in Cu(BF4)–2,9-dimethyl-1,10-phenanthroline–nitrile systems†","Journal of the Chemical Society, Dalton Transactions","1999","","23","4261","","10.1039/a906781g","","","0.71069","MoKα","","0.0724","0.0574","","0.0851","0.0717","","","","","","","1.0185","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027781","11.848","0.016","19.296","0.003","7.506","0.011","90","","108.29","0.02","90","","1629","3","150","1","150","1","","","","","","","Treatment of [Cu(NCMe)4][BF4] with dmp in dichloromethane.","6","P 1 21/c 1","-P 2ybc","14","","(2,9-dimethyl-1,10-phenanthroline)(2-cyanoguanidine)copper(I) tetrafluoroborate ether adduct (2/1)","","- C16 H15 B Cu F4 N3 -","- C16 H15 B Cu F4 N3 -","- C64 H60 B4 Cu4 F16 N12 -","4","1","","Blake, Alexander J.; Hubberstey, Peter; Li, Wan-Sheung; Quinlan, Daniel J.; Russell, Claire E.; Sampson, Claire L.","The role of π–π stacking interactions in stabilising trigonal planar copper(I) in Cu(BF4)–2,9-dimethyl-1,10-phenanthroline–nitrile systems†","Journal of the Chemical Society, Dalton Transactions","1999","","23","4261","","10.1039/a906781g","","","0.71069","MoKα","","0.0384","0.0344","","0.039","0.0373","","","","","","","1.1804","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027782","18.817","0.002","11.504","0.002","18.627","0.002","90","","105.337","0.005","90","","3888.6","0.9","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H56 N2 O2 -","- C44 H56 N2 O2 -","- C176 H224 N8 O8 -","4","1","","Woodman, Paul R.; Munslow, Ian J.; Hitchcock, Peter B.; Scott, Peter","Non-planar co-ordination of C2-symmetric biaryl-bridged Schiff-base ligands: well expressed chiral ligand environments for zirconium †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4069","","10.1039/a906788d","","","0.71073","MoKα","","0.1829","0.0698","","","0.1534","0.1982","","","","","","0.983","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027783","25.226","0.007","10.762","0.01","16.134","0.004","90","","102.13","0.02","90","","4282","4","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C44 H54 Cl2 Hf N2 O2 -","- C44 H54 Cl2 Hf N2 O2 -","- C176 H216 Cl8 Hf4 N8 O8 -","4","0.5","","Woodman, Paul R.; Munslow, Ian J.; Hitchcock, Peter B.; Scott, Peter","Non-planar co-ordination of C2-symmetric biaryl-bridged Schiff-base ligands: well expressed chiral ligand environments for zirconium †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4069","","10.1039/a906788d","","","0.71073","MoKα","","0.0542","0.0474","","0.1302","0.1222","","","","1.049","1.062","1.062","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027784","13.21","0.01","13.557","0.008","15.287","0.007","69.35","0.05","74.15","0.05","77.73","0.05","2444","3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H64 N2 O4 Zr -","- C56 H64 N2 O4 Zr -","- C112 H128 N4 O8 Zr2 -","2","1","","Woodman, Paul R.; Munslow, Ian J.; Hitchcock, Peter B.; Scott, Peter","Non-planar co-ordination of C2-symmetric biaryl-bridged Schiff-base ligands: well expressed chiral ligand environments for zirconium †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4069","","10.1039/a906788d","","","0.71073","MoKα","","0.1494","0.1186","","0.3742","0.3364","","","","1.064","1.145","1.145","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027785","11.6149","0.0005","12.441","0.0007","15.8853","0.0004","72.073","0.003","70.757","0.003","65.849","0.003","1937.23","0.16","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H60 Cl2 Mg2 O2 P2 -","- C30 H60 Cl2 Mg2 O2 P2 -","- C60 H120 Cl4 Mg4 O4 P4 -","2","1","","Hibbs, David E.; Jones, Cameron; Richards, Anne F.","A convenient synthetic route to substituted phosphavinyl Grignard reagents: synthesis and characterisation of [{RPC(But)MgX(OEt2)}2] (R = cyclohexyl, cyclopentyl, ethyl or mesityl; X = Cl or Br) †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3531","","10.1039/a906839b","","","0.71073","MoKα","","0.0995","0.0545","","","0.1299","0.1462","","","","","","0.991","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027786","8.162","0.009","9.682","0.007","12.341","0.01","70.69","0.02","75.44","0.018","78.995","0.016","884.6","1.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C14 H28 Cl Mg O P -","- C7 H14 Cl0.5 Mg0.5 O0.5 P0.5 -","- C28 H56 Cl2 Mg2 O2 P2 -","4","2","","Hibbs, David E.; Jones, Cameron; Richards, Anne F.","A convenient synthetic route to substituted phosphavinyl Grignard reagents: synthesis and characterisation of [{RPC(But)MgX(OEt2)}2] (R = cyclohexyl, cyclopentyl, ethyl or mesityl; X = Cl or Br) †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3531","","10.1039/a906839b","","","0.71073","MoKα","","0.0388","0.0346","","","0.0951","0.0972","","","","","","1.074","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027787","8.757","0.001","16.15","0.008","27.766","0.003","90","","90","","90","","3927","2","453","2","453","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H22 Cl N O4 Ti -","- C20 H22 Cl N O4 Ti -","- C160 H176 Cl8 N8 O32 Ti8 -","8","1","","Rao, P. Venkateshwara; Pulla Rao, Chebrolu; Wegelius, Elina K.; Kolehmainen, Erkki; Rissanen, Kari","Reactivity of cis-bis(acetylacetonato)dichlorotitanium(IV) towards hydroxy-containing ligands: isolation and characterisation of products †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4469","","10.1039/a906985b","","","0.71069","MoKα","","0.0708","0.0394","","0.1123","0.1043","","","","1.032","1.167","1.167","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027788","13.769","0.002","10.985","0.002","17.0552","0.0015","90","","102.384","0.01","90","","2519.6","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H30 N2 O4 Ti -","- C30 H30 N2 O4 Ti -","- C120 H120 N8 O16 Ti4 -","4","1","","Rao, P. Venkateshwara; Pulla Rao, Chebrolu; Wegelius, Elina K.; Kolehmainen, Erkki; Rissanen, Kari","Reactivity of cis-bis(acetylacetonato)dichlorotitanium(IV) towards hydroxy-containing ligands: isolation and characterisation of products †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4469","","10.1039/a906985b","","","0.71073","MoKα","","0.0642","0.037","","0.0911","0.0848","","","","0.998","1.119","1.119","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027789","8.2542","0.0013","22.121","0.004","14.582","0.002","90","","102.34","0.013","90","","2601","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C31 H28 O6 Ti -","- C31 H28 O6 Ti -","- C124 H112 O24 Ti4 -","4","1","","Rao, P. Venkateshwara; Pulla Rao, Chebrolu; Wegelius, Elina K.; Kolehmainen, Erkki; Rissanen, Kari","Reactivity of cis-bis(acetylacetonato)dichlorotitanium(IV) towards hydroxy-containing ligands: isolation and characterisation of products †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4469","","10.1039/a906985b","","","0.71073","MoKα","","0.0677","0.0376","","0.0942","0.0876","","","","1.019","1.145","1.145","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027790","7.822","0.002","14.306","0.003","14.919","0.003","63.78","0.03","87.6","0.03","81.3","0.03","1479.9","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H56 Cl2 Mn N12 O12 -","- C60 H56 Cl2 Mn N12 O12 -","- C60 H56 Cl2 Mn N12 O12 -","1","0.5","","Tong, Ming-Liang; Lee, Hung Kay; Chen, Xiao-Ming; Huang, Rong-Bin; Mak, Thomas C. W.","A novel three-dimensional triangular organic–inorganic hybrid network self-assembled by mononuclear [Mn(4,4′-bipyridine)2(H2O)4]2+ cations and rich solvate 4,4′-bipyridine molecules through hydrogen-bonding and π–π interactions †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3657","","10.1039/a907111c","","","0.71073","MoKα","","0.1501","0.0483","","","0.1078","0.1358","","","","","","0.915","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027791","7.672","0.0002","6.5437","0.0002","28.2086","0.0009","90","","90","","90","","1416.16","0.07","293","2","193","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C6 H4 B N3 O2 -","- C6 H4 B N3 O2 -","- C48 H32 B8 N24 O16 -","8","1","","Fraenk, Wolfgang; Habereder, Tassilo; Klapötke, Thomas M.; Nöth, Heinrich; Polborn, Kurt","Synthesis and characterization of new azido(o-phenylenedioxy)boranes and azidobicyclononylboranes †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4283","","10.1039/a907222e","","","0.71073","MoKα","","0.0645","0.0486","","","0.0991","0.1061","","","","","","1.165","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027792","24.819","0.006","7.4217","0.0014","19.099","0.003","90","0.013","106.29","0.02","90","0.02","3376.8","1.2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H28 B2 N4 -","- C16 H28 B2 N4 -","- C128 H224 B16 N32 -","8","1","","Fraenk, Wolfgang; Habereder, Tassilo; Klapötke, Thomas M.; Nöth, Heinrich; Polborn, Kurt","Synthesis and characterization of new azido(o-phenylenedioxy)boranes and azidobicyclononylboranes †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4283","","10.1039/a907222e","","","0.71073","MoKα","","0.0776","0.0559","","0.1493","0.1319","","","","1.084","1.128","1.128","","","","","has coordinates,has disorder","179983","2020-10-21","18:00:00",""
"7027793","7.793","0.002","11.786","0.004","14.763","0.006","90","0.03","103.65","0.03","90","0.03","1317.7","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H19 B N4 -","- C13 H19 B N4 -","- C52 H76 B4 N16 -","4","1","","Fraenk, Wolfgang; Habereder, Tassilo; Klapötke, Thomas M.; Nöth, Heinrich; Polborn, Kurt","Synthesis and characterization of new azido(o-phenylenedioxy)boranes and azidobicyclononylboranes †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4283","","10.1039/a907222e","","","0.71073","MoKα","","0.0909","0.0512","","0.1205","0.1006","","","","1.118","1.194","1.194","","","","","has coordinates","179983","2020-10-21","18:00:00",""
"7027794","10.085","0.0008","10.249","0.005","10.472","0.001","96.55","0.02","110.168","0.007","115.77","0.03","869.2","0.5","293","","293","","","","","","","","Synthesized in the laboratory","6","P -1","-P 1","2","","","","- C30 H30 Cl2 Cu2 N8 O10 -","- C30 H30 Cl2 Cu2 N8 O10 -","- C30 H30 Cl2 Cu2 N8 O10 -","1","0.5","","Gupta, Rajeev; Mukherjee, Sumitra; Mukherjee, Rabindranath","Synthesis, magnetism, 1H NMR and redox activity of dicopper(II) complexes having a discrete {Cu2(μ-phenoxide)2}2+ unit supported by a non-macrocyclic ligand environment. Crystal structure of [Cu2(L)2(OClO3)2] [HL = 4-methyl-2,6-bis(pyrazol-1-ylmethyl)phenol] †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4025","","10.1039/a907250k","","","0.71073","MoK-alpha","","0.052","0.043","","0.056","0.051","","","","1.236","1.253","1.253","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027795","9.401","0.002","17.73","0.004","25.841","0.007","105.48","0.02","93.23","0.02","100.63","0.02","4054.3","1.8","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C62.5 H73 B2 Cl13 Mo2 N16 O3 -","- C62.5 H62 B2 Cl13 Mo2 N16 O3 -","- C125 H124 B4 Cl26 Mo4 N32 O6 -","2","1","","Behrendt, Andreas; Couchman, Samantha M.; Jeffery, John C.; McCleverty, Jon A.; Ward, Michael D.","Complexes containing redox-active fluorenone-based ligands linked to redox-active tris(pyrazolyl)boratomolybdenum fragments: assignment of ligand-centred and metal-centred redox processes by EPR and UV/VIS/NIR spectroelectrochemistry †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4349","","10.1039/a907303e","","","0.71073","MoKα","","0.2395","0.1048","","0.3201","0.2433","","","","1.002","1.251","1.251","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7027796","7.736","0.004","11.418","0.003","21.239","0.004","90","","97.35","0.03","90","","1860.6","1.1","296.2","","296.2","","","","","","","","prepared by T. Mitsudo et al.","5","P 1 21/n 1","-P 2yn","14","Ru(η6-cot)(dmfm)(PrNH2)","","","- C17 H27 N O4 Ru -","- C17 H27 N O4 Ru -","- C68 H108 N4 O16 Ru4 -","4","1","","Suzuki, Toshiaki; Shiotsuki, Masashi; Wada, Kenji; Kondo, Teruyuki; Mitsudo, Take-aki","Syntheses and structures of novel zerovalent ruthenium monodentate amine complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4231","","10.1039/a907333g","","","0.7107","MoKα","","0.028","0.028","","","0.0282","0.0282","","","","","","1.067","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027797","9.252","0.003","13.898","0.007","7.749","0.003","94.97","0.04","101.27","0.03","73.03","0.03","934.2","0.7","296.2","","296.2","","","","","","","","prepared by T. mitsudo et al.","5","P -1","-P 1","2","Ru(η6-cot)(dmfm)(mor)","","","- C18 H27 N O5 Ru -","- C18 H27 N O5 Ru -","- C36 H54 N2 O10 Ru2 -","2","1","","Suzuki, Toshiaki; Shiotsuki, Masashi; Wada, Kenji; Kondo, Teruyuki; Mitsudo, Take-aki","Syntheses and structures of novel zerovalent ruthenium monodentate amine complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4231","","10.1039/a907333g","","","0.7107","MoKα","","0.029","0.029","","","0.0314","0.0314","","","","","","0.955","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027798","9.303","0.004","13.772","0.007","7.379","0.003","99.29","0.04","101.56","0.03","86.71","0.04","913.8","0.7","296.2","","296.2","","","","","","","","prepared by T. Mitsudo et al.","5","P -1","-P 1","2","Ru(η6-cot)(dmfm)(py)","","","- C19 H23 N O4 Ru -","- C19 H23 N O4 Ru -","- C38 H46 N2 O8 Ru2 -","2","1","","Suzuki, Toshiaki; Shiotsuki, Masashi; Wada, Kenji; Kondo, Teruyuki; Mitsudo, Take-aki","Syntheses and structures of novel zerovalent ruthenium monodentate amine complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4231","","10.1039/a907333g","","","0.7107","MoKα","","0.0261","0.0261","","","0.0316","0.0316","","","","","","1.133","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027799","13.294","0.006","12.141","0.007","14.24","0.004","90","","94.95","0.03","90","","2289.8","1.8","296.2","","296.2","","","","","","","","prepared by T. Mitsudo et al.","5","P 1 21/c 1","-P 2ybc","14","Ru(η4-cot)(dmfm)(PrNH2)2","","","- C20 H36 N2 O4 Ru -","- C20 H36 N2 O4 Ru -","- C80 H144 N8 O16 Ru4 -","4","1","","Suzuki, Toshiaki; Shiotsuki, Masashi; Wada, Kenji; Kondo, Teruyuki; Mitsudo, Take-aki","Syntheses and structures of novel zerovalent ruthenium monodentate amine complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4231","","10.1039/a907333g","","","0.7107","MoKα","","0.0366","0.0366","","","0.037","0.0369","","","","","","0.476","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027800","11.562","0.002","21.028","0.003","18.837","0.003","90","0","97","0.02","90","0","4545.6","1.3","298","","298","","","","","","","","?","8","P 1 21/n 1","-P 2yn","14","","","","- C47 H53 Fe N O6 P2 Pd Si -","- C48 H39 Fe N O6 P2 Pd Si -","- C192 H156 Fe4 N4 O24 P8 Pd4 Si4 -","4","1","","Braunstein, Pierre; Durand, Jérôme; Kickelbick, Guido; Knorr, Michael; Morise, Xavier; Pugin, Raphael; Tiripicchio, Antonio; Ugozzoli, Franco","Hydrocarbyl derivatives of dppm- or dppa-bridged alkoxysilyl heterobimetallic Fe‒Pd complexes and CO insertion reactions. Crystal structures of [(OC)3{(MeO)3Si}Fe(μ-dppm)Pd(8-mq)] (dppm = Ph2PCH2PPh2), [(OC)3Fe{μ-Si(OMe)2(OMe)}(μ-dppa)PdCl] and [(OC)3Fe{μ-Si(OMe)2(OMe)}(μ-dppa)PdPh] (dppa = Ph2PNHPPh2) †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4175","","10.1039/a907425b","","","0.7107","Mokapha","","0.055","","","0.075","","","","","0.899","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027801","19.6245","0.0003","13.9778","0.0001","29.5777","0.0006","90","","90","","90","","8113.4","0.2","293","2","293","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C40 H43 Fe N O7 P2 Pd Si -","- C40 H43 Fe N O7 P2 Pd Si -","- C320 H344 Fe8 N8 O56 P16 Pd8 Si8 -","8","1","","Braunstein, Pierre; Durand, Jérôme; Kickelbick, Guido; Knorr, Michael; Morise, Xavier; Pugin, Raphael; Tiripicchio, Antonio; Ugozzoli, Franco","Hydrocarbyl derivatives of dppm- or dppa-bridged alkoxysilyl heterobimetallic Fe‒Pd complexes and CO insertion reactions. Crystal structures of [(OC)3{(MeO)3Si}Fe(μ-dppm)Pd(8-mq)] (dppm = Ph2PCH2PPh2), [(OC)3Fe{μ-Si(OMe)2(OMe)}(μ-dppa)PdCl] and [(OC)3Fe{μ-Si(OMe)2(OMe)}(μ-dppa)PdPh] (dppa = Ph2PNHPPh2) †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4175","","10.1039/a907425b","","","0.71073","MoKα","","0.0875","0.051","","0.1271","0.1013","","","","1.155","1.202","1.202","","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027802","25.113","0.002","25.113","0.002","25.113","0.003","118.39","0.02","118.39","0.02","118.39","0.02","5176","18","298","","298","","","","","","","","","9","R -3 :R","-P 3*","148","","","","- C30 H30 Cl Fe N O6 P2 Pd Si -","- C30 H30 Cl Fe N O6 P2 Pd Si -","- C180 H180 Cl6 Fe6 N6 O36 P12 Pd6 Si6 -","6","1","","Braunstein, Pierre; Durand, Jérôme; Kickelbick, Guido; Knorr, Michael; Morise, Xavier; Pugin, Raphael; Tiripicchio, Antonio; Ugozzoli, Franco","Hydrocarbyl derivatives of dppm- or dppa-bridged alkoxysilyl heterobimetallic Fe‒Pd complexes and CO insertion reactions. Crystal structures of [(OC)3{(MeO)3Si}Fe(μ-dppm)Pd(8-mq)] (dppm = Ph2PCH2PPh2), [(OC)3Fe{μ-Si(OMe)2(OMe)}(μ-dppa)PdCl] and [(OC)3Fe{μ-Si(OMe)2(OMe)}(μ-dppa)PdPh] (dppa = Ph2PNHPPh2) †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4175","","10.1039/a907425b","","","0.71073","MoKα","","0.1309","0.0316","","0.1271","0.0629","","","","1.389","0.899","0.899","","","","","has coordinates","211902","2020-10-21","18:00:00",""
"7027803","27.355","0.008","8.966","0.003","25.515","0.008","90","","114.28","0.02","90","","5704","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C48 H68 Li4 N16 O12 -","- C48 H68 Li4 N16 O12 -","- C192 H272 Li16 N64 O48 -","4","0.5","","Otero, A.; Fernández-Baeza, J.; Tejeda, J.; Antiñolo, A.; Carrillo-Hermosilla, F.; Díez-Barra, E.; Lara-Sánchez, A.; Fernández-López, M.; Lanfranchi, M.; Pellinghelli, M. A.","Syntheses and crystal structures of lithium and niobium complexes containing a new type of monoanionic “scorpionate” ligand †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3537","","10.1039/a907505d","","","1.54184","CuKα","","0.0744","0.0598","","","0.176","0.1891","","","","","","1.051","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027804","19.242","0.007","8.024","0.003","34.146","0.01","90","","91.3","0.02","90","","5271","3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C22 H25 Cl4 N4 Nb O2 -","- C22 H25 Cl4 N4 Nb O2 -","- C176 H200 Cl32 N32 Nb8 O16 -","8","1","","Otero, A.; Fernández-Baeza, J.; Tejeda, J.; Antiñolo, A.; Carrillo-Hermosilla, F.; Díez-Barra, E.; Lara-Sánchez, A.; Fernández-López, M.; Lanfranchi, M.; Pellinghelli, M. A.","Syntheses and crystal structures of lithium and niobium complexes containing a new type of monoanionic “scorpionate” ligand †","Journal of the Chemical Society, Dalton Transactions","1999","","20","3537","","10.1039/a907505d","","","0.71073","MoKα","","0.1214","0.0484","","","0.1207","0.1548","","","","","","0.906","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027805","14.38","0.05","10.14","0.04","17.62","0.02","90","","95.24","0.03","90","","2558","14","296.2","","","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H26 B F4 N2 O Rh -","- C25 H20 B F4 N2 O Rh -","- C100 H80 B4 F16 N8 O4 Rh4 -","4","1","","Maekawa, Masahiko; Sugimoto, Kunihisa; Kuroda-Sowa, Takayoshi; Suenaga, Yusaku; Munakata, Megumu","Syntheses and structures of dinuclear rhodium(I) complexes and 1-D zigzag-chain rhodium(I) co-ordination polymers bridged by rod-like bidentate nitrogen ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4357","","10.1039/a907577a","","","0.7107","MoKα","","","0.0514","","","","0.143","","","","","","1.714","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027806","9.162","0.004","18.442","0.003","9.573","0.007","90","","108.79","0.05","90","","1531.3","1.4","296.2","","","","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C28 H32 B F4 N2 O2 Rh -","- C28 H20 B F3.97 N2 O2 Rh -","- C56 H40 B2 F7.94 N4 O4 Rh2 -","2","0.5","","Maekawa, Masahiko; Sugimoto, Kunihisa; Kuroda-Sowa, Takayoshi; Suenaga, Yusaku; Munakata, Megumu","Syntheses and structures of dinuclear rhodium(I) complexes and 1-D zigzag-chain rhodium(I) co-ordination polymers bridged by rod-like bidentate nitrogen ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4357","","10.1039/a907577a","","","0.7107","MoKα","","","0.0527","","","","0.1373","","","","","","1.085","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027807","9.347","0.002","18.114","0.003","9.917","0.003","90","","108.53","0.02","90","","1592","0.7","296.2","","","","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C28 H32 F6 N2 O2 P Rh -","- C28 H20 F6 N2 O2 P Rh -","- C56 H40 F12 N4 O4 P2 Rh2 -","2","0.5","","Maekawa, Masahiko; Sugimoto, Kunihisa; Kuroda-Sowa, Takayoshi; Suenaga, Yusaku; Munakata, Megumu","Syntheses and structures of dinuclear rhodium(I) complexes and 1-D zigzag-chain rhodium(I) co-ordination polymers bridged by rod-like bidentate nitrogen ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4357","","10.1039/a907577a","","","0.7107","MoKα","","","0.0584","","","","0.1686","","","","","","1.39","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027808","15.153","0.003","16.466","0.0005","19.698","0.001","90","","90","","90","","4914.8","1","296.2","","","","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C23 H28 B F4 N2 O Rh -","- C208 N32 Rh16 -","- C1664 N256 Rh128 -","8","1","","Maekawa, Masahiko; Sugimoto, Kunihisa; Kuroda-Sowa, Takayoshi; Suenaga, Yusaku; Munakata, Megumu","Syntheses and structures of dinuclear rhodium(I) complexes and 1-D zigzag-chain rhodium(I) co-ordination polymers bridged by rod-like bidentate nitrogen ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4357","","10.1039/a907577a","","","0.7107","MoKα","","","0.0806","","","","0.188","","","","","","1.292","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027809","15.5919","0.0005","17.6515","0.0006","26.172","0.0009","90","","92.739","0.001","90","","7194.8","0.4","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C36 H87 Ag3 La N9 O12 S12 W3 -","- C36 Ag3 La N9 O12 S12 W3 -","- C144 Ag12 La4 N36 O48 S48 W12 -","4","1","","Chen, Ling; Wu, Xin-tao; Gao, Xian-cheng; Zhang, Wen-jian; Lin, Ping","The unconventional semiconductors represent two novel structure types of polythiometalates: syntheses, structures and electrical properties of {[W3Ag3S12]·[La(DMAC)5(H2O)3·(DMAC)4]}n and {[W8Ag10S32]·[M(DEF)8]2}n (M = La, Nd) †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4303","","10.1039/a907625e","","","0.71073","MoKα","","0.1235","0.0606","","0.1578","0.1336","","","","0.955","1.09","1.09","","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027810","21.6534","0.0003","18.1125","0.0001","22.1818","0.0003","90","","108.531","0.001","90","","8248.58","0.17","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C80 H176 Ag10 La2 N16 O16 S32 W8 -","- C80 Ag10 La2 N16 O16 S32 W8 -","- C160 Ag20 La4 N32 O32 S64 W16 -","2","0.5","","Chen, Ling; Wu, Xin-tao; Gao, Xian-cheng; Zhang, Wen-jian; Lin, Ping","The unconventional semiconductors represent two novel structure types of polythiometalates: syntheses, structures and electrical properties of {[W3Ag3S12]·[La(DMAC)5(H2O)3·(DMAC)4]}n and {[W8Ag10S32]·[M(DEF)8]2}n (M = La, Nd) †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4303","","10.1039/a907625e","","","0.71073","MoKα","","0.1648","0.084","","0.2034","0.1668","","","","1.045","1.215","1.215","","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027811","21.636","0.0009","17.9851","0.0008","22.0251","0.0009","90","","108.257","0.001","90","","8139.1","0.6","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C80 H176 Ag10 N16 Nd2 O16 S32 W8 -","- C80 Ag10 N16 Nd2 O16 S32 W8 -","- C160 Ag20 N32 Nd4 O32 S64 W16 -","2","0.5","","Chen, Ling; Wu, Xin-tao; Gao, Xian-cheng; Zhang, Wen-jian; Lin, Ping","The unconventional semiconductors represent two novel structure types of polythiometalates: syntheses, structures and electrical properties of {[W3Ag3S12]·[La(DMAC)5(H2O)3·(DMAC)4]}n and {[W8Ag10S32]·[M(DEF)8]2}n (M = La, Nd) †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4303","","10.1039/a907625e","","","0.71073","MoKα","","0.1234","0.0779","","0.198","0.174","","","","1.061","1.202","1.202","","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027812","8.703","0.003","14.442","0.003","18.168","0.012","90","","93.21","0.04","90","","2279.9","1.8","294","2","294","2","","","","","","","Synthesis","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H25 Cu2 N3 O6 -","- C25 H19 Cu2 N3 O6 -","- C100 H76 Cu8 N12 O24 -","4","1","","Geetha, Kannappan; Tiwary, Satish K.; Chakravarty, Akhil R.; Ananthakrishna, Garani","Synthesis, crystal structure and magnetic properties of a polymeric copper(II) Schiff-base complex having binuclear units covalently linked by isonicotinate ligands †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4463","","10.1039/a907668i","","","1.5418","CuKα","","0.1139","0.0633","","0.2157","0.1613","","","","1.005","0.984","0.984","","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027813","12.717","0.003","18.034","0.004","26.811","0.005","90","","102.6","0.03","90","","6001","2","143","2","143","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C60 H90 N2 O8 P4 -","- C60 H90 N2 O8 P4 -","- C240 H360 N8 O32 P16 -","4","1","","Le Saulnier, Laetitia; Varbanov, Sabi; Scopelliti, Rosario; Elhabiri, Mourad; Bünzli, Jean-Claude G.","Lanthanide complexes with a p-tert-butylcalix[4]arene fitted with phosphinoyl pendant arms †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3919","","10.1039/a907693j","","","0.7107","MoKα","","0.1051","0.055","","","0.1207","0.1349","","","","","","0.928","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027814","7.221","0.008","8.463","0.013","10.585","0.012","103.69","0.11","98.36","0.09","110.57","0.11","569.5","1.4","298","","298","","","","","","","","see text","5","P -1","-P 1","2","","","","- C12 H18 Cu2 N12 O12 -","- C12 H18 Cu2 N12 O12 -","- C12 H18 Cu2 N12 O12 -","1","0.5","","Ferrer, Sacramento; van Koningsbruggen, Petra J.; Haasnoot, Jaap G.; Reedijk, Jan; Kooijman, Huub; Spek, Anthony L.; Lezama, Luis; Arif, Atta M.; Miller, Joel S.","Dimetallic complexes derived from a novel dinucleating chelating symmetric triazole ligand; crystal structure, magnetic properties and ESR study of bis[μ-3,5-diacetylamino-1,2,4-triazolato-O ′,N 1,N 2,O ″]bis[(nitrato)(aqua)copper(II)] ‡","Journal of the Chemical Society, Dalton Transactions","1999","","23","4269","","10.1039/a907740e","","","0.71073","MoKα","","","0.09","","","0.119","","","","","","","2.1","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027815","24.484","0.004","26.086","0.004","23.553","0.003","90","","101.44","0.01","90","","14744","4","293","","293","","","","","","","","?","5","C 1 2/c 1","-C 2yc","15","","","","- C108 H188 Na O64 Y9 -","- C96 Na O62 Y9 -","- C384 Na4 O248 Y36 -","4","0.5","","Hubert-Pfalzgraf, Liliane G.; Miele-Pajot, Nathalie; Papiernik, Renée; Vaissermann, Jacqueline","A novel example of self-assembly in lanthanide chemistry: synthesis and molecular structure of [Na(EtOH)6][Y9(μ4-O)2(μ3-OH)8{μ-η2-MeC(O)CHC(O)OEt}8{η2-MeC(O)CHC(O)OEt}8] †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4127","","10.1039/a907755c","","","0.71069","MoKα","","","0.0837","","","0.0919","","","","","1.0801","1.0801","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7027816","15.681","0.001","11.324","0.002","9.807","0.001","90","","90","","90","","1741.4","0.4","296.2","","296.2","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C10 H12 Cl2 Ir2 N2 O6 -","- C10 H12 Cl2 Ir2 N2 O6 -","- C40 H48 Cl8 Ir8 N8 O24 -","4","1","","Kanematsu, Naohiro; Ebihara, Masahiro; Kawamura, Takashi","A one-step synthesis of an iridium(II) dinuclear complex. Preparation, structures and properties of bis(μ-acetato)dicarbonyldichlorodiiridium(II) complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4413","","10.1039/a907776f","","","0.7107","MoKα","","0.0707","0.0386","","","0.0809","0.0908","","","","","","1.013","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027817","9.913","0.002","12.268","0.002","8.369","0.002","90.57","0.01","95.88","0.02","75.35","0.01","979.4","0.4","193.2","","193.2","","","","","","","","","6","P -1","-P 1","2","","","","- C10 H18 Cl2 Ir2 O8 S2 -","- C10 H18 Cl2 Ir2 O8 S2 -","- C20 H36 Cl4 Ir4 O16 S4 -","2","1","","Kanematsu, Naohiro; Ebihara, Masahiro; Kawamura, Takashi","A one-step synthesis of an iridium(II) dinuclear complex. Preparation, structures and properties of bis(μ-acetato)dicarbonyldichlorodiiridium(II) complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4413","","10.1039/a907776f","","","0.7107","MoKα","","0.0272","0.0272","","","0.0323","0.0323","","","","","","1.679","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7027818","16.3167","0.0005","8.3925","0.0005","16.0097","0.0004","90","","106.461","0.002","90","","2102.48","0.15","296.2","","296.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H16 Cl2 Ir2 N2 O6 -","- C16 H16 Cl2 Ir2 N2 O6 -","- C64 H64 Cl8 Ir8 N8 O24 -","4","0.5","","Kanematsu, Naohiro; Ebihara, Masahiro; Kawamura, Takashi","A one-step synthesis of an iridium(II) dinuclear complex. Preparation, structures and properties of bis(μ-acetato)dicarbonyldichlorodiiridium(II) complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4413","","10.1039/a907776f","","","0.7107","MoKα","","0.0304","0.0304","","","0.046","0.046","","","","","","1.776","","","","has coordinates,has disorder","179984","2020-10-21","18:00:00",""
"7027819","16.783","0.007","7.454","0.002","16.124","0.007","90","","104.17","0.02","90","","1955.7","1.3","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C12 H29 Cl3 Co N5 O4 -","- C12 H29 Cl3 Co N5 O4 -","- C48 H116 Cl12 Co4 N20 O16 -","4","1","","Benzo, Fabián; Bernhardt, Paul V.; González, Gabriel; Martinez, Manuel; Sienra, Beatriz","Variable temperature and pressure study of the aquation reactions of cobalt(III) and chromium(III) penta- and tetra-amines †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3973","","10.1039/a907895i","","","0.71073","MoKα","","0.0533","0.0466","","0.131","0.1254","","","","1.083","1.099","1.099","","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027820","9.599","0.006","16.335","0.002","16.653","0.009","90","","100.62","0.03","90","","2566","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H35 Cl3 Co N5 O15 -","- C12 H31 Cl3 Co N5 O15.016 -","- C48 H124 Cl12 Co4 N20 O60.064 -","4","1","","Benzo, Fabián; Bernhardt, Paul V.; González, Gabriel; Martinez, Manuel; Sienra, Beatriz","Variable temperature and pressure study of the aquation reactions of cobalt(III) and chromium(III) penta- and tetra-amines †","Journal of the Chemical Society, Dalton Transactions","1999","","22","3973","","10.1039/a907895i","","","0.71073","MoKα","","0.0749","0.0669","","0.2028","0.1927","","","","1.044","1.07","1.07","","","","","has coordinates,has disorder","179984","2020-10-21","18:00:00",""
"7027821","10.519","0.002","14.653","0.003","17.505","0.004","72.72","0.02","89.84","0.02","79.68","0.02","2531","1","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H30 Mn O3 P5 -","- C18 H30 Mn O3 P5 -","- C72 H120 Mn4 O12 P20 -","4","2","","Sünkel, Karlheinz; Stramm, Cornelia; Soheili, Sabine","Synthesis and characterization of pentakis(dimethylphosphanyl)cymantrene [Mn{C5(PMe2)5}(CO)3], the first cyclopentadienyl complex with five phosphanyl substituents †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4299","","10.1039/a907973d","","","0.71073","MoKα","","0.0842","0.0541","","","0.1299","0.1476","","","","","","1.012","","","","has coordinates,has disorder","301848","2025-08-21","12:23:48",""
"7027822","8.937","0.0018","14.42","0.003","15.427","0.003","82.42","0.03","88.44","0.03","75.8","0.03","1910.5","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C37 H51 N3 O3 P Rh -","- C37 H51 N3 O3 P Rh -","- C74 H102 N6 O6 P2 Rh2 -","2","1","","Karlsson, Magnus; Johansson, Maria; Andersson, Carlaxel","Synthesis, characterisation and ligand properties of a new amphiphilic triphenylphosphine analogue †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4187","","10.1039/a908077e","","","0.71073","MoKα","","0.1857","0.0583","","","0.1179","0.1713","","","","","","0.924","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027823","15.366","0.003","16.789","0.003","18.212","0.004","107.15","0.03","110.24","0.03","104.79","0.03","3863","2","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C69 H94 B2 Cl2 Mo2 N16 O6 -","- C71 H64 B2 Cl2 Mo2 N16 O4 -","- C142 H128 B4 Cl4 Mo4 N32 O8 -","2","1","","Shonfield, Peter K. A.; Behrendt, Andreas; Jeffery, John C.; Maher, John P.; McCleverty, Jon A.; Psillakis, Elefteria; Ward, Michael D.; Western, Colin","Very weak electron‒electron exchange interactions in paramagnetic dinuclear tris(pyrazolyl)boratomolybdenum centres with extended bridging ligands: estimation of the exchange coupling constant J by simulation of second-order EPR spectra †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4341","","10.1039/a908138k","","","0.71073","MoKα","","0.1469","0.0918","","0.2499","0.1927","","","","1.138","1.161","1.161","","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027824","11.0695","0.0004","11.4615","0.0006","13.8026","0.0007","90","","90","","90","","1751.18","0.14","193","","193","","","","","","","","see text","6","P 21 21 2","P 2 2ab","18","","","","- C23 H54 N4 O2 Si4 Y -","- C23 H54 N4 O2 Si4 Y -","- C46 H108 N8 O4 Si8 Y2 -","2","0.5","","Görlitzer, Hans W.; Spiegler, Michael; Anwander, Reiner","C2-symmetric bis(oxazolinato) complexes of yttrium and lanthanum † ‡","Journal of the Chemical Society, Dalton Transactions","1999","","24","4287","","10.1039/a908313h","","","0.71073","MoKα","","0.0581","0.0576","","","0.1439","0.1441","","","","","","1.207","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027825","8.682","0.003","17.52","0.003","13.6","0.003","90","","107.35","0.02","90","","1974.6","0.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[(salen????)VO]","","","- C21 H24 N2 O5 V -","- C21 H24 N2 O5 V -","- C84 H96 N8 O20 V4 -","4","1","","Choudhary, Nosheen F.; Connelly, Neil G.; Hitchcock, Peter B.; Leigh, G. Jeffery","New compounds of tetradentate Schiff bases with vanadium(IV) and vanadium(V) †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4437","","10.1039/a908337e","","","0.71073","MoKα","","0.0847","0.0683","","0.2026","0.1809","","","","1.087","1.113","1.113","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027826","7.625","0.003","17.769","0.005","14.628","0.007","90","","93.51","0.04","90","","1978.2","1.3","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","[(salen)VOV(O)(salen)][I3]","","","- C18 H18 I1.5 N2 O3 V -","- C18 H18 I1.5 N2 O3 V -","- C72 H72 I6 N8 O12 V4 -","4","2","","Choudhary, Nosheen F.; Connelly, Neil G.; Hitchcock, Peter B.; Leigh, G. Jeffery","New compounds of tetradentate Schiff bases with vanadium(IV) and vanadium(V) †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4437","","10.1039/a908337e","","","0.71073","MoKα","","0.0842","0.0511","","0.1086","0.0948","","","","1.055","1.138","1.138","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027827","13.712","0.005","13.666","0.003","21.31","0.008","90","","108.11","0.03","90","","3795","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","[{VO(sal-1,2pr)}2][I3]","","","- C34 H32 I3 N4 O6 V2 -","- C34 H32 I3 N4 O6 V2 -","- C136 H128 I12 N16 O24 V8 -","4","1","","Choudhary, Nosheen F.; Connelly, Neil G.; Hitchcock, Peter B.; Leigh, G. Jeffery","New compounds of tetradentate Schiff bases with vanadium(IV) and vanadium(V) †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4437","","10.1039/a908337e","","","0.7107","MoKα","","0.3071","0.1223","","0.3358","0.2342","","","","1.056","1.314","1.314","","","","","has coordinates","179984","2020-10-21","18:00:00",""
"7027828","15.157","0.005","10.378","0.002","23.576","0.005","90","","93.33","0.02","90","","3702.2","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","[(salen)VOV(O)(salen)][ClO4]","","","- C36 H36 Cl N4 O10 V2 -","- C36 H36 Cl N4 O10 V2 -","- C144 H144 Cl4 N16 O40 V8 -","4","1","","Choudhary, Nosheen F.; Connelly, Neil G.; Hitchcock, Peter B.; Leigh, G. Jeffery","New compounds of tetradentate Schiff bases with vanadium(IV) and vanadium(V) †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4437","","10.1039/a908337e","","","0.71073","MoKα","","0.1362","0.0752","","0.2232","0.1796","","","","1.026","1.12","1.12","","","","","has coordinates","301848","2025-08-21","12:23:48",""
"7027829","25.205","0.006","20.141","0.004","17.587","0.004","90","","114.145","0.003","90","","8147","3","168","2","168","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C30 H24 Cl5 Cu2.5 N9 O6 P3 -","- C30 H24 Cl5 Cu2.5 N9 O6 P3 -","- C240 H192 Cl40 Cu20 N72 O48 P24 -","8","1","","Ainscough, Eric W.; Brodie, Andrew M.; Depree, Craig V.","Polymer building blocks: a CuCl2-bridged phosphazene dimer containing κ5N coordinated Cu(II) †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4123","","10.1039/a908430d","","","0.71073","MoKα","","0.0479","0.0337","","","0.0849","0.093","","","","","","1.069","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7051381","28.534","0.008","15.244","0.008","12.982","0.008","90","","90","","90","","5646.8","4.8","213","2","213","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C64 H62 Co4 O16 -","- C64 H54 Co4 O16 -","- C256 H216 Co16 O64 -","4","0.5","","","","New Journal of Chemistry","1999","23","1","17","24","10.1039/a806501b","","","","","","","0.0844","","","0.2333","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051382","7.952","0.002","11.592","0.003","13.97","0.01","67.77","0.04","88.13","0.04","84.3","0.02","1186.1","1","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H23 Cr O8 -","- C28 H23 Cr O8 -","- C56 H46 Cr2 O16 -","2","1","","","","New Journal of Chemistry","1999","23","1","17","24","10.1039/a806501b","","","","","","","0.0404","","","0.0977","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051383","8.937","0.006","14.084","0.008","23.76","0.01","99.27","0.04","100.71","0.05","90.21","0.05","2898","3","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H36 Co2 O10 -","- C28 H30.5 Co2 O10 -","- C112 H122 Co8 O40 -","4","2","","","","New Journal of Chemistry","1999","23","1","17","24","10.1039/a806501b","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051384","25.066","0.004","9.615","0.003","13.945","0.008","90","","112.69","0.03","90","","3101","2","223","2","223","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C32 H40 Cr2 O10 -","- C32 H28 Cr2 O10 -","- C128 H112 Cr8 O40 -","4","0.5","","","","New Journal of Chemistry","1999","23","1","17","24","10.1039/a806501b","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051385","13.9562","0.0003","15.0799","0.0004","23.1845","0.0002","90","","102.979","0.001","90","","4754.7","0.2","300","2","300","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C48 H26 N12 Si -","- C48 H26 N12 Si -","- C192 H104 N48 Si4 -","4","1","","Stradiotto, Mark; Brook, Michael A.; McGlinchey, Michael J.","The Molecular Dynamics and cycloaddition chemistry of tris(1-indenyl)allylsilane: Generation of the first crystallographically-characterized tris(benzonorbornyl)silane","New Journal of Chemistry","1999","23","3","317","321","10.1039/a806739b","","","","","","","0.0777","","","0.2053","","","","","","","","","","","has coordinates,has disorder","301851","2025-08-21","20:32:38",""
"7051386","10.5939","0.0006","24.5212","0.0015","12.1504","0.0009","90","","95.004","0.006","90","","3144.3","0.4","150","1","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C33 H31 Cl N3 O5 P Pd -","- C33 H31 Cl N3 O5 P Pd -","- C132 H124 Cl4 N12 O20 P4 Pd4 -","4","1","","","","New Journal of Chemistry","1999","23","2","227","235","10.1039/a807066k","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051387","16.058","0.002","16.058","0.002","10.286","0.002","90","","90","","120","","2297","0.6","298","2","298","2","","","","","","","","6","P 3","P 3","143","","","","- C21 H38 Cl3.33 Fe0.33 Mg2.33 O8 -","- C21 H38 Cl4.66667 Fe0.666667 Mg2.33333 O8 -","- C63 H114 Cl14 Fe2 Mg7 O24 -","3","1","","","","New Journal of Chemistry","1999","23","2","185","188","10.1039/a807745b","","","","","","","0.0666","","","0.1726","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051388","12.079","0.003","12.15","0.003","17.641","0.004","87.02","0.03","78","0.03","60.87","0.03","2208.4","0.9","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H62.5 Cl4 Mg2.8 Ni1.2 O12.5 -","- C29 H62.5 Cl4 Mg2.8 Ni1.2 O12.5 -","- C58 H125 Cl8 Mg5.6 Ni2.4 O25 -","2","1","","","","New Journal of Chemistry","1999","23","2","185","188","10.1039/a807745b","","","","","","","0.0416","","","0.1129","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051389","7.053","0.002","13.818","0.005","16.452","0.006","90","","90","","90","","1603.4","0.7","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H24 Cl2 N4 Ti -","- C10 H24 Cl2 N4 Ti -","- C40 H96 Cl8 N16 Ti4 -","4","1","","","","New Journal of Chemistry","1999","23","3","271","273","10.1039/a807985d","","","","","","","0.0455","","","0.0475","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051390","9.871","0.005","16.677","0.011","15.02","0.011","90","","103.51","0.05","90","","2404.1","2.1","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H42 Cl2 N4 Ti -","- C19 H42 Cl2 N4 Ti -","- C76 H168 Cl8 N16 Ti4 -","4","1","","","","New Journal of Chemistry","1999","23","3","271","273","10.1039/a807985d","","","","","","","0.0681","","","0.0672","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051391","12.378","0.005","7.934","0.003","6.322","0.003","90","","99.07","0.03","90","","613.04","","220","","220","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C4 H4 Ag N3 O2 -","- C4 H4 Ag N3 O2 -","- C16 H16 Ag4 N12 O8 -","4","0.5","","","","New Journal of Chemistry","1999","23","1","13","15","10.1039/a808025i","","","","","","","0.0443","","","0.0459","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051392","7.2931","0.0012","6.087","0.002","11.481","0.003","90","","102.871","0.017","90","","496.8","0.2","220","2","220","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","[Ag(4,4'bipy)NO2]","","","- C10 H8 Ag N3 O2 -","- C10 H8 Ag N3 O2 -","- C20 H16 Ag2 N6 O4 -","2","0.5","","","","New Journal of Chemistry","1999","23","1","13","15","10.1039/a808025i","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051393","11.132","0.002","11.12","0.002","20.726","0.005","77.81","0.02","83.31","0.02","89.95","0.014","2490","0.9","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C12 H19 Li N2 O -","- C12 H19 Li N2 O -","- C96 H152 Li8 N16 O8 -","8","4","","","","New Journal of Chemistry","1999","23","1","35","41","10.1039/a808050j","","","","","","","0.0698","","","0.2173","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
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"7051427","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}","","","- C15.5 H13 Cl Co N8 O6 -","- C15.5 H13 Cl Co N8 O6 -","- C124 H104 Cl8 Co8 N64 O48 -","8","1","","","","New Journal of Chemistry","1999","23","6","573","575","10.1039/a900947g","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051428","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","","","- C15.5 H15 Cd Cl N8 O7 -","- C15.5 H13 Cd Cl N8 O7 -","- C124 H104 Cd8 Cl8 N64 O56 -","8","1","","","","New Journal of Chemistry","1999","23","6","573","575","10.1039/a900947g","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051429","7.853","0.001","15.937","0.001","9.993","0.001","90","","95.65","0.01","90","","1244.6","0.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C11 H7 N O4 S Zn -","- C11 H7 N O4 S Zn -","- C44 H28 N4 O16 S4 Zn4 -","4","1","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","0.025","","","0.065","","","","","","","","","","","has coordinates","198588","2020-10-21","18:00:00",""
"7051430","8.595","0.003","9.491","0.003","12.748","0.006","69.31","0.03","85.99","0.03","67.59","0.02","896.9","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H15 N2 O6.5 S Zn -","- C16 H15 N2 O6.5 S Zn -","- C32 H30 N4 O13 S2 Zn2 -","2","1","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","","","","","","","","","","","","","","","has coordinates","198589","2020-10-21","18:00:00",""
"7051431","10.977","0.002","15.558","0.002","11.376","0.003","90","","116.36","0.03","90","","1740.7","0.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H12 N2 O5 S Zn -","- C18 H12 N2 O5 S Zn -","- C72 H48 N8 O20 S4 Zn4 -","4","1","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","0.0235","","","0.0646","","","","","","","","","","","has coordinates","198588","2020-10-21","18:00:00",""
"7051432","10.917","0.002","15.711","0.002","11.33","0.002","90","","116.01","0.03","90","","1746.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H12 Co N2 O5 S -","- C18 H12 Co N2 O5 S -","- C72 H48 Co4 N8 O20 S4 -","4","1","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","0.0419","","","0.0865","","","","","","","","","","","has coordinates","198589","2020-10-21","18:00:00",""
"7051433","8.031","0.002","18.113","0.006","21.755","0.006","90","","90","","90","","3165","2","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C18 H10 Mn N2 O4 S -","- C18 H10 Mn N2 O4 S -","- C144 H80 Mn8 N16 O32 S8 -","8","1","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","0.0428","","","0.0874","","","","","","","","","","","has coordinates","198588","2020-10-21","18:00:00",""
"7051434","7.349","0.001","18.165","0.001","6.721","0.001","90","","90","","90","","897.3","0.1","293","2","293","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C6 H6 Mn O6 S -","- C6 H6 Mn O6 S -","- C24 H24 Mn4 O24 S4 -","4","0.5","","Chen, Bang-Lin; Mok, Kum-Fun; Ng, Siu-Choon; Drew, Michael G. B.","Thiophene-2,5-dicarboxylic acid incorporated self-assembly of one-, two- and three-dimensional coordination polymers","New Journal of Chemistry","1999","23","8","877","883","10.1039/a901688k","","","","","","","0.0238","","","0.0602","","","","","","","","","","","has coordinates","198589","2020-10-21","18:00:00",""
"7051435","12.5133","0.0008","27.125","0.002","16.0006","0.001","90","","92.529","0.001","90","","5425.6","0.6","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C48 H48 Cl2 F12 Fe2 N8 O P2 -","- C48 H48 Cl2 F12 Fe2 N8 O P2 -","- C192 H192 Cl8 F48 Fe8 N32 O4 P8 -","4","0.5","","","","New Journal of Chemistry","1999","23","7","785","790","10.1039/a901893j","","","","","","","0.0942","","","0.2014","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051436","17.0596","0.0002","11.1202","0.0002","28.8769","0.0004","90","","90","","90","","5478.13","0.14","193","2","193","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","","","","- C24 H24 Cl2 F6 Fe N4 P -","- C24 H24 Cl2 F6 Fe N4 P -","- C192 H192 Cl16 F48 Fe8 N32 P8 -","8","1","","","","New Journal of Chemistry","1999","23","7","785","790","10.1039/a901893j","","","","","","","0.0687","","","0.1923","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051437","7.161","0.002","8.296","0.003","11.377","0.003","77.42","0.03","82.78","0.03","68.75","0.03","614","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H17 N O3 -","- C15 H17 N O3 -","- C30 H34 N2 O6 -","2","1","","","","New Journal of Chemistry","1999","23","7","743","748","10.1039/a901896d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051438","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","2","208","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H6 Cr O5 -","- C10 H6 Cr O5 -","- C20 H12 Cr2 O10 -","2","1","","","pi-Bonded organometallic building blocks for supramolecular chemistry.","New Journal of Chemistry","1999","23","5","461","463","10.1039/a901925a","","","","","","","0.0449","","","0.0981","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051439","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","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H24 Cr O10 -","- C20 H24 Cr O10 -","- C80 H96 Cr4 O40 -","4","2","","","pi-Bonded organometallic building blocks for supramolecular chemistry.","New Journal of Chemistry","1999","23","5","461","463","10.1039/a901925a","","","","","","","0.1101","","","0.2674","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051440","14.646","0.002","8.597","0.002","10.128","0.002","90","","105.45","0.01","90","","1229.2","0.4","298.2","","298.2","","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C22 H32 Cl2 N2 O2 Zn -","- C44 H64 Cl4 N4 O4 Zn -","- C88 H128 Cl8 N8 O8 Zn2 -","2","0.5","","","","New Journal of Chemistry","1999","23","6","629","632","10.1039/a902177i","","","","","","","0.0505","","","0.0508","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051441","9.622","0.004","15.155","0.005","9.522","0.003","101.21","0.03","95.9","0.04","108.32","0.03","1272.9","0.9","153.2","","153.2","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H35 B N O -","- C30 H35 B N O -","- C60 H70 B2 N2 O2 -","2","1","","Toshihiro Murafuji","","New Journal of Chemistry","1999","23","7","683","685","10.1039/a902282a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051442","9.491","0.004","11.884","0.003","12.912","0.003","90","","108.35","0.02","90","","1382.3","0.7","153.2","","153.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","4""-dimethylamino-1,3-diphenylpropen-1-one","","","- C17 H17 N O -","- C17 H17 N O -","- C68 H68 N4 O4 -","4","1","","","","New Journal of Chemistry","1999","23","7","683","685","10.1039/a902282a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051443","13.281","0.001","13.328","0.001","19.818","0.001","105.4","0.01","92.78","0.01","113.24","0.01","3060.7","0.4","173","0.1","173","0.1","","","","","","","","4","P -1","-P 1","2","","","","- C25 H17 Cl11 O4 -","- C25 H17 Cl11 O4 -","- C100 H68 Cl44 O16 -","4","2","","Kolehmainen, Erkki; Koivisto, Jari; Nissinen Maij; Laihia, Katri; Rissanen, Kari","","New Journal of Chemistry","1999","23","7","691","693","10.1039/a902627d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051444","15.134","0.001","13.357","0.001","15.331","0.001","90","","118.89","0.01","90","","2713.4","0.3","173","0.1","173","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H16 Cl8 O4 -","- C24 H16 Cl8 O4 -","- C96 H64 Cl32 O16 -","4","1","","Kolehmainen, Erkki; Koivisto, Jari; Nissinen Maij; Laihia, Katri; Rissanen, Kari","","New Journal of Chemistry","1999","23","7","691","693","10.1039/a902627d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051445","13.3168","0.0006","13.4648","0.0006","18.2628","0.0008","109.01","","96.129","0.001","113.859","0.001","2721.6","0.2","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C60.5 H53 N3 O1.5 P4 Pt Se -","- C60.5 H51 N3 O1.5 P4 Pt Se -","- C121 H102 N6 O3 P8 Pt2 Se2 -","2","1","","","","New Journal of Chemistry","1999","23","7","777","783","10.1039/a902738f","","","","","","","0.0359","","","0.0824","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051446","9.8531","0.0003","13.4561","0.0004","15.5289","0.0005","102.982","0.001","94.774","0.001","110.61","0.001","1847.89","0.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H35 N2 O P3 Pd S -","- C42 H35 N2 O P3 Pd S -","- C84 H70 N4 O2 P6 Pd2 S2 -","2","1","","","","New Journal of Chemistry","1999","23","7","777","783","10.1039/a902738f","","","","","","","0.049","","","0.1157","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051447","9.0446","0.0003","11.5989","0.0003","19.1145","0.0006","91.803","0.001","95.279","0.001","104.479","0.001","1930.24","0.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C42 H36 Au N2 O P3 S -","- C42 H36 Au N2 O P3 S -","- C84 H72 Au2 N4 O2 P6 S2 -","2","1","","","","New Journal of Chemistry","1999","23","7","777","783","10.1039/a902738f","","","","","","","0.0413","","","0.1006","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051448","10.7499","0.0003","13.9705","0.0004","16.7686","0.0004","112.019","0.001","99.431","0.001","98.635","0.001","2240.61","0.1","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C43.25 H39.25 Cl0.75 N2 O P3 Pt S -","- C43.25 H39 Cl0.75 N2 O P3 Pt S -","- C86.5 H78 Cl1.5 N4 O2 P6 Pt2 S2 -","2","1","","","","New Journal of Chemistry","1999","23","7","777","783","10.1039/a902738f","","","","","","","0.0438","","","0.0994","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051449","6.865","0.001","10.751","0.002","24.7","0.004","90","","92.26","0.02","90","","1821.6","0.5","300","2","300","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H12 Cr Fe O8 -","- C16 H12 Cr Fe O8 -","- C64 H48 Cr4 Fe4 O32 -","4","1","","Behrendt, U.; Pfeifer, R.-M..; Wartchow, R.; Butenschön, H.","Some bimetallic half sandwich iron complexes with metal carbene substitution at the cyclopentadienyl ligand : Synthesis, characterization, structure, and cyclic voltammetry","New Journal of Chemistry","1999","23","8","891","895","10.1039/a902815c","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051450","11.257","0.002","8.671","0.001","14.644","0.002","90","","107.33","0.02","90","","1364.5","0.3","183","2","183","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H11 Cl3 Fe N3 -","- C11 H11 Cl3 Fe N3 -","- C44 H44 Cl12 Fe4 N12 -","4","1","","Michael Renz; Catherine Hemmert; Heinz Gornitzka; Bernard Meunier","Influence of the anion of FeIII salts on the product distribution in the oxidative degradation of a tetrapyridyl ligand","New Journal of Chemistry","1999","23","7","773","776","10.1039/a902907i","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051451","9.21","0.01","9.779","0.011","22.6","0.02","90","","90","","90","","2035","4","293","2","293","2","","","","","","","","8","P n m a","-P 2ac 2n","62","","","","- C10 H22 Cl F6 O P Ru S5 -","- C10 H22 Cl F6 O P Ru S5 -","- C40 H88 Cl4 F24 O4 P4 Ru4 S20 -","4","0.5","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates","277928","2022-09-16","20:08:52",""
"7051452","10.391","0.011","20.94","0.02","11.488","0.013","90","","90.38","0.01","90","","2499","5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C12 H22 F12 N2 P2 Ru S4 -","- C12 H22 F12 N2 P2 Ru S4 -","- C48 H88 F48 N8 P8 Ru4 S16 -","4","1","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","277928","2022-09-16","20:08:55",""
"7051453","12.264","0.015","9.189","0.011","8.822","0.01","90","","96.02","0.01","90","","989","2","293","2","293","2","","","","","","","","8","C 1 m 1","C -2y","8","","","","- C10 H19 Cl F6 N P Ru S4 -","- C10 H19 Cl F6 N P Ru S4 -","- C20 H38 Cl2 F12 N2 P2 Ru2 S8 -","2","0.5","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","277928","2022-09-16","20:08:55",""
"7051454","7.655","0.009","15.928","0.017","21.47","0.02","90","","90","","90","","2618","5","293","2","293","2","","","","","","","","8","P c 21 b","","","","","","- C17 H25 Cl F6 N3 P Ru S4 -","- C17 H25 Cl F6 N3 P Ru S4 -","- C68 H100 Cl4 F24 N12 P4 Ru4 S16 -","4","1","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","277928","2022-09-16","20:08:55",""
"7051455","19.95","0.02","14.86","0.016","21.52","0.02","90","","90","","90","","6382","12","293","2","293","2","","","","","","","","7","P c a b","-P 2bc 2ac","61","","","","- C26 H28 F12 N2 P2 Ru S4 -","- C26 H28 F12 N2 P2 Ru S4 -","- C208 H224 F96 N16 P16 Ru8 S32 -","8","1","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates","277928","2022-09-16","20:08:55",""
"7051456","18.89","0.02","11.713","0.013","15.908","0.018","90","","104.06","0.01","90","","3415","7","293","2","293","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C24 H28 F12 N4 O2 P2 Ru S4 -","- C24 H28 F12 N4 O2 P2 Ru S4 -","- C96 H112 F48 N16 O8 P8 Ru4 S16 -","4","0.5","","Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B.","Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands","New Journal of Chemistry","1999","23","10","1015","1025","10.1039/a903117k","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","277928","2022-09-16","20:08:55",""
"7051457","10.207","0.001","14.45","0.001","17.827","0.001","81.979","0.001","85.967","0.001","88.873","0.001","2597","0.3","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H54 N4 O7 Zn -","- C64 H54 N4 O7 Zn -","- C128 H108 N8 O14 Zn2 -","2","1","","","","New Journal of Chemistry","1999","23","8","885","890","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051458","12.182","0.001","12.431","0.001","17.077","0.001","70.652","0.001","82.999","0.001","87.552","0.001","2421.8","0.3","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C59 H52 N4 O6 Zn -","- C59 H50 N4 O6 Zn -","- C118 H100 N8 O12 Zn2 -","2","1","","","","New Journal of Chemistry","1999","23","8","885","890","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051459","9.019","0.001","10.747","0.001","16.206","0.001","83.067","0.001","80.648","0.001","77.566","0.001","1507.6","0.2","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C64 H67 N4 Na O18 Zn -","- C64 H62 N4 Na O18 Zn -","- C64 H62 N4 Na O18 Zn -","1","0.5","","","","New Journal of Chemistry","1999","23","8","885","890","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051460","12.448","0.001","15.412","0.001","16.307","0.001","100.549","0.01","90.827","0.01","100.268","0.01","3022.8","0.4","120","","120","","","","","","","","","6","P -1","-P 1","2","","","","- C64 H67 K N4 O18 Zn -","- C64 H63 K N4 O18 Zn -","- C128 H126 K2 N8 O36 Zn2 -","2","1","","","","New Journal of Chemistry","1999","23","8","885","890","10.1039/a903242h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051461","8.168","0.001","9.279","0.002","9.875","0.002","65.47","0.02","80.99","0.01","67.69","0.01","629.9","0.2","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","(±)-longamide B methyl ester","","","- C10 H10 Br2 N2 O3 -","- C10 H10 Br2 N2 O3 -","- C20 H20 Br4 N4 O6 -","2","1","","Banwell, Martin, G.; Bray, Andrew M.; Willis, Anthony C.; Wong, David J.","First Syntheses of the Pyrroloketopiperazine Marine Natural Products (±)-Longamide, (±)-Longamide B Methyl Ester and and (±)-Hanishin.","New Journal of Chemistry","1999","23","7","687","690","10.1039/a903330k","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"7051462","12.047","0.002","14.647","0.003","21.254","0.004","80.68","0.02","83.04","0.03","76.34","0.03","3582.7","1.2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C10 H75 Mn Mo12 N10 Na O69 P8 -","- C10 H50 Mn Mo12 N10 Na O69 P8 -","- C20 H100 Mn2 Mo24 N20 Na2 O138 P16 -","2","1","","","","New Journal of Chemistry","1999","23","10","1041","1044","10.1039/a903589c","","","","","","","0.0502","","","0.1254","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051463","12.437","0.004","13.441","0.004","19.06","0.006","90","","102.05","0.03","90","","3116","2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C32 H41 Cl N P2 S Tc -","- C32 H41 Cl N P2 S Tc -","- C128 H164 Cl4 N4 P8 S4 Tc4 -","4","1","","","","New Journal of Chemistry","1999","23","8","807","809","10.1039/a903679b","","","","","","","0.0433","","","0.0993","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051464","10.528","0.009","11.731","0.009","24.25","0.01","90","","95.32","0.08","90","","2982","4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C28 H52 N P2 S2 Tc -","- C28 N P2 S2 Tc -","- C112 N4 P8 S8 Tc4 -","4","0.5","","","","New Journal of Chemistry","1999","23","8","807","809","10.1039/a903679b","","","","","","","0.0779","","","0.2038","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051465","17.52","0.002","11.007","0.001","9.9","0.001","90","","93.9","0.01","90","","1904.7","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H26 O2 S2 -","- C21 H26 O2 S2 -","- C84 H104 O8 S8 -","4","1","","Thiemann, Thies; Ohira, Daisuke; Li, Yuanqiang; Sawada, Tsuyoshi; Taniguchi, Masahiko; Tashiro, Masashi; Mataka, Shuntaro","","New Journal of Chemistry","1999","23","7","675","678","10.1039/a903746b","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051466","7.803","0.001","9.474","0.001","17.819","0.004","90","","90","","90","","1317.3","0.4","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H14 N4 -","- C15 H14 N4 -","- C60 H56 N16 -","4","1","","","Crystal Structures of Amino substituted dicyanoquinodimethanes with Potential Nonlinear Optical Applications","New Journal of Chemistry","1999","23","8","841","844","10.1039/a903793d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051467","10.114","0.001","14.412","0.002","12.142","0.002","90","","113.634","0.006","90","","1621.4","0.4","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 F4 N4 -","- C18 H16 F4 N4 -","- C72 H64 F16 N16 -","4","1","","","Crystal Structures of Amino substituted dicyanoquinodimethanes with Potential Nonlinear Optical Applications","New Journal of Chemistry","1999","23","8","841","844","10.1039/a903793d","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051468","18.136","0.004","11.396","0.002","19.734","0.004","90","","94.21","0.03","90","","4067.6","1.4","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H17 Cl F9 P -","- C19 H17 Cl F9 P -","- C152 H136 Cl8 F72 P8 -","8","2","","Voelker, Heike; Labahn, Dieter; Bohnen, Frank-Michael; Herbst-Irmer, Regine; Stalke, Dietmar; Edelmann, Frank T.; Roesky, Herbert W.","Structural Diversity in Nonafluoromesityl Chemistry","New Journal of Chemistry","1999","23","9","905","909","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301851","2025-08-21","20:32:38",""
"7051469","13.136","0.004","13.253","0.003","17.247","0.004","88.8","0.01","68.28","0.01","75.47","0.01","2691.5","1.2","188","2","188","2","","","","","","","","5","P -1","-P 1","2","","","","- C46.5 H20 F36 Se4 Sn -","- C46.5 H20 F36 Se4 Sn -","- C93 H40 F72 Se8 Sn2 -","2","1","","Voelker, Heike; Labahn, Dieter; Bohnen, Frank-Michael; Herbst-Irmer, Regine; Stalke, Dietmar; Edelmann, Frank T.; Roesky, Herbert W.","Structural Diversity in Nonafluoromesityl Chemistry","New Journal of Chemistry","1999","23","9","905","909","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051470","8.874","0.001","17.781","0.002","13.383","0.001","90","","97.22","0.01","90","","2094.9","0.4","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H4 F18 Te -","- C18 H4 F18 Te -","- C72 H16 F72 Te4 -","4","1","","Voelker, Heike; Labahn, Dieter; Bohnen, Frank-Michael; Herbst-Irmer, Regine; Stalke, Dietmar; Edelmann, Frank T.; Roesky, Herbert W.","Structural Diversity in Nonafluoromesityl Chemistry","New Journal of Chemistry","1999","23","9","905","909","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301851","2025-08-21","20:32:38",""
"7051471","16.504","0.001","16.504","0.001","30.677","0.002","90","","90","","90","","8355.9","0.9","153","2","153","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C36 H8 Ag4 F36 -","- C36 H8 Ag4 F36 -","- C288 H64 Ag32 F288 -","8","0.5","","Voelker, Heike; Labahn, Dieter; Bohnen, Frank-Michael; Herbst-Irmer, Regine; Stalke, Dietmar; Edelmann, Frank T.; Roesky, Herbert W.","Structural Diversity in Nonafluoromesityl Chemistry","New Journal of Chemistry","1999","23","9","905","909","10.1039/a903798e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301851","2025-08-21","20:32:38",""
"7051472","16.085","0.005","14.361","0.005","19.564","0.005","90","0.005","94.39","0.005","90","0.005","4506","2","293","2","293","2","","","","","","","","7","P 1 21/a 1","-P 2yab","14","","","","- C40 H40 Cl2 F12 N2 P4 Pd -","- C40 H38 Cl2 F12 N2 P4 Pd -","- C160 H152 Cl8 F48 N8 P16 Pd4 -","4","1","","","","New Journal of Chemistry","1999","23","9","929","938","10.1039/a903823j","","","","","","","0.088","","","0.2134","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051473","15.742","0.002","17.522","0.002","21.814","0.003","90","","91.08","0.01","90","","6015.9","1.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C68 H58 N4 O22 -","- C68 H58 N4 O22 -","- C272 H232 N16 O88 -","4","1","","","","New Journal of Chemistry","1999","23","9","897","903","10.1039/a904174e","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051474","8.8547","0.0009","10.1535","0.001","17.8903","0.0019","90.192","0.011","94.987","0.011","106.811","0.011","1533.2","0.3","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H8 F24 N8 -","- C20 H8 F24 N8 -","- C40 H16 F48 N16 -","2","1","","Alkorta, Ibon; Elguero, Jose; Donnadieu, Bruno; Jaffart, Joëlle; Schagen, David; Limbach, Hans-Heinrich","The structure of 3,5-bis(trifluoromethyl)pyrazole in the gas phase and in the solid state","New Journal of Chemistry","1999","23","","1231","1237","10.1039/a904292j","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","301851","2025-08-21","20:32:38",""
"7051475","29.084","0.009","14.692","0.004","11.795","0.001","90","","90","","90","","5040","3","173","","173","","","","","","","","","7","P 21 21 2","P 2 2ab","18","","","","- C114 H102 Cu2 F12 N8 O14 P2 -","- C113 H101 Cu F12 N8 O14 P2 -","- C226 H202 Cu2 F24 N16 O28 P4 -","2","0.5","","Dietrich-Buchecker Christiane; Sauvage Jean-Pierre; Hwang Neri Geum","A trefoil knot coordinated to two lithium ions : synthesis and structure","New Journal of Chemistry","1999","23","9","911","914","10.1039/a904476k","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051476","12.5569","0.001","13.0513","0.0005","16.5008","0.0005","80.481","0.005","70.949","0.005","82.328","0.005","2511.7","0.2","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C51.5 H69 N4 Nb O2 -","- C51.5 H69 N4 Nb O2 -","- C103 H138 N8 Nb2 O4 -","2","1","","","","New Journal of Chemistry","1999","23","8","815","817","10.1039/a904579a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051477","13.67","0.002","20.289","0.014","19.765","0.011","90","","92.26","0.03","90","","5477.6","4.9","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H84 N5 Nb O2 -","- C56 H84 N5 Nb O2 -","- C224 H336 N20 Nb4 O8 -","4","1","","","","New Journal of Chemistry","1999","23","8","815","817","10.1039/a904579a","","","","","","","0.0479","","","0.1165","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051478","24.826","0.002","39.023","0.003","14.233","0.004","90","0.005","90","0.008","90","0.012","13789.3","3.6","173","2","173","2","","","","","","","","7","F d d 2","F 2 -2d","43","","","","- C28.5 H34 B Cl4 Mo N8 O2 -","- C28.5 H31 B Cl4 Mo N8 O2 -","- C456 H496 B16 Cl64 Mo16 N128 O32 -","16","1","","","","New Journal of Chemistry","1999","23","9","915","921","10.1039/a904599f","","","","","","","0.0511","","","0.1031","","","","","","","","","","","has coordinates,has disorder","301442","2025-08-04","07:13:35",""
"7051479","8.3816","0.0013","12.774","0.003","13.902","0.003","108.66","0.02","93.351","0.014","91.54","0.02","1406.2","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C22.5 H29.5 B Cl Mo N9 O -","- C22.5 H29 B Cl Mo N9 O -","- C45 H58 B2 Cl2 Mo2 N18 O2 -","2","1","","","","New Journal of Chemistry","1999","23","9","915","921","10.1039/a904599f","","","","","","","0.0357","","","0.101","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051480","12.5797","0.0015","12.5797","0.0015","12.5797","0.0015","91.644","0.017","91.644","0.017","91.644","0.017","1988.2","0.4","150","2","150","2","","","","","","","","4","R -3 m :R","-P 3* 2","166","Ti3O(OPri)(O3C9H15)","","","- C30 H64 O11 Ti3 -","- C29.97 O11 Ti3 -","- C59.94 O22 Ti6 -","2","0.166667","","","","New Journal of Chemistry","1999","23","11","1079","1086","10.1039/a904760c","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051481","25.56","0.002","14.1881","0.0006","26.618","0.002","90","","108.478","0.007","90","","9155.3","1","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","Ti11O13(OPri)18","","","- C54 H126 O31 Ti11 -","- C51.03 O31 Ti11 -","- C204.12 O124 Ti44 -","4","1","","","","New Journal of Chemistry","1999","23","11","1079","1086","10.1039/a904760c","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051482","16.714","0.002","14.082","0.001","24.612","0.002","90","","100.78","0.02","90","","5690.6","1","298.2","","298.2","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C36 H76 Cu3 N28 O2 Pt3 -","- C36 H72 Cu3 N28 O2 Pt3 -","- C144 H288 Cu12 N112 O8 Pt12 -","4","1","","","","New Journal of Chemistry","1999","23","11","1049","1050","10.1039/a905080i","","","","","","","0.0485","","","0.056","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051483","7.3207","0.0001","11.0326","0.0002","23.3628","0.0004","81.49","0.001","86.265","0.001","84.381","0.001","1854.73","0.05","222","2","222","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H30 In2 Se6 -","- C36 H30 In2 Se6 -","- C72 H60 In4 Se12 -","2","1","","","","New Journal of Chemistry","1999","23","10","957","959","10.1039/a905250j","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051484","7.877","0.001","8.781","0.002","10.444","0.002","110.69","0.02","95.24","0.01","103.48","0.02","645.1","0.2","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C10 H36 Cl2 Nd2 O20 -","- C10 H12 Cl2 Nd2 O20 -","- C10 H12 Cl2 Nd2 O20 -","1","1","","","","New Journal of Chemistry","1999","23","11","1097","1103","10.1039/a905284d","","","","","","","0.0347","","","0.0978","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051485","11.057","0.002","26.977","0.005","17.087","0.003","90","","104.63","0.03","90","","4931.5","1.5","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C43 H46 Cl4 Fe N2 O10 P2 Pd Si -","- C43 H46 Cl4 Fe N2 O10 P2 Pd Si -","- C172 H184 Cl16 Fe4 N8 O40 P8 Pd4 Si4 -","4","1","","","","New Journal of Chemistry","1999","23","12","1215","1222","10.1039/a905842g","","","","","","","0.0577","","","0.1572","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051486","6.348","0.0001","9.5489","0.0001","18.2304","0.0003","90","","90","","90","","1105.06","0.03","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C9 H9 N O5 Zn -","- C9 H9 N O5 Zn -","- C36 H36 N4 O20 Zn4 -","4","1","","Hoong-Kun Fun; S.Shanmuga Sundara Raj; Ren-Gen Xiong; Jing-Lin Zuo; Xiao-Zeng You","(S-(-)-Lactate)(isonicotinato)zinc(II): Structure and Second Harmonic Generation Property if a Chiral Two-dimensional Metal-organic coordination Polymer","New Journal of Chemistry","1999","23","11","1051","1052","10.1039/a905955e","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:35",""
"7051487","11.263","0.002","6.863","0.002","14.267","0.002","90","","94.01","0.01","90","","1100.1","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H8 Br N3 O -","- C10 H8 Br N3 O -","- C40 H32 Br4 N12 O4 -","4","1","","","","New Journal of Chemistry","1999","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"7051488","7.565","0.002","14.423","0.002","19.793","0.003","90","","90","","90","","2159.6","0.7","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C11 H11 N3 O -","- C11 H11 N3 O -","- C88 H88 N24 O8 -","8","1","","","","New Journal of Chemistry","1999","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"7051489","12.72","0.002","6.954","0.001","14.783","0.003","90","","111.61","0.01","90","","1215.7","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H14 N2 O4 -","- C12 H14 N2 O4 -","- C48 H56 N8 O16 -","4","1","","","","New Journal of Chemistry","1999","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"7051490","8.302","0.001","8.516","0.002","9.333","0.002","99.5","0.02","97.06","0.02","108.21","0.02","607.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H11 N3 O3 -","- C12 H11 N3 O3 -","- C24 H22 N6 O6 -","2","1","","","","New Journal of Chemistry","1999","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"7051491","12.651","0.002","14.571","0.002","6.649","0.001","90","","90","","90","","1225.7","0.3","293","2","293","2","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C12 H11 N3 O3 -","- C12 H11 N3 O3 -","- C48 H44 N12 O12 -","4","0.5","","","","New Journal of Chemistry","1999","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"7051492","11.411","0.002","13.828","0.003","15.143","0.002","90","","98.45","0.01","90","","2363.5","0.7","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H24 N4 O8 -","- C24 H24 N4 O8 -","- C96 H96 N16 O32 -","4","1","","","","New Journal of Chemistry","1999","23","12","1261","1267","10.1039/a906111h","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"7051493","5.427","0.005","5.828","0.005","7.649","0.005","91.97","0.005","95.84","0.005","107.41","0.005","229.1","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","methanesulfonic acid hidrazide","","","- C H6 N2 O2 S -","- C H6 N2 O2 S -","- C2 H12 N4 O4 S2 -","2","1","","","Structure and Vibrational Spectroscopy of Methanesulfonic Acid Hydrazide: an Experimental and Theoretical Study","New Journal of Chemistry","1999","23","12","1253","1260","10.1039/a906264e","","","","","","","0.06","","","0.213","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"7051494","10.3","0.003","10.286","0.003","18.917","0.005","90","","99.77","0.007","90","","1975.1","1","233","2","233","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H26 B N6 Tl -","- C17 H26 B N6 Tl -","- C68 H104 B4 N24 Tl4 -","4","1","","","","New Journal of Chemistry","1999","23","10","961","963","10.1039/a906292k","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"7051495","4.5137","0.0012","7.925","0.002","8.898","0.002","90","","99.173","0.004","90","","314.24","0.14","173","2","173","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C5 H5 Cl2 N -","- C5 H5 Cl2 N -","- C10 H10 Cl4 N2 -","2","0.5","","Freytag, Matthias; Jones, Peter G.; Ahrens, Birte; Fischer, Axel","Hydrogen bonding and halogen...halogen contacts in 4-halopyridinium halides","New Journal of Chemistry","1999","23","12","1137","1139","10.1039/a906356k","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"7051496","4.4705","0.0012","8.253","0.002","9.398","0.002","90","","98.945","0.006","90","","342.49","0.16","143","2","143","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C5 H5 Br2 N -","- C5 H5 Br2 N -","- C10 H10 Br4 N2 -","2","0.5","","Freytag, Matthias; Jones, Peter G.; Ahrens, Birte; Fischer, Axel","Hydrogen bonding and halogen...halogen contacts in 4-halopyridinium halides","New Journal of Chemistry","1999","23","12","1137","1139","10.1039/a906356k","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"7051497","4.5303","0.0006","21.784","0.003","8.0761","0.0012","90","","102.729","0.004","90","","777.42","0.19","143","2","143","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H5 I2 N -","- C5 H5 I2 N -","- C20 H20 I8 N4 -","4","1","","Freytag, Matthias; Jones, Peter G.; Ahrens, Birte; Fischer, Axel","Hydrogen bonding and halogen...halogen contacts in 4-halopyridinium halides","New Journal of Chemistry","1999","23","12","1137","1139","10.1039/a906356k","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"7051498","12.263","0.002","22.3356","0.0013","22.566","0.002","90","","94.169","0.011","90","","6164.3","1.3","183","2","183","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C54 H78 F12 N4 O16 P2 -","- C54 H78 F12 N4 O16 P2 -","- C216 H312 F48 N16 O64 P8 -","4","1","","Huuskonen, Juhani; Buston, Jonathan E. H.; Scotchmer, Neil D.; Anderson, Harry L.","Water-soluble macrocyclic receptors for small neutral guests","New Journal of Chemistry","1999","23","12","1245","1252","10.1039/a906403f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210946","2020-10-21","18:00:00",""
"7051499","14.0149","0.0012","12.7542","0.0012","17.837","0.002","90","","108.711","0.008","90","","3019.8","0.5","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C54.5 H70.5 Cl1.5 N2 O17 -","- C57 H75 Cl3 N2 O18 -","- C114 H150 Cl6 N4 O36 -","2","0.5","","Huuskonen, Juhani; Buston, Jonathan E. H.; Scotchmer, Neil D.; Anderson, Harry L.","Water-soluble macrocyclic receptors for small neutral guests","New Journal of Chemistry","1999","23","12","1245","1252","10.1039/a906403f","","","","","","","","","","","","","","","","","","","","","has coordinates,has disorder","210946","2020-10-21","18:00:00",""
"7051500","12.466","0.002","11.9827","0.0018","16.456","0.002","90","","105.918","0.012","90","","2363.9","0.6","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C50 H66 N2 O12 -","- C50 H66 N2 O12 -","- C100 H132 N4 O24 -","2","0.5","","Huuskonen, Juhani; Buston, Jonathan E. H.; Scotchmer, Neil D.; Anderson, Harry L.","Water-soluble macrocyclic receptors for small neutral guests","New Journal of Chemistry","1999","23","12","1245","1252","10.1039/a906403f","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"7051501","14.43","0.02","8.36","0.01","15.9","0.1","90","","110.8","0.2","90","","1793.1","11.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H24 N8 O12 -","- C8 H24 N8 O12 -","- C32 H96 N32 O48 -","4","1","","","","New Journal of Chemistry","1999","23","10","1007","1013","10.1039/a906736a","","","","","","","0.0402","","","0.1028","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"7051502","6.0244","0.0006","12.731","0.002","15.0026","0.0013","75.052","0.008","83.802","0.006","86.817","0.009","1104.7","0.2","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H19 Cl N2 O4 -","- C28 H19 Cl N2 O4 -","- C56 H38 Cl2 N4 O8 -","2","1","","","","New Journal of Chemistry","1999","23","12","1223","1230","10.1039/a907124e","","","","","","","0.0413","","","0.1092","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:36",""
"7051503","16.121","0.003","7.1894","0.0006","13.5772","0.0017","90","","95.567","0.015","90","","1566.2","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H20 B2 Cl2 N2 -","- C13 H20 B2 Cl2 N2 -","- C52 H80 B8 Cl8 N8 -","4","1","","Anderson, Kirsty M.; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Johnathan","The Platinum Catalysed Diboration of Alkynes Using 1,2- B~2~Cl~2~(NMe~2~)~2~: Formation of 1-Azonia-2-Borata-5-Borole Derivatives","New Journal of Chemistry","1999","23","11","1053","1055","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"7051504","12.41","0.002","12.8779","0.0014","13.066","0.002","90","","90.428","0.014","90","","2088","0.5","173","2","173","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C20 H26 B2 Cl2 N2 -","- C20 H26 B2 Cl2 N2 -","- C80 H104 B8 Cl8 N8 -","4","1","","Anderson, Kirsty M.; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Johnathan","The Platinum Catalysed Diboration of Alkynes Using 1,2- B~2~Cl~2~(NMe~2~)~2~: Formation of 1-Azonia-2-Borata-5-Borole Derivatives","New Journal of Chemistry","1999","23","11","1053","1055","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:37",""
"7051505","10.87","0.003","12.404","0.002","16.086","0.003","90","","92.185","0.009","90","","2167.3","0.7","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C20 H26 B2 Cl2 N2 O2 -","- C20 H26 B2 Cl2 N2 O2 -","- C80 H104 B8 Cl8 N8 O8 -","4","1","","Anderson, Kirsty M.; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Johnathan","The Platinum Catalysed Diboration of Alkynes Using 1,2- B~2~Cl~2~(NMe~2~)~2~: Formation of 1-Azonia-2-Borata-5-Borole Derivatives","New Journal of Chemistry","1999","23","11","1053","1055","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","301851","2025-08-21","20:32:38",""
"7051506","20.496","0.009","9.775","0.004","23.894","0.013","90","","114.37","0.06","90","","4360","3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H27 B2 Cl3 N2 -","- C20 H27 B2 Cl3 N2 -","- C160 H216 B16 Cl24 N16 -","8","2","","Anderson, Kirsty M.; Lesley, M. J. Gerald; Norman, Nicholas C.; Orpen, A. Guy; Starbuck, Johnathan","The Platinum Catalysed Diboration of Alkynes Using 1,2- B~2~Cl~2~(NMe~2~)~2~: Formation of 1-Azonia-2-Borata-5-Borole Derivatives","New Journal of Chemistry","1999","23","11","1053","1055","10.1039/a907255a","","","","","","","","","","","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:37",""
"7051507","9.266","0.002","13.309","0.002","14.782","0.003","64.28","0.02","82.88","0.02","86.51","0.02","1629.6","0.6","301.2","","301.2","","","","","","","","","7","P -1","-P 1","2","","","","- C66 H52 Cd2 F12 N10 P2 S2 -","- C66 H52 Cd2 F22 N10 P2 S2 -","- C66 H52 Cd2 F22 N10 P2 S2 -","1","0.5","","","","New Journal of Chemistry","1999","23","12","1163","1169","10.1039/a907417a","","","","","","","0.057","","","0.0863","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:37",""
"7051508","9.3987","0.0009","13.184","0.001","14.058","0.002","66.133","0.008","83.369","0.008","85.087","0.008","1580.9","0.3","301.2","","301.2","","","","","","","","","7","P -1","-P 1","2","","","","- C64 H48 Cd2 F12 N10 P2 Se2 -","- C64 H48 Cd2 F26 N10 P2 Se2 -","- C64 H48 Cd2 F26 N10 P2 Se2 -","1","0.5","","","","New Journal of Chemistry","1999","23","12","1163","1169","10.1039/a907417a","","","","","","","0.0353","","","0.0503","","","","","","","","","","","has coordinates","301442","2025-08-04","07:13:37",""
"7054305","9.2506","0.0005","9.0398","0.0006","11.4008","0.0009","90","","111.656","0.005","90","","886.08","0.11","213","2","213","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H17 Cl O S2 -","- C20 H17 Cl O S2 -","- C40 H34 Cl2 O2 S4 -","2","1","","Nell, Peter G.","Generation of a highly enantioenriched α-phenylthio-substituted Grignard-reagent","New Journal of Chemistry","1999","23","10","973","","10.1039/a906179g","","","1.54178","CuKα","","0.0489","0.0486","","","0.1332","0.1336","","","","","","1.061","","","","has coordinates","301851","2025-08-21","20:32:47",""
"7110358","19.286","0.004","12.008","0.002","23.956","0.004","90","","96.26","0.02","90","","5514.8","1.7","183","2","183","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C61.5 H72 Cl2 O4 Sn2 -","- C61.5 H72 Cl2 O4 Sn2 -","- C246 H288 Cl8 O16 Sn8 -","4","1","","McBurnett, Brian G.; Cowley, Alan H.","Binuclear tin and germanium calix[4]arenes","Chemical Communications","1999","","1","17","","10.1039/a807167e","","","0.71073","MoKα","","0.1326","0.0981","","0.2666","0.2421","","","","0.993","1.12","1.12","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110359","13.201","0.002","14.188","0.002","15.212","0.002","84.63","0.01","73.46","0.01","64.98","0.01","2473.8","0.7","183","2","183","2","","","","","","","","5","P -1","-P 1","2","","","","- C47.5 H59 Cl7 Ge2 O4 -","- C47.5 H59 Cl7 Ge2 O4 -","- C95 H118 Cl14 Ge4 O8 -","2","1","","McBurnett, Brian G.; Cowley, Alan H.","Binuclear tin and germanium calix[4]arenes","Chemical Communications","1999","","1","17","","10.1039/a807167e","","","0.71073","MoKα","","0.1679","0.086","","0.2629","0.2114","","","","0.959","1.14","1.14","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110360","12.903","0.002","14.192","0.001","14.236","0.002","91.72","0.01","109.35","0.01","111.12","0.01","2261.1","0.6","163","2","163","2","","","","","","","","5","P -1","-P 1","2","","","","- C46 H56 Cl4 O4 Sn2 -","- C46 H56 Cl4 O4 Sn2 -","- C92 H112 Cl8 O8 Sn4 -","2","1","","McBurnett, Brian G.; Cowley, Alan H.","Binuclear tin and germanium calix[4]arenes","Chemical Communications","1999","","1","17","","10.1039/a807167e","","","0.71073","MoKα","","0.0466","0.0351","","0.0983","0.0908","","","","0.964","1.001","1.001","","","","","has coordinates","180217","2020-10-21","18:00:00",""
"7110361","6.0102","0.0002","15.8808","0.0003","10.7925","0.0003","90","","90","","90","","1030.11","0.05","173","2","173","2","","","","","","","B. Luo / Prof. W. Gladfelter","5","P b c m","-P 2c 2b","57","98152a","","","- C7 H14 Cl2 Ga N -","- C7 H14 Cl2 Ga N -","- C28 H56 Cl8 Ga4 N4 -","4","0.5","","Luo, Bing; Young Jr., Victor G.; Gladfelter, Wayne L.","Syntheses and structures of quinuclidine-stabilized four- and five-coordinate mono- and di-chlorogallane","Chemical Communications","1999","","2","123","","10.1039/a807169a","","","0.71073","MoKα","","0.0407","0.0338","","0.084","0.0802","","","","1.152","1.172","1.172","","","","","has coordinates","180217","2020-10-21","18:00:00",""
"7110362","10.9098","0.0002","12.0848","0.0002","12.3099","0.0003","90","","90","","90","","1622.97","0.06","173","2","173","2","","","","","","","B. Luo / Prof. W. Gladfelter","5","P b c n","-P 2n 2ab","60","98154","","","- C14 H28 Cl Ga N2 -","- C14 H28 Cl Ga N2 -","- C56 H112 Cl4 Ga4 N8 -","4","0.5","","Luo, Bing; Young Jr., Victor G.; Gladfelter, Wayne L.","Syntheses and structures of quinuclidine-stabilized four- and five-coordinate mono- and di-chlorogallane","Chemical Communications","1999","","2","123","","10.1039/a807169a","","","0.71073","MoKα","","0.04","0.0296","","0.0644","0.0606","","","","1.117","1.154","1.154","","","","","has coordinates","180217","2020-10-21","18:00:00",""
"7110363","10.2217","0.0006","12.2916","0.0007","6.462","0.0004","90","","90","","90","","811.89","0.08","173","2","173","2","","","","","","","B. Lou / Prof. W. Gladfelter","5","P m n 21","P 2ac -2","31","98215b","","","- C14 H23 Cl2 Ga N2 -","- C14 H23 Cl2 Ga N2 -","- C28 H46 Cl4 Ga2 N4 -","2","0.5","","Luo, Bing; Young Jr., Victor G.; Gladfelter, Wayne L.","Syntheses and structures of quinuclidine-stabilized four- and five-coordinate mono- and di-chlorogallane","Chemical Communications","1999","","2","123","","10.1039/a807169a","","","0.71073","MoKα","","0.0605","0.0529","","0.1491","0.1365","","","","1.099","1.111","1.111","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110365","9.507","0.003","11.641","0.002","12.732","0.004","73.418","0.009","80.316","0.016","66.294","0.007","1234.2","0.6","171","2","171","2","","","","","","","","6","P -1","-P 1","2","","","","- C42 H28 Br4 Cl6 Hg2 N8 -","- C42 H28 Br4 Cl6 Hg2 N8 -","- C42 H28 Br4 Cl6 Hg2 N8 -","1","0.5","","Pan, Long; Wang, Xiaotai; Noll, Bruce C.","Self-assembly of free-base tetrapyridylporphyrin units by metal ion coordination","Chemical Communications","1999","","2","157","","10.1039/a807242f","","","0.71073","MoKα","","0.102","0.0548","","","0.0831","0.0994","","","","","","1.032","","","","has coordinates","180217","2020-10-21","18:00:00",""
"7110367","15.004","0.003","17.795","0.004","21.662","0.004","97.81","0.03","103.21","0.03","92.16","0.03","5564","2","126","2","126","2","","","","","","","","6","P -1","-P 1","2","","","","- C62 H122.4 Cl4.5 N46.5 O44.2 Pt4 -","- C62 H105 Cl4.5 N46.5 O44.2 Pt4 -","- C124 H210 Cl9 N93 O88.4 Pt8 -","2","1","","Sigel, Roland K. O.; Thompson, Susan M.; Freisinger, Eva; Lippert, Bernhard","Combining four different model nucleobases (uracil, adenine, guanine, cytosine) via metal binding and H bond formation in a single compound","Chemical Communications","1999","","1","19","","10.1039/a807322h","","","0.71073","MoKα","","0.1062","0.067","","0.1947","0.1697","","","","1.069","1.19","1.19","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110368","8.5573","0.0008","26.064","0.003","7.595","0.0007","90","","91.967","0.009","90","","1693","0.3","299","2","299","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H24 Cu2 N12 O4 Pt2 -","- C28 H24 Cu2 N12 O4 Pt2 -","- C56 H48 Cu4 N24 O8 Pt4 -","2","0.5","","Falvello, Larry R.; Tomás, Milagros","[{Cu(bipy)(H2O)Pt(CN)4}2]·2H2O: the first synthesis and crystal structure of a discrete heterometallic square cyano-bridged compound with terminal cyano ligands","Chemical Communications","1999","","3","273","","10.1039/a807324d","","","0.71073","MoKα","","0.0545","0.0383","","","0.0933","0.1023","","","","","","1.079","","","","has coordinates","180217","2020-10-21","18:00:00",""
"7110375","13.3435","0.0008","13.5214","0.0008","20.85","0.001","103.096","0.001","91.287","0.001","111.723","0.001","3380.2","0.3","127.15","","127.15","","","","","","","","","6","P -1","-P 1","2","","","","- C70 H63 Cl9 N12 O4 Zn -","- C70 H63 Cl9 N12 O4 Zn -","- C140 H126 Cl18 N24 O8 Zn2 -","2","1","","Collman, James P.; Schwenninger, Reinhold; Rapta, Miroslav; Bröring, Martin; Fu, Lei","New 1,4,7-triazacyclononane-based functional analogues of the Fe/Cu active site of cytochrome c oxidase: structure, spectroscopy and electrocatalytic reduction of oxygen","Chemical Communications","1999","","2","137","","10.1039/a807598k","","","0.7107","MoKa","","","","","","","","","","","","","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110379","10.217","0.002","8.6426","0.001","21.054","0.003","90","","101.22","0.02","90","","1823.6","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H10 F11 N -","- C19 H10 F11 N -","- C76 H40 F44 N4 -","4","1","","Eric Banks, R.; Besheesh, Mohamed K.; Lawrence, Nicholas J.; Pritchard, Robin G.; Tovell, David J.","Novel conversion of perfluoro(2,6-dimethyl-1-azacyclohexene) to 3,3,4,4,5-pentafluoro-2,6-diphenyl-2,6-bis(trifluoromethyl)- 1-azabicyclo[3.1.0]hexane","Chemical Communications","1999","","1","47","","10.1039/a807673a","","","0.71069","MoKα","","0.0974","0.0389","","","0.0857","0.1057","","","","","","1","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110380","27.339","0.002","8.385","0.001","15.593","0.002","90","","90","","90","","3574.5","0.7","203","2","203","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C19 H11 F12 N -","- C19 H11 F12 N -","- C152 H88 F96 N8 -","8","1","","Eric Banks, R.; Besheesh, Mohamed K.; Lawrence, Nicholas J.; Pritchard, Robin G.; Tovell, David J.","Novel conversion of perfluoro(2,6-dimethyl-1-azacyclohexene) to 3,3,4,4,5-pentafluoro-2,6-diphenyl-2,6-bis(trifluoromethyl)- 1-azabicyclo[3.1.0]hexane","Chemical Communications","1999","","1","47","","10.1039/a807673a","","","0.71069","MoKα","","0.062","0.0355","","","0.0718","0.0808","","","","","","1.029","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110384","18.4451","0.0004","25.0336","0.0006","16.9564","0.0004","90","","111.794","0.001","90","","7270","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H78 Cl3 La N16 O15 -","- C64 H72 Cl3 La N16 O15 -","- C256 H288 Cl12 La4 N64 O60 -","4","1","","Wietzke, Raphaël; Mazzanti, Marinella","Strong intramolecular π‒π interactions favor the formation of 2:1 (L:M) lanthanide complexes of tris(2-benzimidazolylmethyl)amine","Chemical Communications","1999","","2","209","","10.1039/a807831i","","","0.71073","MoKα","","0.1428","0.0767","","0.2264","0.1827","","","","1.1","1.178","1.178","","","","","has coordinates","180217","2020-10-21","18:00:00",""
"7110385","18.2235","0.0007","24.8434","0.001","16.8575","0.0007","90","","111.793","0.001","90","","7086.5","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H78 Cl3 N16 Nd O15 -","- C64 H72 Cl3 N16 Nd O15 -","- C256 H288 Cl12 N64 Nd4 O60 -","4","1","","Wietzke, Raphaël; Mazzanti, Marinella","Strong intramolecular π‒π interactions favor the formation of 2:1 (L:M) lanthanide complexes of tris(2-benzimidazolylmethyl)amine","Chemical Communications","1999","","2","209","","10.1039/a807831i","","","0.71073","MoKα","","0.1278","0.0618","","0.1592","0.125","","","","1.12","1.146","1.146","","","","","has coordinates","180217","2020-10-21","18:00:00",""
"7110386","18.1861","0.0004","24.8563","0.0006","16.9481","0.0004","90","","111.929","0.001","90","","7106.9","0.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C64 H78 Cl3 Eu N16 O15 -","- C64 H72 Cl3 Eu N16 O15 -","- C256 H288 Cl12 Eu4 N64 O60 -","4","1","","Wietzke, Raphaël; Mazzanti, Marinella","Strong intramolecular π‒π interactions favor the formation of 2:1 (L:M) lanthanide complexes of tris(2-benzimidazolylmethyl)amine","Chemical Communications","1999","","2","209","","10.1039/a807831i","","","0.71073","MoKα","","0.1115","0.0481","","0.1076","0.0865","","","","1.03","1.094","1.094","","","","","has coordinates","180217","2020-10-21","18:00:00",""
"7110387","28.034","0.0001","14.8758","0.0001","27.7355","0.0003","90","","90","","90","","11566.5","0.15","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C48.5 H58 Cl3 Lu N14 O7.5 -","- C48.5 H42 Cl3 Lu N14 O7.5 -","- C388 H336 Cl24 Lu8 N112 O60 -","8","1","","Wietzke, Raphaël; Mazzanti, Marinella","Strong intramolecular π‒π interactions favor the formation of 2:1 (L:M) lanthanide complexes of tris(2-benzimidazolylmethyl)amine","Chemical Communications","1999","","2","209","","10.1039/a807831i","","","0.71073","MoKα","","0.1555","0.0867","","0.2566","0.2266","","","","1.055","1.272","1.272","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110389","14.9165","0.0005","18.8797","0.0007","19.5635","0.0004","90","","105.49","0.001","90","","5309.3","0.3","173.2","","173.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C96 H30 N4 Ni -","- C96 H30 N4 Ni -","- C384 H120 N16 Ni4 -","4","1","","Croucher, Peter D.; Marshall, Jodie M. E.; Nichols, Peter J.; Raston, Colin L.","Confinement of C70 in an extended saddle shaped nickel(II) macrocycle","Chemical Communications","1999","","2","193","","10.1039/a807990k","","","0.7107","MoKalpha","","","0.0649","","","0.0474","","","","","2.727","2.727","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110390","12.9197","0.0004","12.9197","0.0004","7.2357","0.0005","90","","90","","90","","1207.77","0.1","293","2","293","2","","","","","","","synthesis","2","I -4","I -4","82","","tetrakis(4-Ethynylphenyl)methane","","- C33 H20 -","- C33 H20 -","- C66 H40 -","2","0.25","","Galoppini, Elena; Gilardi, Richard","Weak hydrogen bonding between acetylenic groups: the formation of diamondoid nets in the crystal structure of tetrakis(4-ethynylphenyl)methane†","Chemical Communications","1999","","2","173","","10.1039/a807993e","","","1.54178","CuKα","","0.0367","0.0354","","0.0993","0.0951","","","","1.054","1.065","1.065","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110391","48.46","0.004","10.5467","0.0013","28.759","0.003","90","","121.896","0.004","90","","12479","2","293","2","293","2","","","","","","","synthesis","2","C 1 2/c 1","-C 2yc","15","","1,3,5,7-tetrakis(4-ethynylphenyl)adamantane/benzene [4:1] solvate","","- C43.5 H33.5 -","- C43.5 H33.5 -","- C696 H536 -","16","2","","Galoppini, Elena; Gilardi, Richard","Weak hydrogen bonding between acetylenic groups: the formation of diamondoid nets in the crystal structure of tetrakis(4-ethynylphenyl)methane†","Chemical Communications","1999","","2","173","","10.1039/a807993e","","","1.54178","CuKα","","0.1141","0.0574","","0.1376","0.1115","","","","1.023","1.149","1.149","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110392","8.9725","0.0003","11.312","0.0003","12.8986","0.0005","77.522","0.001","75.876","0.001","67.686","0.001","1163.35","0.07","273.2","","273.2","","","","","","","","","4","P -1","-P 1","2","","","","- C12 H39 Ga3 O9 -","- C14 H40 Ga3 O9 -","- C28 H80 Ga6 O18 -","2","1","","Croucher, Paul D.; Drljaca, Alexander; Papadopoulos, Stavroula; Raston, Colin L.","Hydrogen bonded assemblies of a cyclic trimeric hydroxy gallium(III) derivative: [{Me2Ga(μ-OH)}3·3H2O]2·18-crown-6","Chemical Communications","1999","","2","153","","10.1039/a807995a","","","0.7107","MoKα","","0.059","0.031","","0.0338","","0.031","","","1.682","","","1.87","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7110394","16.0744","0.0001","10.219","0.0002","18.9058","0.0003","90","","91.593","0.001","90","","3104.35","0.08","200","2","200","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H28 F12 N2 O8 -","- C26 H28 F12 N2 O8 -","- C104 H112 F48 N8 O32 -","4","0.5","","Kunze, Andreas; Gleiter, Rolf; Rominger, Frank","1,8-Diazabicyclo[6.6.6]eicosa-4,11,17-triyne: a flexible cage for protons, copper(I) and silver(I)","Chemical Communications","1999","","2","171","","10.1039/a808068b","","","0.71073","MoKα","","0.0638","0.0461","","0.1277","0.1119","","","","1.041","1.066","1.066","","","","","has coordinates,has disorder","301857","2025-08-21","22:47:10",""
"7110395","13.4273","0.0002","13.9115","0.0003","14.0299","0.0003","65.582","0.001","73.275","0.001","64.659","0.001","2137.02","0.08","200","2","200","2","","","","","","","","8","P -1","-P 1","2","","","","- C19.25 H24.5 Ag Cl0.5 F3 N2 O3 S -","- C19.25 H24.5 Ag Cl0.5 F3 N2 O3 S -","- C77 H98 Ag4 Cl2 F12 N8 O12 S4 -","4","2","","Kunze, Andreas; Gleiter, Rolf; Rominger, Frank","1,8-Diazabicyclo[6.6.6]eicosa-4,11,17-triyne: a flexible cage for protons, copper(I) and silver(I)","Chemical Communications","1999","","2","171","","10.1039/a808068b","","","0.71073","MoKα","","0.041","0.032","","","0.0745","0.0794","","","","","","1.02","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110396","11.7163","0.0004","7.4458","0.0003","23.4107","0.0008","90","","99.852","0.001","90","","2012.17","0.13","200","2","200","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C19 H24 Cu F3 N2 O3 S -","- C19 H24 Cu0.81 F3 N2 O3 S -","- C76 H96 Cu3.24 F12 N8 O12 S4 -","4","1","","Kunze, Andreas; Gleiter, Rolf; Rominger, Frank","1,8-Diazabicyclo[6.6.6]eicosa-4,11,17-triyne: a flexible cage for protons, copper(I) and silver(I)","Chemical Communications","1999","","2","171","","10.1039/a808068b","","","0.71073","MoKα","","0.0404","0.0285","","","0.0689","0.0734","","","","","","1.04","","","","has coordinates,has disorder","180217","2020-10-21","18:00:00",""
"7110399","9.919","0.004","12.587","0.005","11.624","0.005","90","","112.71","0.03","90","","1338.7","1","293.2","","293.2","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C15 H18 O3 -","- C15 H18 O3 -","- C60 H72 O12 -","4","1","","Arai, Shigeru; Shirai, Yoshiki; Shioiri, Takayuki; Ishida, Toshimasa","Phase-transfer catalyzed asymmetric Darzens reaction of cyclic α-chloro ketones","Chemical Communications","1999","","1","49","","10.1039/a808321e","","","1.5418","CuKα","","0.0635","0.0523","","","","0.2113","","","","","","0.933","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110400","16.446","0.003","9.796","0.002","18.16","0.004","90","","111.32","0.03","90","","2725.4","1.1","150","2","150","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H29 Cl5 N2 O2 Ti -","- C25 H29 Cl5 N2 O2 Ti -","- C100 H116 Cl20 N8 O8 Ti4 -","4","1","","Corden, Jonathan P.; Errington, William; Moore, Peter; Wallbridge, Malcolm G. H.","Stereochemical control of cis- and trans-TiCl2 groups in six-coordinate complexes [(L)TiCl2] (L2− = N2O2-donor Schiff base) and reactions with trimethylaluminium to form cationic aluminium species","Chemical Communications","1999","","4","323","","10.1039/a808372j","","","0.71073","MoKα","","0.182","0.0539","","","0.0998","0.1248","","","","","","0.597","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110401","15.7057","0.0015","9.7173","0.0009","19.5089","0.0015","90","","90","","90","","2977.4","0.5","230","2","230","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C24 H34 Al3 Cl3 N2 O2 -","- C24 H34 Al3 Cl3 N2 O2 -","- C96 H136 Al12 Cl12 N8 O8 -","4","1","","Corden, Jonathan P.; Errington, William; Moore, Peter; Wallbridge, Malcolm G. H.","Stereochemical control of cis- and trans-TiCl2 groups in six-coordinate complexes [(L)TiCl2] (L2− = N2O2-donor Schiff base) and reactions with trimethylaluminium to form cationic aluminium species","Chemical Communications","1999","","4","323","","10.1039/a808372j","","","0.71073","MoKα","","0.1187","0.0735","","","0.1607","0.1905","","","","","","1.071","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110402","9.918","0.003","12.7145","0.0009","12.2801","0.0008","90","","90.989","0.01","90","","1548.3","0.5","293","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","5-(1,2-dihydro-1,1-dimethylbenzo(cd)indolium-2-yl)- 2,2-dimethyl-4,6-dioxo-1,3-dioxane-5-ide","","- C19 H19 N O4 -","- C19 H19 N O4 -","- C76 H76 N4 O16 -","4","1","","Bell, Paul C.; Wallis, John D.","Addition of nucleophiles to electron-deficient alkenes: structural studies on the incipient reaction and the zwitterionic intermediate","Chemical Communications","1999","","3","257","","10.1039/a808488b","","","0.71069","MoKα","","0.0573","0.04","","0.095","0.0906","","","","0.892","0.999","0.999","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110403","13.606","0.01","9.042","0.005","11.073","0.01","90","","103.38","0.02","90","","1325.3","1.7","150","2","150","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","2-(8-dimethylamino)naphth-1-yl)ethene-1,1-dinitrile","","- C16 H13 N3 -","- C16 H13 N3 -","- C64 H52 N12 -","4","1","","Bell, Paul C.; Wallis, John D.","Addition of nucleophiles to electron-deficient alkenes: structural studies on the incipient reaction and the zwitterionic intermediate","Chemical Communications","1999","","3","257","","10.1039/a808488b","","","0.71069","MoKa","","0.0679","0.0502","","0.128","0.1144","","","","1.068","1.124","1.124","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110404","11.2537","0.0004","11.4933","0.0005","16.7819","0.0006","90","","93.884","0.002","90","","2165.62","0.14","150","2","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1,1-dibenzoyl-2-(8-dimethylamino)naphth-1-yl)ethene","","- C28 H23 N O2 -","- C28 H23 N O2 -","- C112 H92 N4 O8 -","4","1","","Bell, Paul C.; Wallis, John D.","Addition of nucleophiles to electron-deficient alkenes: structural studies on the incipient reaction and the zwitterionic intermediate","Chemical Communications","1999","","3","257","","10.1039/a808488b","","","0.71069","MoKa","","0.0902","0.0566","","0.1635","0.1385","","","","0.976","1.03","1.03","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110405","43.506","0.003","13.866","0.0011","24.2283","0.0016","90","","111.811","0.002","90","","13569.5","1.7","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C56 H95 F12 N3 Na2 O12 P2 -","- C56 H55 F12 N3 Na2 O12 P2 -","- C448 H440 F96 N24 Na16 O96 P16 -","8","1","","Cragg, Peter J.; Allen, Marcus C.; Steed, Jonathan W.","A ‘toothpaste tube’ model for ion transport through trans-membrane channels","Chemical Communications","1999","","6","553","","10.1039/a808492k","","","0.7107","MoKα","","0.1829","0.1095","","","0.2328","0.2683","","","","","","1.071","","","","has coordinates,has disorder","180218","2020-10-21","18:00:00",""
"7110406","7.351","0.0002","13.8734","0.0004","16.4273","0.0004","90","","90","","90","","1675.31","0.08","213","2","213","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","di(2-pyrrolyl) thioketone","","","- C9 H8 N2 S -","- C9 H8 N2 S -","- C72 H64 N16 S8 -","8","1","","Norsten, Tyler B.; McDonald, Robert; Branda, Neil R.","The self-assembly and spontaneous resolution of a hydrogen-bonded helix","Chemical Communications","1999","","8","719","","10.1039/a808638i","","","1.54178","CuKa","","0.0417","0.0391","","0.1019","0.099","","","","1.155","1.166","1.166","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110407","5.919","0.001","8.569","0.001","14.959","0.001","90","","90","","90","","758.72","0.16","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","di(2-pyrrolyl) ketone","","","- C9 H8 N2 O -","- C9 H8 N2 O -","- C36 H32 N8 O4 -","4","1","","Norsten, Tyler B.; McDonald, Robert; Branda, Neil R.","The self-assembly and spontaneous resolution of a hydrogen-bonded helix","Chemical Communications","1999","","8","719","","10.1039/a808638i","","","0.71073","MoKa","","0.1665","0.0594","","0.1249","0.0995","","","","0.894","1.067","1.067","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110408","8.4325","0.0014","13.5423","0.0012","16.555","0.002","107.588","0.008","91.823","0.011","98.651","0.011","1775.6","0.4","293","2","293","2","","","","","","","turqoise","5","P -1","-P 1","2","","","","- C38 H30 Cu N10 P2 -","- C38 H30 Cu N10 P2 -","- C76 H60 Cu2 N20 P4 -","2","1","","Taillefer, Marc; Inguimbert, Nicolas; Cristau, Henri-Jean; Jäger, Lothar; Merzweiler, Kurt","Synthesis of the sodium diphenylbis(cyanamido)phosphonium diylide by a new variation of the Staudinger reaction","Chemical Communications","1999","","6","565","","10.1039/a808641i","","","0.71073","MoKα","","0.0739","0.0479","","0.133","0.1186","","","","1.037","1.106","1.106","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110409","11.658","0.001","8.055","0.001","34.764","0.005","90","","90","","90","","3264.5","0.7","173","2","173","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C15 H10 F6 N2 O6 -","- C15 H10 F6 N2 O6 -","- C120 H80 F48 N16 O48 -","8","1","","Andrews, Mark D.; Brown, Giles A.; Charmant, Jonathan P. H.; Peakman, Torren M.; Rebello, Arlene; Walsh, Kenneth E.; Gallagher, Timothy; Hales, Neil J.","Aldehydes and ketones as dipolarophiles: application to the synthesis of oxapenams","Chemical Communications","1999","","3","249","","10.1039/a808688e","","","0.71073","MoKα","","0.0374","0.0319","","","0.074","0.0765","","","","","","1.194","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110410","9.4128","0.0012","10.937","0.003","12.306","0.002","73.97","0.02","73.132","0.012","69.426","0.01","1113.4","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H76 K2 N6 Si4 -","- C32 H76 K2 N6 Si4 -","- C32 H76 K2 N6 Si4 -","1","0.5","","Alder, Roger W.; Blake, Michael E.; Bortolotti, Christel; Bufali, Simone; Butts, Craig P.; Linehan, Emma; Oliva, Josep M.; Guy Orpen, A.; Quayle, Michael J.","Complexation of stable carbenes with alkali metals","Chemical Communications","1999","","3","241","","10.1039/a808951e","","","0.71073","MoKα","","0.0343","0.0266","","0.0762","0.0743","","","","0.988","1.077","1.077","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110411","8.434","0.01","10.467","0.003","15.389","0.004","90","","90","","90","","1358.5","1.7","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H21 B F4 N2 -","- C10 H21 B F4 N2 -","- C40 H84 B4 F16 N8 -","4","1","","Alder, Roger W.; Blake, Michael E.; Bortolotti, Christel; Bufali, Simone; Butts, Craig P.; Linehan, Emma; Oliva, Josep M.; Guy Orpen, A.; Quayle, Michael J.","Complexation of stable carbenes with alkali metals","Chemical Communications","1999","","3","241","","10.1039/a808951e","","","0.71073","mokα","","0.0664","0.0394","","0.0958","0.085","","","","0.977","1.046","1.046","","","","","has coordinates,has disorder","301857","2025-08-21","22:47:10",""
"7110412","10.911","","27.242","","19.466","","90","","90.31","","90","","5785.94","","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C66 H14 F30 N6 -","- C66 H14 F30 N6 -","- C264 H56 F120 N24 -","4","1","","Neves, Maria G. P. M. S.; Martins, Rosália M.; Tomé, Augusto C.; Silvestre, Armando J. D.; Silva, Artur M. S.; Félix, Vitor; Cavaleiro, José A. S.; Drew, Michael G. B.","meso-Substituted expanded porphyrins: new and stable hexaphyrins","Chemical Communications","1999","","4","385","","10.1039/a808952c","","","0.71073","MoKα","","0.2304","0.0785","","","0.2094","0.275","","","","","","0.862","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110413","13.3249","0.0007","18.8617","0.0009","20.9513","0.001","85.3696","0.0009","74.1679","0.001","74.333","0.0009","4877.6","0.4","193","2","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C75.5 H76 Cl4 Mn5 N30 O26.5 -","- C75 H60 Cl4 Mn5 N30 O27 -","- C150 H120 Cl8 Mn10 N60 O54 -","2","1","","Matthews, Craig J.; Xu, Zhiqiang; Mandal, Sanat K.; Thompson, Laurence K.; Biradha, Kumar; Poirier, Karen; Zaworotko, Michael J.","A novel pentamanganese(II) cluster produced by a controlled self assembly process; an exact match between the coordination algorithm of the metals and the ligand binding site arrangement","Chemical Communications","1999","","4","347","","10.1039/a808970a","","","0.71073","MoKα","","0.0987","0.0637","","0.2247","0.1473","","","","1.021","1.085","1.085","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110414","7.754","0.0011","8.8328","0.0012","12.476","0.002","78.53","0.014","89.25","0.012","81.025","0.009","827","0.2","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H23 N O4 -","- C17 H23 N O4 -","- C34 H46 N2 O8 -","2","1","","Gabbutt, Christopher D.; Hepworth, John D.; Mark Heron, B.; Elsegood, Mark R. J.; Clegg, William","An unusual ring expansion from the Zav’yalov pyrrole synthesis: formation of oxacino[2,3-c]pyrroles","Chemical Communications","1999","","3","289","","10.1039/a809033e","","","1.54184","CuKα","","0.0488","0.0471","","0.1095","0.1072","","","","1.042","1.054","1.054","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110415","29.557","0.001","9.069","0.003","12.422","0.004","90","","90","","90","","3329.7","1.5","173","","173","","","","","","","","","7","P 21 21 2","P 2 2ab","18","","","","- C60 H106 Cl6 I2 O P2 Pt -","- C60 H102 Cl6 I2 O P2 Pt -","- C120 H204 Cl12 I4 O2 P4 Pt2 -","2","0.5","","Soulivong, Daravong; Matt, Dominique; Ziessel, Raymond","The first transition metal cholesteryl-phosphine complexes","Chemical Communications","1999","","4","393","","10.1039/a809041f","","","1.54184","Cu-Kα","","0.05","0.046","","0.07","","0.066","","","1.091","","","1.029","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7110416","11.642","0.002","12.002","0.002","15.718","0.003","89.32","0.03","70.01","0.03","86.67","0.03","2060.4","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","Zr(IV)(acac)2sae","bis-(acetylacetonato)-N(2-hydroxyethyl)salicylidenimino-zirconium(IV)","","- C38 H46 N2 O12 Zr2 -","- C38 H46 N2 O12 Zr2 -","- C76 H92 N4 O24 Zr4 -","2","1","","Stulz, Eugen; Leumann, Christian","X-Ray structure and solvolytic activity towards phosphate diesters of a zirconium(IV) complex","Chemical Communications","1999","","3","239","","10.1039/a809101c","","","0.71073","MoKα","","0.0889","0.0509","","","0.1141","0.1251","","","","","","0.821","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110417","5.807","0.0007","13.393","0.002","15.477","0.003","90","","90","","90","","1203.7","0.3","173","","173","","","","","","","","?","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H20 N O2 -","- C12 H20 N O2 -","- C48 H80 N4 O8 -","4","1","","Hodgson, David M.; Robinson, Lesley A.","A new and enantioselective indolizidine synthesis by meso-epoxide α-deprotonation‒transannular N‒C insertion","Chemical Communications","1999","","4","309","","10.1039/a809105f","","","0.71069","MoKα","","","0.0638","","","0.0626","","","","","1.0016","1.0016","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7110418","9.64","0.002","11.557","0.002","12.535","0.003","100.17","0.03","105.38","0.03","113.52","0.03","1170","0.7","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H22 Cl2 O2 Pd2 Se4 -","- C15 H22 Cl2 O2 Pd2 Se4 -","- C30 H44 Cl4 O4 Pd4 Se8 -","2","1","","Oilunkaniemi, Raija; Laitinen, Risto S.; Ahlgrén, Markku","The condensation of trans-[PdCl2{(C4H3O)SeMe}2] with acetone: formation and crystal structure of [Pd2Cl2(μ-SeMe)2{MeSe(C4H2O)}2CMe2]","Chemical Communications","1999","","7","585","","10.1039/a809111k","","","0.71073","MoKα","","0.0908","0.0581","","","0.137","0.1508","","","","","","1.095","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110419","7.929","0.005","10.33","0.002","28.769","0.006","90","","90","","90","","2356.4","1.6","293","2","293","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","Chloro(cysteineethylester-N,S)triphenylphosphinepalladium(II)","","- C23 H25 Cl N O2 P Pd S -","- C23 H25 Cl N O2 P Pd S -","- C92 H100 Cl4 N4 O8 P4 Pd4 S4 -","4","1","","Real, Julio; Pagès, Montserrat; Polo, Alfons; Francesc Piniella, J.; Álvarez-Larena, Ángel","Low symmetry metal complexes: chloro cysteine ethyl ester-N,S triphenylphosphine palladium(II), a new regioselective hydrocarboxylation catalyst for 2-phenylpropanoic acid, and its crystal structure","Chemical Communications","1999","","3","277","","10.1039/a809130g","","","0.71069","MoKα","","0.0302","0.0229","","","0.0595","0.0631","","","","","","1.13","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110420","12.576","0.003","16.179","0.003","21.058","0.004","96.86","0.03","95.34","0.03","111","0.03","3928.5","1.7","203","2","200","1","","","","","","","","7","P 1","P 1","1","","","","- C156 H182 Cu4 F24 N16 O3 P4 -","- C156 H182 Cu4 F24 N16 O3 P4 -","- C156 H182 Cu4 F24 N16 O3 P4 -","1","1","","Constable, Edwin C.; Housecroft, Catherine E.; Kulke, Torsten; Baum, Gerhard; Fenske, Dieter","Chiral 1,2-ethanediyl-spaced quaterpyridines give a library of cyclic and double helicates with copper(I)","Chemical Communications","1999","","2","195","","10.1039/a809230c","","","0.71073","MoKα","","0.0655","0.0565","","0.1637","0.152","","","","1.288","1.292","1.292","","","","","has coordinates","288538","2023-12-24","00:34:32",""
"7110421","36.533","0.005","36.533","0.005","36.533","0.005","90","","90","","90","","48759","12","200","2","200","2","","","","","","","","6","I 21 3","I 2b 2c 3","199","","","","- C109.5 H116.25 Cu3 F18 N12.75 P3 -","- C219 H232.5 Cu6 F36 N25.5 P6 -","- C1752 H1860 Cu48 F288 N204 P48 -","8","0.333333","","Constable, Edwin C.; Housecroft, Catherine E.; Kulke, Torsten; Baum, Gerhard; Fenske, Dieter","Chiral 1,2-ethanediyl-spaced quaterpyridines give a library of cyclic and double helicates with copper(I)","Chemical Communications","1999","","2","195","","10.1039/a809230c","","","0.71073","MoKα","","0.2037","0.1098","","","0.2474","0.273","","","","","","1.144","","","","has coordinates,has disorder","288538","2023-12-24","00:34:33",""
"7110422","8.977","0.009","30.3","0.03","16.449","0.02","90","","95.23","0.09","90","","4456","8","213","2","213","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C37 H100 Cl P4 Si W -","- C39 H64 P4 Si W -","- C156 H256 P16 Si4 W4 -","4","1","","John, Kevin D.; Hopkins, Michael D.","Synthesis and reactions of metallo-diethynylbenzenes: building blocks for redox-active poly(phenyleneethynylene)s†","Chemical Communications","1999","","7","589","","10.1039/a809231a","","","0.71073","MoKα","","0.2602","0.1279","","0.4043","0.2812","","","","1.023","1.067","1.067","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110423","10.745","0.001","10.773","0.001","18.216","0.002","98.42","0.01","95.81","0.01","114.02","0.01","1874.8","0.4","203","","203","","","","","","","","","6","P -1","-P 1","2","","","","- C32 H35 F15 N3 O3.5 Sm -","- C32 H27 F15 N3 O3.5 Sm -","- C64 H54 F30 N6 O7 Sm2 -","2","1","","Click, Damon R.; Scott, Brian L.; Watkin, John G.","Highly electrophilic lanthanide complexes containing fluorinated amido ligands: multiple Ln···F interactions, agostic interactions and η6-arene coordination","Chemical Communications","1999","","7","633","","10.1039/a809275c","","","0.71073","MoKα","","0.048","0.0404","","0.1218","0.1165","","","","1.109","1.131","1.131","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7110424","22.964","0.004","8.712","0.002","24.927","0.004","90","","107.47","0.01","90","","4756.9","1.6","198","","198","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C50 H16 F30 N3 Nd -","- C50 H16 F30 N3 Nd -","- C200 H64 F120 N12 Nd4 -","4","1","","Click, Damon R.; Scott, Brian L.; Watkin, John G.","Highly electrophilic lanthanide complexes containing fluorinated amido ligands: multiple Ln···F interactions, agostic interactions and η6-arene coordination","Chemical Communications","1999","","7","633","","10.1039/a809275c","","","0.71073","MoKα","","0.1199","0.0577","","0.1252","0.1015","","","","1.062","1.152","1.152","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110425","10.196","0.004","10.868","0.004","16.461","0.007","94.96","0.01","107.33","0.01","95.26","0.01","1721.4","1.2","198","","198","","","","","","","","","6","P -1","-P 1","2","","","","- C27 H27 F15 N3 Si3 Sm -","- C27 H24 F15 N3 Si3 Sm -","- C54 H48 F30 N6 Si6 Sm2 -","2","1","","Click, Damon R.; Scott, Brian L.; Watkin, John G.","Highly electrophilic lanthanide complexes containing fluorinated amido ligands: multiple Ln···F interactions, agostic interactions and η6-arene coordination","Chemical Communications","1999","","7","633","","10.1039/a809275c","","","0.71073","MoKα","","0.0812","0.0564","","0.1528","0.1359","","","","1.067","1.095","1.095","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110426","11.0509","0.0004","14.1655","0.0007","11.7913","0.0005","90","","95.826","0.003","90","","1836.29","0.14","150","0.1","150","0.1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H22 B Cl Fe Sn -","- C19 H22 B Cl Fe Sn -","- C76 H88 B4 Cl4 Fe4 Sn4 -","4","1","","Jäkle, Frieder; Lough, Alan J.; Manners, Ian","Selective synthesis of 1-stanna-2-boraferrocenes: novel bidentate Lewis acids via an unexpected rearrangement reaction","Chemical Communications","1999","","5","453","","10.1039/a809276a","","","0.71073","MoKα","","0.0383","0.0307","","","0.0786","0.0825","","","","","","1.067","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110427","8.1147","0.001","10.897","0.002","11.4273","0.001","74.94","0.009","88.665","0.01","81.84","0.01","965.8","0.2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H36 In P -","- C18 H36 In P -","- C36 H72 In2 P2 -","2","1","","Hibbs, David E.; Jones, Cameron; Smithies, Neil A.","A remarkably stable indium trihydride complex: synthesis and characterisation of [InH3{P(C6H11)3}]","Chemical Communications","1999","","2","185","","10.1039/a809279f","","","0.71073","MoKα","","0.0229","0.0199","","","0.0513","0.0559","","","","","","1.06","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110428","10.397","0.001","11.109","0.001","13.696","0.002","80.65","0.01","69.11","0.01","69.66","0.01","1384.4","0.3","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C60 H40 Ag2 B2 F8 N10 -","- C60 H40 Ag2 B2 F8 N10 -","- C60 H40 Ag2 B2 F8 N10 -","1","0.5","","Carlucci, Lucia; Ciani, Gianfranco; Proserpio, Davide M.","A new type of supramolecular entanglement in the silver(I) coordination polymer [Ag2(bpethy)5](BF4)2 [bpethy = 1,2-bis(4-pyridyl)ethyne]","Chemical Communications","1999","","5","449","","10.1039/a809361j","","","0.71073","MoKα","","0.0656","0.0373","","0.1042","0.0978","","","","0.902","","","","","","","has coordinates,has disorder","180218","2020-10-21","18:00:00",""
"7110429","16.1867","0.0003","12.1515","0.0002","26.4092","0.0004","90","","105.827","0.002","90","","4997.57","0.15","160","2","160","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C104 H148.66 K2 O16.66 -","- C103.642 H143.644 K2 O16.624 -","- C207.284 H287.288 K4 O33.248 -","2","0.5","","Clague, Nicholas P.; Crane, Jonathan D.; Sinn, Ekkehard; Young, Nigel A.; Clegg, William; Clegg, William; Coles, Simon J.; Teat, Simon J.; Moreton, David J.","An insight into ion-transport by calixarenes; the structure of the dipotassium complex of p-tert-butylcalix[8]arene crystallised from a protogenic, coordinating solvent [ethanol/diethylcarbonate (10:1)]","Chemical Communications","1999","","4","379","","10.1039/a809401b","","","0.6879","Synchrotron","","0.1014","0.0802","","","0.2475","0.2642","","","","","","1.06","","","","has coordinates,has disorder","180218","2020-10-21","18:00:00",""
"7110430","11.565","0.003","11.827","0.003","10.206","0.002","95.45","0.02","100.68","0.02","60.12","0.02","1189.4","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","11,11,12,12,13,13-Hexafluoro-5,15-dimethyl-3,7-diphenyl-4,6-dithia-tetracyclo[7.5.1.0^5,15^.0^10,14^]pentadeca-1(14),2,7,9(10)-tetraene","","- C27 H18 F6 S2 -","- C27 H18 F6 S2 -","- C54 H36 F12 S4 -","2","1","","Irie, Masahiro; Lifka, Thorsten; Uchida, Kingo; Kobatake, Seiya; Shindo, Yuriko","Fatigue resistant properties of photochromic dithienylethenes: by-product formation","Chemical Communications","1999","","8","747","","10.1039/a809410a","","","1.54184","CuKα","","0.0947","0.053","","0.1647","0.1356","","","","1.034","1.078","1.078","","","","","has coordinates,has disorder","301857","2025-08-21","22:47:10",""
"7110431","7.8793","0.0001","8.1955","0.0001","22.0906","0.0004","90","","90","","90","","1426.5","0.04","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H17 N O5 S -","- C13 H17 N O5 S -","- C52 H68 N4 O20 S4 -","4","1","","Scott Oakes, R.; Clifford, Anthony A.; Bartle, Keith D.; Pett, Mark Thornton; Rayner, Christopher M.","Sulfur oxidation in supercritical carbon dioxide: dramatic pressure dependant enhancement of diastereoselectivity for sulfoxidation of cysteine derivatives","Chemical Communications","1999","","3","247","","10.1039/a809434i","","","0.71073","MoKα","","0.0258","0.0256","","","0.0706","0.0707","","","","","","1.074","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110432","10.243","0.001","11.376","0.001","16.419","0.002","78.67","0.01","79.45","0.01","84.85","0.01","1841.3","0.3","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C38 H35 B F15 N Si Ti -","- C38 H35 B F15 N Si Ti -","- C76 H70 B2 F30 N2 Si2 Ti2 -","2","1","","Cowley, Alan H.; Hair, Gregory S.; McBurnett, Brian G.; Jones, Richard A.","Novel zwitterionic complexes of Ti(IV) via reaction of Lewis acids M(C6F5)3 (M = B, Al) with a titanium diene complex (η5-C5Me4SiMe2NtBu)Ti(1,3-pentadiene)","Chemical Communications","1999","","5","437","","10.1039/a809438a","","","0.71073","MoKα","","0.0509","0.041","","0.117","0.1092","","","","1.057","1.085","1.085","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110433","10.879","0.003","38.665","0.006","11.069","0.002","90","","107.19","0.02","90","","4448","1.7","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C45 H43 Al F15 N Si Ti -","- C45 H43 Al F15 N Si Ti -","- C180 H172 Al4 F60 N4 Si4 Ti4 -","4","1","","Cowley, Alan H.; Hair, Gregory S.; McBurnett, Brian G.; Jones, Richard A.","Novel zwitterionic complexes of Ti(IV) via reaction of Lewis acids M(C6F5)3 (M = B, Al) with a titanium diene complex (η5-C5Me4SiMe2NtBu)Ti(1,3-pentadiene)","Chemical Communications","1999","","5","437","","10.1039/a809438a","","","0.71073","MoKα","","0.1004","0.0536","","0.1365","0.1116","","","","1.046","1.092","1.092","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110434","10.309","0.003","16.206","0.017","19.207","0.005","90","","100.02","0.02","90","","3160","4","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","compound 2a","","","- C29 H51 B Co N6 -","- C29 H51 B Co N6 -","- C116 H204 B4 Co4 N24 -","4","1","","Shirasawa, Nobuhiko; Akita, Munetaka; Hikichi, Shiro; Moro-oka, Yoshihiko","Thermally stable coordinatively unsaturated alkyl complexes resistant to β-hydride elimination: TpiPrM‒CH2CH3 (M = Co, Fe)","Chemical Communications","1999","","5","417","","10.1039/a809441a","","","0.7107","MoK?Ga","","0.0962","0.0825","","0.2235","0.2003","","","","1.662","1.793","1.793","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110435","9.968","0.005","15.82","0.002","21.57","0.002","90","","97.02","0.02","90","","3376","1.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","compound 3c","","","- C31 H51 B N6 Ni O2 -","- C31 H30 B N6 Ni O2 -","- C124 H120 B4 N24 Ni4 O8 -","4","1","","Shirasawa, Nobuhiko; Akita, Munetaka; Hikichi, Shiro; Moro-oka, Yoshihiko","Thermally stable coordinatively unsaturated alkyl complexes resistant to β-hydride elimination: TpiPrM‒CH2CH3 (M = Co, Fe)","Chemical Communications","1999","","5","417","","10.1039/a809441a","","","0.7107","MoK?Ga","","0.0881","0.0844","","0.2375","0.2337","","","","1.99","2.025","2.025","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110436","7.7242","0.0008","9.7417","0.0008","4.9584","0.0007","103.837","0.009","98.12","0.01","93.227","0.008","357.07","0.07","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C12 H12 Cu N2 O6 S2 -","- C12 H12 Cu0.5 N2 O6 S2 -","- C12 H12 Cu0.5 N2 O6 S2 -","1","0.5","","Kimura, Kentaro; Kimura, Takahiro; Kinoshita, Isamu; Nakashima, Nobuaki; Kitano, Ken’ichi; Nishioka, Takanori; Isobe, Kiyoshi","Aerobic oxidation of a disulfide to its sulfonate leading to supramolecular pyridine-2-sulfonato Cu(II) and Zn(II) complexes","Chemical Communications","1999","","6","497","","10.1039/a809513b","","","0.7107","MoK_a","","","0.0328","","","0.0513","","","","","1.698","1.698","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110437","19.058","0.001","7.381","0.001","14.321","0.001","90","","126.176","0.004","90","","1626.1","0.3","296.2","","296.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H16 N2 O8 S2 Zn -","- C12 H16 N2 O8 S2 Zn0.5 -","- C48 H64 N8 O32 S8 Zn2 -","4","0.5","","Kimura, Kentaro; Kimura, Takahiro; Kinoshita, Isamu; Nakashima, Nobuaki; Kitano, Ken’ichi; Nishioka, Takanori; Isobe, Kiyoshi","Aerobic oxidation of a disulfide to its sulfonate leading to supramolecular pyridine-2-sulfonato Cu(II) and Zn(II) complexes","Chemical Communications","1999","","6","497","","10.1039/a809513b","","","0.7107","MoK_a","","","0.0269","","","0.0377","","","","","1.343","1.343","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110438","8.6306","0.0007","10.61","0.002","15.119","0.004","90","","90","","90","","1384.5","0.5","293","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6-Phenyl-8,8-dimethyl-10-aza-11-oxa-tricyclo[7.2.1.0]dodeca- 2,4,6,9tetraene","","- C18 H17 N O -","- C18 H17 N O -","- C72 H68 N4 O4 -","4","1","","Barnes, John C.; Horspool, William M.; Hynd, George","A new synthetic path to peri-naphthisoxazoles by oxidative intramolecular cyclization of some β,γ-unsaturated oximes","Chemical Communications","1999","","5","425","","10.1039/a809610d","","","0.71069","MoKα","","0.0387","0.0321","","","0.0686","0.07","","","","","","0.891","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110439","11.102","0.004","12.907","0.006","8.906","0.003","107.63","0.03","100.47","0.03","96.34","0.04","1177.2","0.9","123","","123","","","","","","","","","7","P -1","-P 1","2","","","","- C24 H72 K2 Mg2 N4 O2 Si8 -","- C24 H72 K2 Mg2 N4 O2 Si8 -","- C24 H72 K2 Mg2 N4 O2 Si8 -","1","0.5","","Kennedy, Alan R.; Mulvey, Robert E.; Roberts, Brett A.; Rowlings, René B.; Raston, Colin L.","‘Inverse crown ether’ complexes: extension to potassium through the synthesis of [{[(Me3Si)2N]4K2Mg2(O2)}∞ ], a peroxo-centred macrocycle linked into infinite chains by intermolecular K⋯CH3(SiMe2) interactions","Chemical Communications","1999","","4","353","","10.1039/a809681c","","","0.71069","MoKalpha","","0.0243","0.0229","","0.041","0.0404","","","","","1.558","1.558","","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110440","3.818","0.001","3.818","0.001","22.952","0.005","90","","90","","90","","334.57","0.14","293","2","293","2","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- O5 S2 Sm2 Ti2 -","- O5 S2 Sm2 Ti2 -","- O10 S4 Sm4 Ti4 -","2","0.0625","","Goga, M.; Seshadri, R.; Ksenofontov, V.; Gütlich, P.; Tremel, W.","Ln2Ti2S2O5 (Ln = Nd, Pr, Sm): a novel series of defective Ruddlesden‒Popper phases","Chemical Communications","1999","","11","979","","10.1039/a809737b","","","0.71073","MoKα","","0.0145","0.0142","","0.035","0.0349","","","","1.183","1.19","1.19","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110441","3.849","0.001","3.849","0.001","23.064","0.005","90","","90","","90","","341.69","0.15","293","2","293","2","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- Nd2 O5 S2 Ti2 -","- Nd2 O5 S2 Ti2 -","- Nd4 O10 S4 Ti4 -","2","0.0625","","Goga, M.; Seshadri, R.; Ksenofontov, V.; Gütlich, P.; Tremel, W.","Ln2Ti2S2O5 (Ln = Nd, Pr, Sm): a novel series of defective Ruddlesden‒Popper phases","Chemical Communications","1999","","11","979","","10.1039/a809737b","","","0.71073","MoKα","","0.0168","0.0168","","0.0415","0.0415","","","","1.235","1.235","1.235","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110442","3.871","0.001","3.871","0.001","23.036","0.005","90","","90","","90","","345.19","0.15","293","2","293","2","","","","","","","","4","I 4/m m m","-I 4 2","139","","","","- O5 Pr2 S2 Ti2 -","- O5 Pr2 S2 Ti2 -","- O10 Pr4 S4 Ti4 -","2","0.0625","","Goga, M.; Seshadri, R.; Ksenofontov, V.; Gütlich, P.; Tremel, W.","Ln2Ti2S2O5 (Ln = Nd, Pr, Sm): a novel series of defective Ruddlesden‒Popper phases","Chemical Communications","1999","","11","979","","10.1039/a809737b","","","0.71073","MoKα","","0.0307","0.0291","","0.0696","0.0686","","","","1.195","1.208","1.208","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110443","16.41","0.002","23.353","0.003","20.352","0.002","90","","91.593","0.008","90","","7796.3","1.6","173","2","173","2","","","","","","","","9","P 1 21/n 1","-P 2yn","14","","","","- C76 H64 Au4 Cl4 F6 O6 P4 S2 Se -","- C76 H64 Au4 Cl4 F6 O6 P4 S2 Se -","- C304 H256 Au16 Cl16 F24 O24 P16 S8 Se4 -","4","1","","Canales, Silvia; Crespo, Olga; Concepción Gimeno, M.; Laguna, Antonio; Jones, Peter G.","Synthesis of the first gold complex with a central μ4-selenido ligand","Chemical Communications","1999","","8","679","","10.1039/a809739i","","","0.71073","MoKα","","0.1093","0.0386","","","0.0451","0.0536","","","","","","0.743","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110444","32.4214","0.001","32.4214","0.001","73.249","0.003","90","","90","","120","","66680","4","183","2","183","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C60 H872 Mo132 N42 Na30 O814 -","- C30 Mo132 O694 -","- C90 Mo396 O2082 -","3","0.166667","","Müller, Achim; Fedin, Vladimir P.; Kuhlmann, Christoph; Bögge, Hartmut; Schmidtmann, Marc","A hydrogen-bonded cluster with ‘onion-type’ structure, encapsulated and induced by a spherical cluster shell: [(H2O)n⊂ MoVI72MoV60O372(HCO2)30(H2O)72]42−","Chemical Communications","1999","","10","927","","10.1039/a809856e","","","0.71073","MoKα","","0.172","0.0784","","0.3061","0.2237","","","","0.992","1.132","1.132","","","","","has coordinates","190298","2020-10-21","18:00:00",""
"7110445","17.044","0.003","16.976","0.003","19.725","0.004","90","","97.75","0.03","90","","5655.1","1.9","110","","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C26 H28 F6 N2 O4 Pd2 -","- C26 H28 F6 N2 O4 Pd2 -","- C208 H224 F48 N16 O32 Pd16 -","8","2","","Ohff, Manuela; Ohff, Andreas; Milstein, David","Highly active PdII cyclometallated imine catalysts for the Heck reaction","Chemical Communications","1999","","4","357","","10.1039/a809883b","","","0.71073","MoKα","","0.1113","0.0618","","0.1464","0.1068","","","","1.107","1.097","1.097","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110446","16.4575","0.0003","17.8346","0.0002","19.379","0.0003","77.521","0.001","89.245","0.001","86.432","0.001","5542.84","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C168 H160 Cl16 Fe8 N24 O73.5 -","- C84 H80 Cl8 Fe4 N12 O36.75 -","- C168 H160 Cl16 Fe8 N24 O73.5 -","2","1","","Trukhan, Vladimir M.; Shteinman, Albert A.; Pierpont, Cortlandt G.; Jensen, Kenneth B.; Nordlander, Ebbe","Synthesis and characterization of iron(III) complexes of a new ligand containing a potentially bridging carboxylate; structural characterization of a helical tetranuclear iron complex","Chemical Communications","1999","","13","1193","","10.1039/a809888c","","","0.71073","MoKα","","0.4759","0.0973","","0.3538","0.2047","","","","0.854","1.327","1.327","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110447","10.203","0.005","16.674","0.008","11.902","0.006","90","0.03","101.19","0.02","90","0.03","1986.3","1.7","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 Co2 Ni O6 -","- C20 H14 Co3 O6 -","- C80 H56 Co12 O24 -","4","1","","Wadepohl, Hubert; Gebert, Stefan; Merkel, Rüdiger; Pritzkow, Hans","Synthesis and X-ray structure of a cluster complex with facial coordination of cyclooctatetraene to a Co2Ni triangle","Chemical Communications","1999","","4","389","","10.1039/a900002j","","","0.7107","MoKα","","0.0885","0.0401","","0.0942","0.079","","","","1.035","1.101","1.101","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110448","6.335","0.002","12.139","0.003","17.103","0.004","78.55","0.02","79.9","0.03","74.84","0.03","1233.6","0.6","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H35 Al N2 Si2 -","- C23 H35 Al N2 Si2 -","- C46 H70 Al2 N4 Si4 -","2","1","","Coslédan, Frédéric; Hitchcock, Peter B.; Lappert, Michael F.","Synthesis and structures of neutral and cationic β-diketiminatoaluminium methyls†","Chemical Communications","1999","","8","705","","10.1039/a900003h","","","0.71073","MoKα","","0.1143","0.0787","","0.2354","0.1955","","","","1.043","1.043","1.043","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110449","12.016","0.003","13.439","0.005","16.409","0.007","99.44","0.03","91.8","0.03","108.31","0.02","2471.8","1.6","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C47 H48 Al B F15 N2 O1.5 Si2 -","- C47 H48 Al B F15 N2 O1.5 Si2 -","- C94 H96 Al2 B2 F30 N4 O3 Si4 -","2","1","","Coslédan, Frédéric; Hitchcock, Peter B.; Lappert, Michael F.","Synthesis and structures of neutral and cationic β-diketiminatoaluminium methyls†","Chemical Communications","1999","","8","705","","10.1039/a900003h","","","0.71073","MoKα","","0.0942","0.0526","","0.2013","0.1458","","","","0.833","0.748","0.748","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110450","13.503","0.005","14.557","0.011","15.403","0.007","69.39","0.05","88.02","0.03","74.04","0.05","2718","3","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C52 H47 Al B F20 N2 O1.5 Si2 -","- C52 H42 Al B F20 N2 O1.5 Si2 -","- C104 H84 Al2 B2 F40 N4 O3 Si4 -","2","1","","Coslédan, Frédéric; Hitchcock, Peter B.; Lappert, Michael F.","Synthesis and structures of neutral and cationic β-diketiminatoaluminium methyls†","Chemical Communications","1999","","8","705","","10.1039/a900003h","","","0.71073","MoKα","","0.1159","0.0673","","0.2142","0.1693","","","","1.027","1.032","1.032","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110451","9.861","0.001","15.219","0.002","10.715","0.001","90","","110.95","0.01","90","","1501.7","0.3","123","","123","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H20 P2 S -","- C14 H20 P2 S -","- C56 H80 P8 S4 -","4","1","","Rosa, Patrick; Ricard, Louis; Mathey, François; Floch, Pascal Le","Synthesis of functional 1,4-diphosphaindenes and their related anions","Chemical Communications","1999","","6","537","","10.1039/a900086k","","","0.71073","Mo-Kα","","0.048","0.033","","0.056","","0.053","","","1.173","","","1.097","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110452","22.617","0.005","10.047","0.002","7.594","0.002","90","","90","","90","","1725.6","0.7","160","2","160","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C18 H24 Li2 N2 O -","- C18 H24 Li2 N2 O -","- C72 H96 Li8 N8 O4 -","4","0.5","","Clegg, William; Liddle, Stephen T.; Mulvey, Robert E.; Robertson, Alan","Dis-assembling lithium amide ladder structures: new insight through the structure of [{[PhCH2N(H)Li]2·thf}∞ ], a polymer of (NLi)2 planar rings connected by thf-bridged (NLi)2 butterfly junctions","Chemical Communications","1999","","6","511","","10.1039/a900392d","","","1.54184","CuKα","","0.0729","0.0509","","","0.1291","0.1469","","","","","","1.05","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110453","19.174","0.004","18.548","0.004","23.132","0.005","90","","103.31","0.03","90","","8006","3","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C36 H63 Na O6 S2 U -","- C36 H55 Na O6 S2 U -","- C288 H440 Na8 O48 S16 U8 -","8","2","","Ventelon, Lionel; Lescop, Christophe; Arliguie, Thérèse; Ephritikhine, Michel; Leverd, Pascal C.; Lance, Monique; Nierlich, Martine","Synthesis and X-ray crystal structure of [Na(18-crown-6)][U(Cp*)2(SBut)(S)], the first f-element compound containing a metal‒sulfur double bond","Chemical Communications","1999","","7","659","","10.1039/a900466a","","","0.71073","MoKα","","0.0594","0.0334","","0.0748","0.0641","","","","0.97","1.071","1.071","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110454","10.371","0.002","19.518","0.003","35.646","0.002","90","","90","","90","","7215.5","1.8","150","2","150","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C53 H39 Cr N O13 S32 -","- C53 H36 Cr N O13 S32 -","- C212 H144 Cr4 N4 O52 S128 -","4","0.5","","Martin, Lee; Turner, Scott S.; Day, Peter; Abdul Malik, K. M.; Coles, Simon J.; Hursthouse, Michael B.","Polymorphism based on molecular stereoisomerism in tris(oxalato) Cr(III) salts of bedt-ttf [bis(ethylenedithio)tetrathiafulvalene]","Chemical Communications","1999","","6","513","","10.1039/a900482c","","","0.71069","MoKα","","0.1764","0.0655","","0.1243","0.1033","","","","0.731","1.041","1.041","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110455","10.278","0.003","20.13","0.004","35.078","0.015","90","","93.04","0.009","90","","7247","4","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C53 H37 Cr N O13 S32 -","- C53 H37 Cr N O13 S32 -","- C212 H148 Cr4 N4 O52 S128 -","4","0.5","","Martin, Lee; Turner, Scott S.; Day, Peter; Abdul Malik, K. M.; Coles, Simon J.; Hursthouse, Michael B.","Polymorphism based on molecular stereoisomerism in tris(oxalato) Cr(III) salts of bedt-ttf [bis(ethylenedithio)tetrathiafulvalene]","Chemical Communications","1999","","6","513","","10.1039/a900482c","","","0.71069","MoKα","","0.1126","0.0622","","0.1149","0.0945","","","","0.841","1.055","1.055","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110456","8.059","0.002","21.76","0.004","21.431","0.002","90","","98.5","0.01","90","","3716.9","1.2","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C33 H41 B2 Cu2 F8 N7 O4 -","- C33 H41 B2 Cu2 F8 N7 O4 -","- C132 H164 B8 Cu8 F32 N28 O16 -","4","1","","Kruger, Paul E.; Launay, Frederic; McKee, Vickie","Controlled synthesis of heterotetranuclear complexes","Chemical Communications","1999","","7","639","","10.1039/a900500e","","","0.71073","MoKα","","0.1276","0.0591","","","0.1223","0.1497","","","","","","1.012","","","","has coordinates,has disorder","288183","2023-12-08","14:43:00",""
"7110457","8.446","0.001","25.567","0.003","9.034","0.001","90","","96.23","0.01","90","","1939.3","0.4","153","2","153","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H38 B2 Cu4 F8 N8 O4 -","- C34 H38 B2 Cu4 F8 N8 O4 -","- C68 H76 B4 Cu8 F16 N16 O8 -","2","0.5","","Kruger, Paul E.; Launay, Frederic; McKee, Vickie","Controlled synthesis of heterotetranuclear complexes","Chemical Communications","1999","","7","639","","10.1039/a900500e","","","0.71073","MoKα","","0.1465","0.0665","","","0.1093","0.1329","","","","","","1.037","","","","has coordinates,has disorder","301857","2025-08-21","22:47:10",""
"7110458","6.362","0.006","18.813","0.013","12.552","0.004","90","","91.64","0.06","90","","1501.7","1.8","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C6 H22 Ag2 N4 O9 S -","- C6 H22 Ag2 N4 O9 S -","- C24 H88 Ag8 N16 O36 S4 -","4","1","","Tong, Ming-Liang; Zheng, Shao-Liang; Chen, Xiao-Ming","Two- and three-dimensional non-interpenetrating open-networks self- assembled by μ4-hexamethylenetetramine (hmt). Syntheses and structures of [Ag2(μ4-hmt)(SO4)(H2O)]·4H2O and [Ag2(μ4-hmt)(μ-O2CMe)]MeCO2·4.5H2O","Chemical Communications","1999","","6","561","","10.1039/a900508k","","","0.71073","MoKα","","0.0266","0.0259","","","0.0658","0.0662","","","","","","1.071","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110459","22.7015","0.0003","12.12","0.0002","12.9889","0.0002","90","","90","","90","","3573.79","0.09","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C10 H27 Ag2 N4 O8.5 -","- C10 H24 Ag2 N4 O8.5 -","- C80 H192 Ag16 N32 O68 -","8","1","","Tong, Ming-Liang; Zheng, Shao-Liang; Chen, Xiao-Ming","Two- and three-dimensional non-interpenetrating open-networks self- assembled by μ4-hexamethylenetetramine (hmt). Syntheses and structures of [Ag2(μ4-hmt)(SO4)(H2O)]·4H2O and [Ag2(μ4-hmt)(μ-O2CMe)]MeCO2·4.5H2O","Chemical Communications","1999","","6","561","","10.1039/a900508k","","","0.71073","MoKα","","0.0617","0.0487","","","0.1251","0.1335","","","","","","1.076","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110460","14.814","0.003","14.814","0.003","15.712","0.005","90","","90","","90","","3448.1","1.5","291.2","","291.2","","","","","","","","","7","I -4 2 d","I -4 2bw","122","","","","- C20 H20 Cu6 I4 Mo N4 S4 -","- C80 Cu90 I6 Mo1.25 N16 S80 -","- C320 Cu360 I24 Mo5 N64 S320 -","4","0.25","","Hou, Hongwei; Fan, Yaoting; Du, Chenxia; Zhu, Yu; Wang, Wenling; Xin, Xinquan; Low, Michael K. M.; Ji, Wei; Ang, How Ghee","Strong optical limiting (OL) capability of the two-dimensional network cluster polymer [MoS4Cu6I4(py)4]n","Chemical Communications","1999","","7","647","","10.1039/a900518h","","","0.7107","MoKα","","0.0604","0.0428","","0.047","0.0416","","","","1.077","1.037","1.037","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110461","14.923","0.001","16.31","0.001","17.626","0.001","82.07","0.001","71.52","0.001","80.38","0.001","3995","0.4","153.2","","153.2","","","","","","","","","6","P -1","-P 1","2","","","","- C78 H84 Cl12 N8 Ni O -","- C78.018 H84 Cl12 N8 Ni O -","- C156.036 H168 Cl24 N16 Ni2 O2 -","2","1","","Nie, Hanlin; Stern, Charlotte L.; Hoffman, Brian M.; Barrett, Anthony G. M.","Decapitation of dihydroporphyrazinediol derivatives: synthesis and X-ray structure of a novel seco-porphyrazine","Chemical Communications","1999","","8","703","","10.1039/a900555b","","","0.7107","MoKα","","0.1555","0.099","","0.199","","0.098","","","3.588","","","4.67","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110462","6.1219","0.0011","5.2029","0.001","10.244","0.003","90","","90","","90","","326.29","0.13","293","2","293","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- C3 H6 O -","- C3 H6 O -","- C12 H24 O4 -","4","0.25","","Allan, David R.; Clark, Stewart J.; Ibberson, Richard M.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay","The influence of pressure and temperature on the crystal structure of acetone","Chemical Communications","1999","","8","751","","10.1039/a900558g","","","0.71073","MoKα","","0.167","0.056","","","0.0805","0.0982","","","","","","0.907","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"7110463","6.514","0.004","5.4159","0.0018","10.756","0.005","90","","90","","90","","379.5","0.3","160","2","160","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- C3 H6 O -","- C3 H6 O -","- C12 H24 O4 -","4","0.25","","Allan, David R.; Clark, Stewart J.; Ibberson, Richard M.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay","The influence of pressure and temperature on the crystal structure of acetone","Chemical Communications","1999","","8","751","","10.1039/a900558g","","","0.71073","MoKα","","0.0755","0.0516","","","0.1469","0.1667","","","","","","1.111","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110464","8.873","0.003","8","0.004","22.027","0.007","90","","90","","90","","1563.6","1.1","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C3 H6 O -","- C3 H6 O -","- C48 H96 O16 -","16","2","","Allan, David R.; Clark, Stewart J.; Ibberson, Richard M.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay","The influence of pressure and temperature on the crystal structure of acetone","Chemical Communications","1999","","8","751","","10.1039/a900558g","","","0.71073","MoKα","","0.1396","0.0528","","","0.1039","0.1351","","","","","","0.928","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110465","9.1669","0.0001","7.5323","0.0001","21.2486","0.0001","90","","90","","90","","1467.17","0.03","5","","5","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","Acetone-d6","","- C3 D6 O -","- C3 D6 O -","- C48 D96 O16 -","16","2","","Allan, David R.; Clark, Stewart J.; Ibberson, Richard M.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay","The influence of pressure and temperature on the crystal structure of acetone","Chemical Communications","1999","","8","751","","10.1039/a900558g","","neutron","","Neutron","","","","","","","","","","","","","","","","","has coordinates","297501","2025-01-28","14:00:45",""
"7110466","9.172","0.008","7.761","0.008","21.66","0.02","90","","90","","90","","1542","3","110","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C3 H6 O -","- C3 H6 O -","- C48 H96 O16 -","16","2","","Allan, David R.; Clark, Stewart J.; Ibberson, Richard M.; Parsons, Simon; Pulham, Colin R.; Sawyer, Lindsay","The influence of pressure and temperature on the crystal structure of acetone","Chemical Communications","1999","","8","751","","10.1039/a900558g","","","0.71073","MoKα","","0.1416","0.0585","","","0.1012","0.1274","","","","","","0.968","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110467","11.622","0.003","21.83","0.008","8.389","0.004","90","","107.01","0.03","90","","2035.3","1.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H28 N P Zr -","- C23 H28 N P Zr -","- C92 H112 N4 P4 Zr4 -","4","1","","Cloke, F. Geoffrey N.; Hitchcock, Peter B.; Nixon, John F.; James Wilson, D.; Mountford, Philip","One- and two-step [2 + 2] cycloaddition reactions of group 4 imides with the phosphaalkyne ButCP. Crystal and molecular structures of [Zr(η5-C5H5)2(PCButNC6H3Me2-2,6)] and [TiCl2(P2C2But2NBut)(py)] (py) = pyridine)","Chemical Communications","1999","","7","661","","10.1039/a900648f","","","0.71073","MoKα","","0.0746","0.0476","","0.1375","0.1141","","","","0.834","0.817","0.817","","","","","has coordinates,has disorder","301857","2025-08-21","22:47:10",""
"7110468","12.728","0.002","12.17","0.001","15.596","0.001","90","","97.5","0.01","90","","2395.1","0.5","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H32 Cl2 N2 P2 Ti -","- C19 H32 Cl2 N2 P2 Ti -","- C76 H128 Cl8 N8 P8 Ti4 -","4","1","","Cloke, F. Geoffrey N.; Hitchcock, Peter B.; Nixon, John F.; James Wilson, D.; Mountford, Philip","One- and two-step [2 + 2] cycloaddition reactions of group 4 imides with the phosphaalkyne ButCP. Crystal and molecular structures of [Zr(η5-C5H5)2(PCButNC6H3Me2-2,6)] and [TiCl2(P2C2But2NBut)(py)] (py) = pyridine)","Chemical Communications","1999","","7","661","","10.1039/a900648f","","","0.71073","MoKα","","0.0628","0.0396","","0.0953","0.0849","","","","1.03","1.061","1.061","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110469","13.132","0.003","32.368","0.006","17.233","0.003","90","","90","","90","","7325","3","293","2","218","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C50 H121 Ga3 P4 Si9 -","- C50 H121 Ga3 P4 Si9 -","- C200 H484 Ga12 P16 Si36 -","4","0.5","","Uhl, Werner; Benter, Maike","The insertion of alkylgallium(I) groups [Ga‒C(SiMe3)3] into P‒P bonds of P4: formation of a P4(GaR)3 cage","Chemical Communications","1999","","9","771","","10.1039/a900670b","","","0.71073","MoKα","","0.0917","0.0587","","","0.15","0.1654","","","","","","1.035","","","","has coordinates,has disorder","180218","2020-10-21","18:00:00",""
"7110470","11.5407","0.0003","16.9821","0.0004","16.7013","0.0004","90","","106.988","0.001","90","","3130.39","0.13","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H24 N4 Ni2 O2.8 S4 -","- C32 H24 N4 Ni2 O2.8 S4 -","- C128 H96 N16 Ni8 O11.2 S16 -","4","1","","Matthew Cocker, T.; Bachman, Robert E.","Isolation and crystal structure of a novel dinuclear nickel(II) O-bound sulfinate from the oxidation of 2,2′-bipyridine-1,2-benzenedithiolatonickel(II)","Chemical Communications","1999","","10","875","","10.1039/a900673g","","","0.71073","MoKα","","0.1523","0.0786","","","0.1788","0.21","","","","","","1.013","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110471","9.3135","0.0001","12.5526","0.0002","12.7451","0.0002","96.017","0.001","101.887","0.0003","110.076","0.001","1344.26","0.04","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C27.5 H20 N4.5 Ni O6.5 S2 -","- C27.5 H20 N4.5 Ni O6.5 S2 -","- C55 H40 N9 Ni2 O13 S4 -","2","1","","Matthew Cocker, T.; Bachman, Robert E.","Isolation and crystal structure of a novel dinuclear nickel(II) O-bound sulfinate from the oxidation of 2,2′-bipyridine-1,2-benzenedithiolatonickel(II)","Chemical Communications","1999","","10","875","","10.1039/a900673g","","","0.71073","MoKα","","0.1254","0.0691","","","0.1137","0.134","","","","","","1.066","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110472","13.722","0.003","14.908","0.003","15.368","0.003","73.49","0.03","87.4","0.03","62.68","0.03","2664.6","1.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C61 H72 Cl2 Fe2 N4 -","- C61 H72 Cl2 Fe2 N4 -","- C122 H144 Cl4 Fe4 N8 -","2","1","","Burrell, Anthony K.; Campbell, Wayne M.; Jameson, Geoffrey B.; Officer, David L.; Boyd, Peter D. W.; Zhao, Zhongde; Cocks, Paul A.; Gordon, Keith C.","Bis(ferrocenyl)porphyrins. Compounds with strong long-range metal‒metal coupling†","Chemical Communications","1999","","7","637","","10.1039/a900691e","","","0.71073","MoKα","","0.2262","0.0586","","","0.1645","0.2549","","","","","","0.987","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110473","28.5339","0.0002","28.5339","0.0002","24.6067","0.0001","90","","90","","90","","20034.4","0.2","293","2","293","2","","","","","","","","6","I 41/a :2","-I 4ad","88","","","","- C60 H68 Fe2 N4 Ni O0.25 -","- C59.996 H68 Fe2 N3.996 Ni O0.25 -","- C959.936 H1088 Fe32 N63.936 Ni16 O4 -","16","1","","Burrell, Anthony K.; Campbell, Wayne M.; Jameson, Geoffrey B.; Officer, David L.; Boyd, Peter D. W.; Zhao, Zhongde; Cocks, Paul A.; Gordon, Keith C.","Bis(ferrocenyl)porphyrins. Compounds with strong long-range metal‒metal coupling†","Chemical Communications","1999","","7","637","","10.1039/a900691e","","","0.71073","MoKα","","0.1354","0.0809","","","0.2048","0.2328","","","","","","1.071","","","","has coordinates,has disorder","180218","2020-10-21","18:00:00",""
"7110474","15.334","0.003","18.203","0.004","8.414","0.002","90","","90","","90","","2348.6","0.9","293","2","293","2","","","","","","","","4","A b a 2","A 2 -2ab","41","","","","- C13 H11 N2 O2 -","- C13 H11 N2 O2 -","- C104 H88 N16 O16 -","8","","","Reznikov, Vladimir A.; Pervukhina, Natalia V.; Ikorskii, Vladimir N.; Ovcharenko, Victor I.; Ovcharenko, Ivan V.; Grand, Andre","Persistent vinylnitroxides","Chemical Communications","1999","","6","539","","10.1039/a900733d","","","0.71069","MoKα","","0.0482","0.0204","","","0.0251","0.0306","","","","","","0.506","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110475","10.212","0.004","16.231","0.005","19.776","0.008","90","","101.73","0.03","90","","3209","2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C33 H52 N4 Si -","- C33 H52 N4 Si -","- C132 H208 N16 Si4 -","4","1","","Marco Boesveld, W.; Gehrhus, Barbara; Hitchcock, Peter B.; Lappert, Michael F.; von Ragué Schleyer, Paul","A crystalline carbene‒silylene adduct 1,2-C6H4[N(R)]2C-Si[N(R)]2C6H4-1,2 (R = CH2But); synthesis, structure and bonding in model compounds†","Chemical Communications","1999","","8","755","","10.1039/a900784i","","","0.71073","MoKα","","0.1556","0.075","","0.1982","0.154","","","","1.002","1.072","1.072","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110476","13.026","0.0006","19.219","0.0009","16.1034","0.0007","90","","110.517","0.001","90","","3775.7","0.3","203","2","203","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H33 Ta -","- C20 H33 Ta -","- C160 H264 Ta8 -","8","2","","Shin, Jun Ho; Parkin, Gerard","The ansa-effect in permethyltantalocene chemistry: a [Me2Si] ansa bridge promotes olefin-insertion and reductive-elimination reactions for [Me2Si(C5Me4)2]Ta(η2-C2H4)H and [Me2Si(C5Me4)2]TaH3","Chemical Communications","1999","","10","887","","10.1039/a900895k","","","0.71073","MoKα","","0.027","0.0227","","","0.0508","0.0522","","","","","","1.032","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110477","8.6366","0.0005","15.9753","0.0009","14.8619","0.0008","90","","100.539","0.001","90","","2015.9","0.2","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H25 O Si Ta -","- C21 H25 O Si Ta -","- C84 H100 O4 Si4 Ta4 -","4","1","","Shin, Jun Ho; Parkin, Gerard","The ansa-effect in permethyltantalocene chemistry: a [Me2Si] ansa bridge promotes olefin-insertion and reductive-elimination reactions for [Me2Si(C5Me4)2]Ta(η2-C2H4)H and [Me2Si(C5Me4)2]TaH3","Chemical Communications","1999","","10","887","","10.1039/a900895k","","","0.71073","MoKα","","0.0285","0.0225","","0.0563","0.0535","","","","1.04","1.073","1.073","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110478","10.1777","0.0006","14.7904","0.0008","13.6189","0.0008","90","","90","","90","","2050.1","0.2","223","2","223","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C22 H35 Si Ta -","- C22 H35 Si Ta -","- C88 H140 Si4 Ta4 -","4","0.5","","Shin, Jun Ho; Parkin, Gerard","The ansa-effect in permethyltantalocene chemistry: a [Me2Si] ansa bridge promotes olefin-insertion and reductive-elimination reactions for [Me2Si(C5Me4)2]Ta(η2-C2H4)H and [Me2Si(C5Me4)2]TaH3","Chemical Communications","1999","","10","887","","10.1039/a900895k","","","0.71073","MoKα","","0.0334","0.0285","","","0.0634","0.065","","","","","","1.193","","","","has coordinates,has disorder","180218","2020-10-21","18:00:00",""
"7110479","9.2119","0.0008","12.5305","0.0012","14.5747","0.001","90","","107.744","0.007","90","","1602.3","0.2","213","2","213","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","","","- C20 H20 -","- C20 H20 -","- C80 H80 -","4","1","","Tykwinski, Rik R.","Cyclic alkynes‒electronic behaviour as a function of ring strain","Chemical Communications","1999","","10","905","","10.1039/a900910h","","","0.71073","MoKa","","0.1618","0.0762","","0.2012","0.1549","","","","1.024","1.149","1.149","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110480","27.297","0.005","18.88","0.004","17.444","0.003","90","","126.75","0.03","90","","7203","4","299","2","299","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C32 H48 Li N2 O3 S2 V -","- C32 H48 Li N2 O3 S2 V -","- C256 H384 Li8 N16 O24 S16 V8 -","8","1","","Janas, Zofia; Jerzykiewicz, Lucjan B.; Sobota, Piotr; Richards, Raymond L.","Synthesis and molecular structure of vanadium(III) dithiolate complexes: a new class of alkene polymerization catalysts","Chemical Communications","1999","","11","1015","","10.1039/a900916g","","","0.71073","MoKα","","0.0474","0.0357","","","0.1007","0.1064","","","","","","1.075","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110481","10.022","0.003","12.156","0.004","18.628","0.004","90","","98.44","0.03","90","","2244.8","1.1","299","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H30 N O2 S2 V -","- C21 H30 N O2 S2 V -","- C84 H120 N4 O8 S8 V4 -","4","1","","Janas, Zofia; Jerzykiewicz, Lucjan B.; Sobota, Piotr; Richards, Raymond L.","Synthesis and molecular structure of vanadium(III) dithiolate complexes: a new class of alkene polymerization catalysts","Chemical Communications","1999","","11","1015","","10.1039/a900916g","","","0.71073","MoKα","","0.0322","0.0269","","","0.076","0.0785","","","","","","1.124","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110482","7.3254","0.0008","9.2627","0.0009","6.6102","0.0008","100.026","0.009","112.327","0.008","97.532","0.009","398.87","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H12 Cr F6 -","- C18 H12 Cr F6 -","- C18 H12 Cr F6 -","1","0.5","","Aspley, Catherine J.; Boxwell, Clive; Buil, Maria L.; Higgitt, Catherine L.; Perutz, Robin N.; Long, Conor","A new combination of donor and acceptor: bis(η6-benzene)chromium and hexafluorobenzene form a charge-transfer stacked crystal","Chemical Communications","1999","","11","1027","","10.1039/a900919a","","","0.71069","MoKα","","0.0537","0.0392","","","0.1027","0.1112","","","","","","1.083","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110483","15.829","0.002","15.829","0.002","28.712","0.006","90","","90","","90","","7194","2","293","2","293","2","","","","","","","","9","P 43 2 2","P 4cw 2c","95","","","","- C12 H50 Mo8 N12 Na Ni2 O45 P V8 -","- C12 H48 Mo8 N12 Na Ni2 O45 P V8 -","- C48 H192 Mo32 N48 Na4 Ni8 O180 P4 V32 -","4","0.5","","Xu, Yan; Zhu, Hao-Guo; Cai, Hu; You, Xiao-Zeng","[MoV2MoVI6VIV8O40(PO4)]5−: the first polyanion with a tetra-capped Keggin structure","Chemical Communications","1999","","9","787","","10.1039/a900928k","","","0.71073","MoKα","","0.1103","0.0765","","0.2256","0.1987","","","","1.161","1.299","1.299","","","","","has coordinates,has disorder","180218","2020-10-21","18:00:00",""
"7110484","31.616","0.006","35.691","0.007","13.355","0.003","90","","90","","90","","15070","5","293","2","293","2","","","","","","","","7","C c c a :2","-C 2a 2ac","68","","","","- C14.5 H33 Cl3 N14 O22 Pd1.25 Pt1.5 -","- C14.5 H26 Cl3 N14 O22 Pd1.25 Pt1.5 -","- C232 H416 Cl48 N224 O352 Pd20 Pt24 -","16","1","","Schnebeck, Ralf-Dieter; Freisinger, Eva; Lippert, Bernhard","Anion pore structure through packing of molecular triangles","Chemical Communications","1999","","8","675","","10.1039/a900964g","","","0.71069","MoKα","","0.1841","0.0613","","0.1635","0.1308","","","","0.834","1.177","1.177","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110485","9.789","0.002","11.737","0.002","14.795","0.003","92.05","0.03","99.19","0.03","107","0.03","1598.6","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H36 Cl2 N4 Ni O12 -","- C26 H32 Cl2 N4 Ni O12 -","- C52 H64 Cl4 N8 Ni2 O24 -","2","1","","Starynowicz, Przemysław; Lisowski, Jerzy","A heterodinuclear macrocyclic complex containing both nickel(II) and palladium(II) ions","Chemical Communications","1999","","9","769","","10.1039/a900969h","","","0.71073","MoKα","","","0.0707","","","0.1352","","","","","6.044","6.044","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110486","16.627","0.003","19.701","0.004","10.951","0.002","90","","91.35","0.03","90","","3586.2","1.2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H35 Cl2 N7 Ni O10 Pd -","- C30 H35 Cl2 N7 Ni O10 Pd -","- C120 H140 Cl8 N28 Ni4 O40 Pd4 -","4","1","","Starynowicz, Przemysław; Lisowski, Jerzy","A heterodinuclear macrocyclic complex containing both nickel(II) and palladium(II) ions","Chemical Communications","1999","","9","769","","10.1039/a900969h","","","0.71073","MoKα","","","0.0673","","","0.1243","","","","","4.503","4.503","","","","","has coordinates,has disorder","180218","2020-10-21","18:00:00",""
"7110487","26.41","0.005","15.468","0.004","15.683","0.004","90","","119.47","0.02","90","","5578","3","296.2","","296.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H34 Rh2 S4 Ti2 -","- C26 H34 Rh2 S4 Ti2 -","- C208 H272 Rh16 S32 Ti16 -","8","1","","Amemiya, Takashi; Kuwata, Shigeki; Hidai, Masanobu","Syntheses of mixed-metal M2Ti2S4 cubane-type sulfido clusters (M = Ru, Rh, Ir, Cu) from a dinuclear organometallic thiotitanate anion","Chemical Communications","1999","","8","711","","10.1039/a901002e","","","0.7107","MoKα","","0.0369","0.0369","","","0.0371","0.0371","","","","","","1.669","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110488","25.876","0.003","11.435","0.004","31.271","0.004","90","","105.849","0.009","90","","8901","3","296.2","","296.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C46 H40 Cu2 P2 S4 Ti2 -","- C46 H40 Cu2 P2 S4 Ti2 -","- C368 H320 Cu16 P16 S32 Ti16 -","8","1","","Amemiya, Takashi; Kuwata, Shigeki; Hidai, Masanobu","Syntheses of mixed-metal M2Ti2S4 cubane-type sulfido clusters (M = Ru, Rh, Ir, Cu) from a dinuclear organometallic thiotitanate anion","Chemical Communications","1999","","8","711","","10.1039/a901002e","","","0.7107","MoKα","","0.0403","0.0403","","","0.0353","0.0353","","","","","","1.377","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110489","12.251","0.005","17.276","0.006","18.083","0.007","90","","91.56","0.03","90","","3826","3","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H21 Co Fe O5 -","- C22 H20 Co Fe O5 -","- C176 H160 Co8 Fe8 O40 -","8","2","","Braga, Dario; Maini, Lucia; Grepioni, Fabrizia","Grinding of an organometallic crystalline material leads to quantitative formation of a hydrated polymorph","Chemical Communications","1999","","10","937","","10.1039/a901078e","","","0.71069","MoKα","","0.1495","0.0455","","","0.1056","0.1408","","","","","","0.948","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110490","11.8154","0.0007","11.8154","0.0007","17.7571","0.0007","90","","90","","120","","2146.8","0.2","200","","","","","","","","","","","3","R -3 :H","-R 3","148","9-germanyltriptycene","tribenzobarellenegermane","","- C20 H16 Ge -","- C20 H16 Ge -","- C120 H96 Ge6 -","6","0.333333","","Brynda, Marcin; Geoffroy, Michel; Bernardinelli, Gérald","Air-stable crystalline primary phosphines and germanes: synthesis and crystal structures of dibenzobarellenephosphine and tribenzobarellenegermane","Chemical Communications","1999","","11","961","","10.1039/a901083a","","","1.54183","CuKα","","","0.086","","","","0.06","","","","","","5.835","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110491","11.7919","0.0007","11.7919","0.0007","17.5871","0.0008","90","","90","","120","","2117.8","0.2","170","","","","","","","","","","","2","R -3 :H","-R 3","148","9-methyltriptycene","tribenzobarellenemethane","","- C21 H16 -","- C21 H16 -","- C126 H96 -","6","0.333333","","Brynda, Marcin; Geoffroy, Michel; Bernardinelli, Gérald","Air-stable crystalline primary phosphines and germanes: synthesis and crystal structures of dibenzobarellenephosphine and tribenzobarellenegermane","Chemical Communications","1999","","11","961","","10.1039/a901083a","","","1.54183","CuKα","","","0.038","","","","0.036","","","","","","4.803","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110492","14.014","0.003","12.75","0.003","15.014","0.003","90","","105.48","0.03","90","","2585.4","1","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C34 H88 As2 K2 N10 P2 -","- C34 H88 As2 K2 N10 P2 -","- C68 H176 As4 K4 N20 P4 -","2","0.5","","Beswick, Michael A.; Hopkins, Alexander D.; Kidd, Sara J.; Lawson, Yvonne G.; Raithby, Paul R.; Wright, Dominic S.; Bashall, Alan; McPartlin, Mary; Rothenberger, Alexander; Stalke, FT3Dietmar","A simple route to multifunctional phosphide and amide donor sets; syntheses and structures of [{ButPAs(NMe2)2}K.pmdeta]2 and [{CyNAs(NMe2)2K}2]∞","Chemical Communications","1999","","8","739","","10.1039/a901222b","","","0.71073","MoKα","","0.1468","0.0733","","","0.1536","0.1854","","","","","","1.014","","","","has coordinates","301857","2025-08-21","22:47:10",""
"7110493","7.4866","0.001","7.4866","0.001","27.407","0.005","90","","90","","90","","1536.1","0.4","293","2","293","2","","","","","","","synthetic","4","I 41/a m d :2","-I 4bd 2","141","","","","- Na2 O13 Si5 Ti -","- Na0.8 O5.2 Si2 Ti0.4 -","- Na8 O52 Si20 Ti4 -","10","0.3125","","Wang, Xiqu; Jacobson, Allan J.","Crystal structure of the microporous titanosilicate ETS-10 refined from single crystal X-ray diffraction data","Chemical Communications","1999","","11","973","","10.1039/a901280j","","","0.71073","MoKα","","0.1578","0.119","","0.2537","0.2374","","","","1.352","1.426","1.426","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110494","13.451","0.0008","13.451","0.0008","13.9408","0.0012","90","","90","","120","","2184.4","0.3","158","","158","","","","","","","","","4","R -3 :H","-R 3","148","","","","- C16 H26 O13 Si8 -","- C15.98 O13.02 Si8 -","- C47.94 O39.06 Si24 -","3","0.166667","","Feher, Frank J.; Wyndham, Kevin D.; Baldwin, Richard K.; Soulivong, Daravong; Ziller, Joseph W.; Lichtenhan, Joseph D.; Lichtenhan, Joseph D.","Methods for effecting monofunctionalization of (CH2CH)8Si8O12","Chemical Communications","1999","","14","1289","","10.1039/a901308c","","","0.71073","MoKα","","0.1122","0.0995","","","0.3092","0.3246","","","","","","1.05","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110495","11.3602","0.0006","22.7707","0.0013","15.858","0.0009","90","","93.956","0.001","90","","4092.4","0.4","200","2","293","2","","","","","","","","5","P 1 n 1","P -2yac","7","","bis(4,4'-bipyridine)dinitratonickel(II) 1:2 complex with pyrene","","- C52 H36 N6 Ni O6 -","- C52 H36 N6 Ni O6 -","- C208 H144 N24 Ni4 O24 -","4","2","","Biradha, Kumar; Domasevitch, Konstantin V.; Moulton, Brian; Seward, Corey; Zaworotko, Michael J.","Covalent and noncovalent interpenetrating planar networks in the crystal structure of {[Ni(4,4′-bipyridine)2(NO3)2·2pyrene}n","Chemical Communications","1999","","14","1327","","10.1039/a901311c","","","0.71073","MoKα","","0.0651","0.0409","","0.125","0.1031","","","","1.017","1.114","1.114","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110496","7.641","0.001","15.89","0.003","6.3477","0.0009","96.66","0.01","109.31","0.01","99.48","0.01","705.3","0.2","150.2","","150.15","","","","","","","","","3","P -1","-P 1","2","","","","- C16 H24 O2 -","- C16 H22 O2 -","- C32 H44 O4 -","2","1","","Fujishima, Hiroshi; Takeshita, Hiroshi; Toyota, Masahiro; Ihara, Masataka","Novel concise ring closure leading to bridged ten-membered ring compounds","Chemical Communications","1999","","10","893","","10.1039/a901392j","","","0.7107","MoKα","","0.039","0.039","","","0.0379","0.0379","","","","","","1.733","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110497","12.4567","0.0001","19.2826","0.0002","21.7933","0.0002","90","","100.76","0.01","90","","5142.66","0.19","203","2","203","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C48 H50 Cl4 N2 O4 Os P2 S2 Sn -","- C48 H50 Cl4 N2 O4 Os P2 S2 Sn -","- C192 H200 Cl16 N8 O16 Os4 P8 S8 Sn4 -","4","1","","Rickard, Clifton E. F.; Roper, Warren R.; Woodman, Timothy J.; James Wright, L.","The synthesis and crystal structure of the first metal-bound stannatrane complex Os(Sn[OCH2CH2]3N)(η2-S2CNMe2)(CO)(PPh3)2: structural comparisons with the analogous silatrane complex Os(Si[OCH2CH2]3N)(η2-S2CNMe2)(CO)(PPh3)2","Chemical Communications","1999","","9","837","","10.1039/a901408j","","","0.71073","MoKα","","0.0409","0.0354","","","0.0982","0.1022","","","","","","1.022","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110498","19.9139","0.0002","9.9449","0.0001","22.2254","0.0002","90","","90","","90","","4401.56","0.07","203","2","203","2","","","","","","","","8","P c a 21","P 2c -2ac","29","","","","- C46 H48 N2 O4 Os P2 S2 Si -","- C46 H48 N2 O4 Os P2 S2 Si -","- C184 H192 N8 O16 Os4 P8 S8 Si4 -","4","1","","Rickard, Clifton E. F.; Roper, Warren R.; Woodman, Timothy J.; James Wright, L.","The synthesis and crystal structure of the first metal-bound stannatrane complex Os(Sn[OCH2CH2]3N)(η2-S2CNMe2)(CO)(PPh3)2: structural comparisons with the analogous silatrane complex Os(Si[OCH2CH2]3N)(η2-S2CNMe2)(CO)(PPh3)2","Chemical Communications","1999","","9","837","","10.1039/a901408j","","","0.71073","MoKα","","0.0395","0.0346","","","0.0737","0.0762","","","","","","1.173","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110499","9.4979","0.0015","9.4931","0.0013","21.394","0.003","88.104","0.01","77.308","0.014","62.825","0.011","1669.1","0.5","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","{(Cp*Rh)2}{Co3(CO)8}(BBH)(BCl)","","- C28 H31 B3 Cl Co3 O8 Rh2 -","- C28 H31 B3 Cl Co3 O8 Rh2 -","- C56 H62 B6 Cl2 Co6 O16 Rh4 -","2","1","","Lei, Xinjian; Shang, Maoyu; Fehlner, Thomas P.","Designer clusters: synthesis and characterization of Cp*2Rh2Co3(CO)8B3HCl (Cp* =η5-C5Me5)","Chemical Communications","1999","","10","933","","10.1039/a901491h","","","0.71073","MoKα","","0.0475","0.0348","","0.0884","0.0821","","","","1.036","1.081","1.081","","","","","has coordinates","180218","2020-10-21","18:00:00",""
"7110500","18.7886","0.0004","7.41628","0.00019","19.364","0.0003","90","","116.209","0.0016","90","","2420.8","0.09","208","2","208","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","(2S,4S,4aS,5S)-2-[(4-methoxybenzyl)oxy]-4,5-diphenylperhydroazeto- [1,2-b][1,2]oxazin-6-one","","- C29 H31 N O4 -","- C29 H31 N O4 -","- C116 H124 N4 O16 -","4","1","","Kuster, George J.; Kalmoua, Faysal; Scheeren, Hans W.; de Gelder, Rene","A simple entry towards novel bi- and tricyclic N-oxy-β-lactams by high pressure promoted tandem [4 + 2]/[3 + 2] cycloadditions of enol ethers and β-nitrostyrene","Chemical Communications","1999","","9","855","","10.1039/a901505a","","","1.54184","CuKα","","0.0532","0.0473","","0.1367","0.1313","0.1367","","","1.055","","","1.055","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110501","8.9646","0.0006","9.4791","0.0008","14.7752","0.0004","95.628","0.005","100.851","0.005","103.968","0.006","1182.99","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","(2R,3S,3aS,4S,6S)-6-[(4-methoxybenzyl)oxy]-3-nitro-2,4- diphenylperhydroisoxazolo[2,3-b][1,2]oxazine","","- C26 H26 N2 O6 -","- C26 H26 N2 O6 -","- C52 H52 N4 O12 -","2","1","","Kuster, George J.; Kalmoua, Faysal; Scheeren, Hans W.; de Gelder, Rene","A simple entry towards novel bi- and tricyclic N-oxy-β-lactams by high pressure promoted tandem [4 + 2]/[3 + 2] cycloadditions of enol ethers and β-nitrostyrene","Chemical Communications","1999","","9","855","","10.1039/a901505a","","","1.54184","CuKα","","0.0478","0.0422","","0.1169","0.1113","0.1169","","","1.037","","","1.037","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110502","6.604","0.001","11.265","0.003","15.797","0.004","106.96","0.02","90.41","0.02","93.45","0.02","1121.7","0.5","289","2","289","2","","","","","","","","3","P -1","-P 1","2","","","","- C26 H38 O2 -","- C26 H38 O2 -","- C52 H76 O4 -","2","1","","Forier, Bart; Toppet, Suzanne; Meervelt, Luc Van; Dehaen, Wim","Formation and structure of unusual [2 + 1] adducts of citronellal and oligo(hydroxy)benzenes","Chemical Communications","1999","","12","1117","","10.1039/a901553a","","","0.71073","MoKα","","0.0841","0.0535","","0.149","0.1268","","","","1.039","1.083","1.083","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110503","8.555","0.002","10.668","0.002","12.427","0.002","90","","108.41","0.01","90","","1076.1","0.4","289","2","289","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C26 H38 O2 -","- C26 H38 O2 -","- C52 H76 O4 -","2","0.5","","Forier, Bart; Toppet, Suzanne; Meervelt, Luc Van; Dehaen, Wim","Formation and structure of unusual [2 + 1] adducts of citronellal and oligo(hydroxy)benzenes","Chemical Communications","1999","","12","1117","","10.1039/a901553a","","","0.71073","MoKα","","0.0473","0.0393","","","0.1026","0.1084","","","","","","1.059","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110504","12.8335","0.0004","16.7315","0.0005","18.65","0.0006","90","","90","","90","","4004.6","0.2","123","2","123","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","1,2,3-Tri-tert.butyl-1,3-2,4-diazaphosphaaluminetidine- trimethylamino-donor","","- C15 H37 Al N3 P -","- C15 H37 Al N3 P -","- C120 H296 Al8 N24 P8 -","8","1","","Schulz, Stephan; Bauer, Tillmann; Nieger, Martin","Synthesis and X-ray structure of the first 1,3,2,4-diazaphosphaaluminetidine","Chemical Communications","1999","","10","879","","10.1039/a901556f","","","0.71073","MoKα","","0.0746","0.05","","","0.1457","0.1535","","","","","","1.004","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110505","13.24","0.001","15.536","0.001","16.387","0.001","78.643","0.001","75.868","0.001","68.096","0.001","3011.7","0.4","291","1","291","1","","","","","","","","6","P -1","-P 1","2","","cis-μ~2~-Cl-μ~3~-O-[1,3-Bis(trimethylsilylmethyl)-1,3-dichloro-1,3- distanna-2-oxa-5,8-disila-5,5,8,8-tetramethyl-cyclo-6-nonine]-dimer","","- C32 H76 Cl4 O2 Si8 Sn4 -","- C32 H76 Cl4 O2 Si8 Sn4 -","- C64 H152 Cl8 O4 Si16 Sn8 -","2","1","","Schulte, Marcus; Schürmann, Markus; Jurkschat, Klaus; Dakternieks, Dainis","Tetraorganodistannoxanes: formation of a novel cis-ladder†","Chemical Communications","1999","","14","1291","","10.1039/a901557d","","","0.71069","MoKα","","0.0617","0.0324","","","0.0748","0.0822","","","","","","1.017","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110506","12.7694","0.0016","20.991","0.003","21.691","0.002","94.763","0.014","103.677","0.014","98.202","0.015","5550.1","1.3","160","2","160","2","","","","","","","","6","P -1","-P 1","2","","","","- C58 H91 O P2 Ru Si -","- C58.5 H91 O0.5 P2 Ru Si -","- C234 H364 O2 P8 Ru4 Si4 -","4","2","","Hussein, Khansaa; Marsden, Colin J.; Barthelat, Jean-Claude; Rodriguez, Venancio; Conejero, Salvador; Sabo-Etienne, Sylviane; Donnadieu, Bruno; Chaudret, Bruno","X-Ray structure and theoretical studies of RuH2(η2-H2)(η2-H-SiPh3)(PCy3)2, a complex with two different η2-coordinated σ bonds","Chemical Communications","1999","","14","1315","","10.1039/a901558b","","","0.71073","MoKα","","0.0997","0.0381","","","0.0626","0.0725","","","","","","0.671","","","","has coordinates,has disorder","180219","2020-10-21","18:00:00",""
"7110507","13.28","0.002","13.28","0.002","26.529","0.005","90","","90","","90","","4678.6","1.3","193","2","193","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C49 H54 Cl3 Mn N4 O8 -","- C49 H52 Cl3 Mn N4 O8 -","- C196 H208 Cl12 Mn4 N16 O32 -","4","0.5","","Simonato, Jean-Pierre; Pécaut, Jacques; Marchon, Jean-Claude; Robert Scheidt, W.","Antagonistic metal-directed inductions in catalytic asymmetric aziridination by manganese and iron tetramethylchiroporphyrins","Chemical Communications","1999","","11","989","","10.1039/a901559k","","","0.71073","MoKα","","0.0512","0.0458","","0.1277","0.123","","","","1.034","1.052","1.052","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110508","50.075","0.003","56.049","0.004","30.302","0.002","90","","90","","90","","85047","10","183","2","183","2","","","","","","","","5","C m c a","-C 2ac 2","64","","","","- H736 Mo154 Na21 O830 P7 -","- Mo154 Na4 O752 P7 -","- Mo616 Na16 O3008 P28 -","4","","","Müller, Achim; Das, Samar K.; Bögge, Hartmut; Beugholt, Christian; Schmidtmann, Marc","Assembling nanosized ring-shaped synthons to an anionic layer structure based on the synergetically induced functional complementarity of their surface-sites: Na21[MoVI126MoV28O462H14(H2O)54(H2PO2)7]·xH2O (x ≈ 300)","Chemical Communications","1999","","11","1035","","10.1039/a901562k","","","0.71073","MoKα","","0.1625","0.0735","","","0.1783","0.2743","","","","","","1.164","","","","has coordinates","190299","2020-10-21","18:00:00",""
"7110509","10.238","0.004","18.026","0.007","10.065","0.003","92.29","0.03","113.71","0.03","101.13","0.03","1654.4","1.1","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C35 H46 B Cu N5 O4 -","- C35 H46 B Cu N5 O4 -","- C70 H92 B2 Cu2 N10 O8 -","2","1","","Tan, Xiang Shi; Fujii, Yuki; Sato, Tsuyoshi; Nakano, Yoshiharu; Yashiro, Morio","The crystal structures of glycylglycine and glycine complexes of cis,cis-1,3,5-triaminocyclohexane‒copper(II) as reaction intermediates of metal-promoted peptide hydrolysis","Chemical Communications","1999","","10","881","","10.1039/a901569h","","","0.7107","MoKα","","0.0502","0.0502","","","0.0506","0.0506","","","","","","3.47","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110510","9.879","0.002","30.374","0.009","9.769","0.002","90","","90","","90","","2931.3","1.2","273.2","","273.2","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H39 B Cu N4 O2 -","- C32 H39 B Cu N4 O2 -","- C128 H156 B4 Cu4 N16 O8 -","4","1","","Tan, Xiang Shi; Fujii, Yuki; Sato, Tsuyoshi; Nakano, Yoshiharu; Yashiro, Morio","The crystal structures of glycylglycine and glycine complexes of cis,cis-1,3,5-triaminocyclohexane–copper(II) as reaction intermediates of metal-promoted peptide hydrolysis","Chemical Communications","1999","","10","881","","10.1039/a901569h","","","0.7107","MoKα","","0.0518","0.0518","","","0.051","0.051","","","","","","3.203","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110511","22.9666","0.0019","18.1932","0.0018","18.1761","0.0019","90","","98.574","0.012","90","","7509.8","1.3","148","","148","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Disodium Hexakis(p-methoxyphenoxy) Octa-μ-3-chloro-Hexamolybdate","","- C60 H79 Cl8 Mo6 Na2 O16.5 -","- C66 H92 Cl8 Mo6 Na2 O18 -","- C264 H368 Cl32 Mo24 Na8 O72 -","4","0.5","","Gorman, Christopher B.; Su, Wendy Y.; Jiang, Hongwei; Watson, Christopher M.; Boyle, Paul","Hybrid organic‒inorganic, hexa-arm dendrimers based on an Mo6Cl8 core","Chemical Communications","1999","","10","877","","10.1039/a901590f","","","0.71073","MolybdenumKα","","0.037","0.036","","0.042","0.041","","","","","1.42","1.42","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110512","17.174","0.006","7.096","0.004","19.452","0.004","90","","92.26","0.02","90","","2368.7","1.6","293.2","","293.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H10 Fe2 O9 S2 W -","- C19 H10 Fe2 O9 S2 W -","- C76 H40 Fe8 O36 S8 W4 -","4","1","","Kuge, Katsuaki; Tobita, Hiromi; Ogino, Hiroshi","Synthesis and structures of heterometallic trinuclear clusters [CpFe(CO)2]2(μ3-S2)W(CO)5 and Cp2Fe2(CO)3(μ-CO)(μ3-S)W(CO)5 and kinetic study of migration of the W(CO)5 moiety in the disulfido complex","Chemical Communications","1999","","12","1061","","10.1039/a901660k","","","0.7107","MoKα","","0.03","0.03","","","0.0437","0.0437","","","","","","1.05","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110513","16.896","0.009","9.848","0.005","12.815","0.01","90","","90","","90","","2132","2","293.2","","293.2","","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C18 H10 Fe2 O8 S W -","- C18 Fe2 O8 S W -","- C72 Fe8 O32 S4 W4 -","4","1","","Kuge, Katsuaki; Tobita, Hiromi; Ogino, Hiroshi","Synthesis and structures of heterometallic trinuclear clusters [CpFe(CO)2]2(μ3-S2)W(CO)5 and Cp2Fe2(CO)3(μ-CO)(μ3-S)W(CO)5 and kinetic study of migration of the W(CO)5 moiety in the disulfido complex","Chemical Communications","1999","","12","1061","","10.1039/a901660k","","","0.7107","MoKα","","","0.0387","","","0.0513","","","","","0.852","0.852","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110514","9.984","0.002","15.039","0.004","17.653","0.002","90","","90","","90","","2650.6","0.9","293","2","293","2","","","","","","","K. Chen/ Prof. L. Que, Jr.","6","P 21 21 21","P 2ac 2ab","19","96CAD35","","","- C20 H28 Cl2 Fe N6 O8 -","- C20 H28 Cl2 Fe N6 O8 -","- C80 H112 Cl8 Fe4 N24 O32 -","4","1","","Chen, Kui; Jr., Lawrence Que","Evidence for the participation of a high-valent iron–oxo species in stereospecific alkane hydroxylation by a non-heme iron catalyst","Chemical Communications","1999","","15","1375","","10.1039/a901678c","","","0.71073","MoKα","","0.0851","0.052","","0.1217","0.1052","","","","1.029","1.058","1.058","","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110515","9.007","0.002","26.879","0.006","10.945","0.002","90.02","0.02","99.34","0.02","89.99","0.02","2614.6","1","298","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C29 H28 O S3 -","- C29 H28 O S3 -","- C116 H112 O4 S12 -","4","1","","Yoshimatsu, Mitsuhiro; Gotoh, Satoshi; Tanabe, Genzoh; Muraoka, Osamu","Formation of 2-oxa- or 2-azabicyclo[3.3.0]octa-3,7-diene by a novel tandem intramolecular photo-cyclization of 2,4,6-tris(phenylthio)hepta-2,4,6-trienal derivatives","Chemical Communications","1999","","10","909","","10.1039/a901707k","","","1.54178","CuIKa","","","0.056","","","0.07","","","","","3.28","3.28","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110516","8.638","0.005","9.693","0.009","32.149","0.016","90","","90","","90","","2692","3","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H44 O6 Si -","- C25 H44 O6 Si -","- C100 H176 O24 Si4 -","4","1","","Stephen Clark, J.; Dossetter, Alexander G.; Blake, Alexander J.; Li, Wan-Sheung; Whittingham, William G.","Synthesis of the functionalised core of neoliacinic acid","Chemical Communications","1999","","8","749","","10.1039/a901711i","","","0.71073","MoKα","","0.0639","0.0506","","","0.1066","0.1167","","","","","","1.041","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110517","35.72","0.007","8.605","0.002","23.661","0.005","90","","117.94","0.03","90","","6425","3","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","bis(R,R)-(-)-trans-2,3-bis(diphenylhydroxymethyl)-1,4-dioxaspiro(4.4)nonane N-nitroso-4-benzylpiperidine 2:1 clathrate","","- C78 H80 N2 O9 -","- C78 H80 N2 O9 -","- C312 H320 N8 O36 -","4","1","","Olszewska, Teresa; Milewska, Maria J.; Połoński, Tadeusz; Gdaniec, Maria","N-Nitrosopiperidines with chirality solely due to hindered rotation about the N‒N bond: enantioselective inclusion complexation with optically active hosts","Chemical Communications","1999","","15","1385","","10.1039/a901718f","","","1.54178","CuKα","","0.0612","0.0404","","0.1139","0.102","","","","1.069","1.099","1.099","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110518","11.292","0.002","9.536","0.002","17.654","0.004","90","","97.04","0.02","90","","1886.7","0.7","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","bis(R,R)-(-)-trans-2,3-bis(diphenylhydroxymethyl)-1,4-dioxaspiro(4.4)nonane N-nitroso-4-phenylpiperidine clathrate","","- C44 H46 N2 O5 -","- C44 H46 N2 O5 -","- C88 H92 N4 O10 -","2","1","","Olszewska, Teresa; Milewska, Maria J.; Połoński, Tadeusz; Gdaniec, Maria","N-Nitrosopiperidines with chirality solely due to hindered rotation about the N‒N bond: enantioselective inclusion complexation with optically active hosts","Chemical Communications","1999","","15","1385","","10.1039/a901718f","","","1.54178","CuKα","","0.0696","0.0418","","0.1271","0.1108","","","","1.072","1.126","1.126","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110519","12.84","0.001","18.077","0.001","12.92","0.001","90","","90.62","0.01","90","","2998.7","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H22 N O2.5 -","- C15 H22 N O2.5 -","- C120 H176 N8 O20 -","8","1","","Griesbeck, Axel G.; Heckroth, Heike; Lex, Johann","Stereoselective Yang cyclizations of α-amido ketones","Chemical Communications","1999","","12","1109","","10.1039/a901723b","","","0.71073","MoKa","","0.1256","0.0581","","0.1422","0.1175","","","","1.029","1.221","1.221","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110520","7.459","0.001","11.632","0.002","15.652","0.003","90","","102.67","0.02","90","","1324.9","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H19 N O2 -","- C14 H19 N O2 -","- C56 H76 N4 O8 -","4","1","","Griesbeck, Axel G.; Heckroth, Heike; Lex, Johann","Stereoselective Yang cyclizations of α-amido ketones","Chemical Communications","1999","","12","1109","","10.1039/a901723b","","","0.71069","MoKa","","0.141","0.0638","","0.1719","0.1189","","","","1.111","1.183","1.183","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110521","7.546","0.001","11.848","0.001","15.712","0.001","90","","90","","90","","1404.7","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H21 N O2 -","- C15 H21 N O2 -","- C60 H84 N4 O8 -","4","1","","Griesbeck, Axel G.; Heckroth, Heike; Lex, Johann","Stereoselective Yang cyclizations of α-amido ketones","Chemical Communications","1999","","12","1109","","10.1039/a901723b","","","0.71073","MoKa","","0.1001","0.0502","","0.1158","0.099","","","","1.011","1.133","1.133","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110522","13.2226","0.0002","10.9412","0.0002","20.9116","0.0003","90","","100.302","0.001","90","","2976.53","0.08","293","2","293","2","","","","","","","Paul Kelly","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H28 Cl2 N4 Pt S2 -","- C28 H28 Cl2 N4 Pt S2 -","- C112 H112 Cl8 N16 Pt4 S8 -","4","1","","Kelly, Paul F.; Slawin, Alexandra M. Z.","Formation of the bidentate [Ph2SNC(Me)N(H)] ligand by metal-assisted sulfimide addition to acetonitrile; X-ray crystal structure of [Pt(Ph2SNH)(Ph2SNC(Me)NH)Cl]Cl·MeCN","Chemical Communications","1999","","12","1081","","10.1039/a901783f","","","0.71073","MoKα","","0.046","0.0268","","0.0569","0.0486","","","","0.96","1.017","1.017","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110523","6.569","0.005","7.732","0.001","8.031","0.002","104.09","0.01","93.94","0.04","90.04","0.03","394.6","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C Ag3 N3 O6 S -","- C Ag3 N3 O6 S -","- C2 Ag6 N6 O12 S2 -","2","1","","Guo, Guo-Cong; Mak, Thomas C. W.","Unprecedented μ-1,2,3κS:4,5κN coordination mode of the thiocyanate anion in two new double salts of silver(I), AgSCN·2AgNO3 and AgSCN·AgClO4","Chemical Communications","1999","","9","813","","10.1039/a901876j","","","0.71073","MoKα","","0.0734","0.0394","","0.0791","0.069","","","","0.846","0.99","0.99","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110524","15.294","0.004","4.7655","0.001","18.278","0.004","90","","109.89","0.02","90","","1252.7","0.5","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C Ag2 Cl N O4 S -","- C Ag2 Cl N O4 S -","- C8 Ag16 Cl8 N8 O32 S8 -","8","1","","Guo, Guo-Cong; Mak, Thomas C. W.","Unprecedented μ-1,2,3κS:4,5κN coordination mode of the thiocyanate anion in two new double salts of silver(I), AgSCN·2AgNO3 and AgSCN·AgClO4","Chemical Communications","1999","","9","813","","10.1039/a901876j","","","0.71073","MoKα","","0.0668","0.0642","","0.193","0.1884","","","","1.113","1.116","1.116","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110525","8.201","0.003","9.0538","0.0016","20.266","0.002","90","","91.648","0.017","90","","1504.1","0.6","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 N3 O P -","- C16 H18 N3 O P -","- C64 H72 N12 O4 P4 -","4","1","","He, Zhengjie; Modro, Tomasz A.; Van Rooyen, Petrus H.; Bourne, Susan A.","Metallation-induced migration of phosphorus from nitrogen to carbon in 1-oxo-2,8-diphenyl-2,5,8-triaza-1λ5-phosphabicyclo[3.3.0]octane: unusual bonding parameters of the double migration product","Chemical Communications","1999","","9","853","","10.1039/a901877h","","","0.7107","MoKα","","0.1155","0.0776","","","0.1833","0.198","","","","","","1.145","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110526","13.959","0.003","13.773","0.002","16.077","0.004","90","","113.44","0.03","90","","2835.8","1.2","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H36 N6 O2 P2 -","- C32 H36 N6 O2 P2 -","- C128 H144 N24 O8 P8 -","4","1","","He, Zhengjie; Modro, Tomasz A.; Van Rooyen, Petrus H.; Bourne, Susan A.","Metallation-induced migration of phosphorus from nitrogen to carbon in 1-oxo-2,8-diphenyl-2,5,8-triaza-1λ5-phosphabicyclo[3.3.0]octane: unusual bonding parameters of the double migration product","Chemical Communications","1999","","9","853","","10.1039/a901877h","","","0.7107","MoKα","","0.1479","0.0602","","","0.1457","0.1653","","","","","","0.91","","","","has coordinates,has disorder","180219","2020-10-21","18:00:00",""
"7110527","5.849","0.002","31.36","0.2","9.436","0.006","90","","93.86","0.0005","90","","1727","11","50","2","50","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 F6 N2 O2 -","- C16 H20 F6 N2 O2 -","- C64 H80 F24 N8 O8 -","4","1","","Rajca, Andrzej; Lu, Kan; Rajca, Suchada; Ross II, Charles R.","Singlet‒triplet bistability in a 1,3-phenylene-based bis(aminoxyl) diradical","Chemical Communications","1999","","13","1249","","10.1039/a901906e","","","0.5608","AgKα","","0.0696","0.0502","","","0.1095","0.1168","","","","","","1.079","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110528","19.265","0.006","19.952","0.003","28.991","0.012","90","","104.88","0.02","90","","10770","6","293","2","188","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C64 H67 Li N4 O Zr -","- C65 H64 Li N4 O Zr -","- C520 H512 Li8 N32 O8 Zr8 -","8","1","","Kim, Hee-Joon; Jung, Sungkyung; Jeon, You-Moon; Whang, Dongmok; Kim, Kimoon","Novel η1-alkynyl zirconium porphyrin complexes: synthesis and characterization of (por)Zr(η1-CCR)3Li(THF) [por = octaethylporphyrinato (oep) or tetraphenylporphyrinato dianion (tpp); R = Ph, SiMe3]","Chemical Communications","1999","","11","1033","","10.1039/a901923e","","","0.71073","MoKa","","0.0701","0.0535","","","0.1239","0.1331","","","","","","1.039","","","","has coordinates,has disorder","180219","2020-10-21","18:00:00",""
"7110529","8.8436","0.0005","11.6692","0.0015","8.7056","0.0008","107.369","0.009","91.648","0.007","106.53","0.007","815.63","0.15","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C18 H36 F6 O6 Ru S2 Se6 -","- C18 H36 F6 O6 Ru S2 Se6 -","- C18 H36 F6 O6 Ru S2 Se6 -","1","0.5","","Levason, William; Orchard, Simon D.; Reid, Gillian","[Ru{MeC(CH2EMe)3}2](CF3SO3)2: the first homoleptic hexaseleno- and hexatelluro-ether complexes","Chemical Communications","1999","","12","1071","","10.1039/a901930h","","","0.71073","MoKα","","0.0539","0.0373","","","0.1011","0.1106","","","","","","1.032","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110530","7.698","0.002","11.321","0.002","11.356","0.002","90","","105.26","0.01","90","","954.8","0.3","173","2","173","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C11 H27 F6 N3 S Si -","- C11 H27 F6 N3 S Si -","- C22 H54 F12 N6 S2 Si2 -","2","0.5","","Kolomeitsev, Alexander; Movchun, Valery; Rusanov, Eduard; Bissky, German; Lork, Enno; Röschenthaler, Gerd-Volker; Kirsch, Peer","Different fluoride anion sources and (trifluoromethyl)trimethylsilane: molecular structure of tris(dimethylamino)sulfonium bis(trifluoromethyl)trimethylsiliconate, the first isolated pentacoordinate silicon species with five Si‒C bonds","Chemical Communications","1999","","11","1017","","10.1039/a901953g","","","0.71073","MoKα","","0.0774","0.0476","","","0.1002","0.1157","","","","","","1.064","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110531","17.9384","0.0012","16.7894","0.0012","25.764","0.002","90","","91.176","0.009","90","","7757.8","1","223","2","223","2","","","","","","","","6","A 1 2/n 1","-A 2yab","15","","","","- C42 H117 Fe2 N24 Ni3 O22.5 -","- C42 H68 Fe2 N24 Ni3 O22.5 -","- C168 H272 Fe8 N96 Ni12 O90 -","4","0.5","","Colacio, Enrique; Domínguez-Vera, José M.; Ghazi, Mustapha; Moreno, José M.; Kivekäs, Raikko; Lloret, Francesc; Stoeckli-Evans, Helen","A novel two-dimensional honeycomb-like bimetallic iron(III)‒nickel(II) cyanide-bridged magnetic material [Ni(cyclam)]3[Fe(CN)6]2·nH2O(cyclam = 1,4,8,11-tetraazacyclodecane)","Chemical Communications","1999","","11","987","","10.1039/a902041a","","","0.71073","MoKα","","0.0785","0.0457","","0.1466","0.1326","","","","0.958","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110532","27.384","0.003","14.3128","0.0011","8.4772","0.0008","90","","90.176","0.013","90","","3322.6","0.5","193","2","193","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C42 H96 Fe2 N24 Ni3 O12 -","- C42 H60 Fe2 N24 Ni3 O12 -","- C84 H120 Fe4 N48 Ni6 O24 -","2","0.25","","Colacio, Enrique; Domínguez-Vera, José M.; Ghazi, Mustapha; Moreno, José M.; Kivekäs, Raikko; Lloret, Francesc; Stoeckli-Evans, Helen","A novel two-dimensional honeycomb-like bimetallic iron(III)‒nickel(II) cyanide-bridged magnetic material [Ni(cyclam)]3[Fe(CN)6]2·nH2O(cyclam = 1,4,8,11-tetraazacyclodecane)","Chemical Communications","1999","","11","987","","10.1039/a902041a","","","0.71073","MoKα","","0.1363","0.0764","","","0.184","0.2071","","","","","","0.831","","","","has coordinates,has disorder","180219","2020-10-21","18:00:00",""
"7110533","19.322","0.002","24.641","0.003","16.05","0.002","90","","108.759","0.008","90","","7235.7","1.5","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","(beta-CD/coumarin) dodecahydrate","(beta-CD/coumarin) dodecahydrate","","- C55.5 H103 O50 -","- C55.5 H47 O50 -","- C222 H188 O200 -","4","1","","Brett, Tom J.; Alexander, Jennifer M.; Clark, Joanna L.; Ross, II, Charles R.; Harbison, Gerard S.; Stezowski, John J.","Chemical insight from crystallographic disorder: structural studies of a supramolecular β-cyclodextrin/coumarin photochemical system","Chemical Communications (Cambridge, United Kingdom)","1999","","14","1275","1276","10.1039/a902092f","","","0.71073","MoKα","","0.1569","0.0893","","","0.2037","0.2342","","","","","","1.239","","","","has coordinates,has disorder","209518","2020-10-21","18:00:00",""
"7110534","10.512","","11.81","","11.012","","90","","91.163","0.001","90","","1366.82","0.0005","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","syn HH coumarin dimer","","","- C18 H12 O4 -","- C18 H12 O4 -","- C72 H48 O16 -","4","1","","Brett, Tom J.; Alexander, Jennifer M.; Clark, Joanna L.; Ross, II, Charles R.; Harbison, Gerard S.; Stezowski, John J.","Chemical insight from crystallographic disorder: structural studies of a supramolecular β-cyclodextrin/coumarin photochemical system","Chemical Communications (Cambridge, United Kingdom)","1999","","14","1275","1276","10.1039/a902092f","","","0.5608","AgKα","","0.0633","0.0533","","","0.1365","0.1441","","","","","","1.091","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110535","20.1096","0.0003","20.1096","0.0003","13.2079","0.0003","90","","90","","120","","4625.63","0.14","123","1","123","1","","","","","","","","6","P 31","P 31","144","","[{lanthanum(18-crown-6)tris-hydrate}{(diprotonated-p- sulfonatocalix[4]arene)}][chloride][decahydrate]","","- C40 H72 Cl La O35 S4 -","- C40 H40 Cl La O35 S4 -","- C120 H120 Cl3 La3 O105 S12 -","3","1","","Drljaca, Alexander; Hardie, Michaele J.; Raston, Colin L.; Webb, Helen R.; Johnson, Julian A.","Lanthanum(III) capture of 18-crown-6 in the cavity of p-sulfonatocalix[4]arene","Chemical Communications","1999","","12","1135","","10.1039/a902095k","","","0.71073","MoKα","","0.0721","0.0591","","","0.1592","0.172","","","","","","1.038","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110536","10.9916","0.0003","14.8774","0.0005","15.3517","0.0006","63.836","0.001","86.583","0.002","80.499","0.002","2222.03","0.13","123","1","123","1","","","","","","","","6","P -1","-P 1","2","[Cr2(OH)2(H2O)8][H4(1,4,8,11-tetraazacyclodecane)][{(p- sulfonatocalix[4]arene)2}].6(H2O)","","","- C33 H77 Cr N2 O27 S4 -","- C33 H26 Cr N2 O27 S4 -","- C66 H52 Cr2 N4 O54 S8 -","2","1","","Airey, Samantha; Drljaca, Alexander; Hardie, Michaele J.; Raston, Colin L.","Cyclam as a supramolecular synthon: infinite stacked arrays to encapsulation in superanions","Chemical Communications","1999","","12","1137","","10.1039/a902124h","","","0.71073","MoKα","","0.2347","0.1644","","","0.3927","0.4139","","","","","","2.277","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110537","9.832","0.002","9.8549","0.0016","25.692","0.006","90","","93.4","0.02","90","","2485","0.9","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 Al4 Cl4 F8 -","- C16 H12 Al4 Cl4 F8 -","- C64 H48 Al16 Cl16 F32 -","4","1","","Tschinkl, Martin; Gabbaï, François P.; Bachman, Robert E.","1,2-Bis(chloromethylalumino)tetrafluorobenzene, an aluminium-based bifunctional Lewis acid with a perfluorinated backbone","Chemical Communications","1999","","15","1367","","10.1039/a902127b","","","0.71073","MoKα","","0.0662","0.0359","","","0.0779","0.087","","","","","","1.014","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110538","14.4444","0.0015","16.998","0.003","27.623","0.003","90","","99.941","0.013","90","","6680.3","1.6","220","2","220","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","5,5''-Bis{((5-cyclopentadienyl)-[(6-(4,7-di-n-butylbenzo[b]thien-2-yl)] -ruthenium}-2,2':5',2''-terthiophene bishexafluorophosphate","","- C54 H58 F12 P2 Ru2 S5 -","- C108 H116 F24 P4 Ru4 S10 -","- C216 H232 F48 P8 Ru8 S20 -","2","0.25","","Grüner, Gerhard; Bäuerle, Peter; Debaerdemaeker, Tony","First crystallographic structure determination of an oligothiophene metal π-complex","Chemical Communications","1999","","12","1097","","10.1039/a902249j","","","0.71073","MoKα","","0.1789","0.0937","","","0.2276","0.2585","","","","","","0.784","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110539","10.806","0.001","17.408","0.002","25.199","0.002","81.432","0.007","82.688","0.007","88.139","0.007","4648.7","0.8","301.2","","301.2","","","","","","","","","9","P -1","-P 1","2","","","","- C43 H28 Cl2 Cu F6 N4 O6 P Re2 -","- C43 H28 Cl2 Cu F6 N4 O6 P Re2 -","- C172 H112 Cl8 Cu4 F24 N16 O24 P4 Re8 -","4","2","","Yam, Vivian Wing-Wah; Chong, Samuel Hung-Fai; Wong, Keith Man-Chung; Cheung, Kung-Kai","Synthesis and luminescence behaviour of mixed-metal rhenium(I)‒copper(I) and ‒silver(I) alkynyl complexes. X-Ray crystal structures of [{η2-Re(CO)3(bpy)(CCPh)}2Cu]PF6 and [{η2-Re(CO)3(bpy)(CCPh)}2Ag]PF6","Chemical Communications","1999","","11","1013","","10.1039/a902273b","","","0.7107","MoKalpha","","","0.0324","","","0.0448","","","","","1.456","1.456","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110540","11.485","0.001","13.368","0.001","17.259","0.001","102.048","0.006","107.155","0.006","103.476","0.006","2349.9","0.3","301.2","","301.2","","","","","","","","","8","P -1","-P 1","2","","","","- C45 H32 Ag F6 N4 O7 P Re2 -","- C45 H32 Ag F6 N4 O7 P Re2 -","- C90 H64 Ag2 F12 N8 O14 P2 Re4 -","2","1","","Yam, Vivian Wing-Wah; Chong, Samuel Hung-Fai; Wong, Keith Man-Chung; Cheung, Kung-Kai","Synthesis and luminescence behaviour of mixed-metal rhenium(I)‒copper(I) and ‒silver(I) alkynyl complexes. X-Ray crystal structures of [{η2-Re(CO)3(bpy)(CCPh)}2Cu]PF6 and [{η2-Re(CO)3(bpy)(CCPh)}2Ag]PF6","Chemical Communications","1999","","11","1013","","10.1039/a902273b","","","0.7107","MoKalpha","","","0.0258","","","0.0336","","","","","1.332","1.332","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110541","9.5433","0.0009","11.656","0.001","12.775","0.001","100.544","0.002","110.146","0.001","97.299","0.002","1283.47","0.19","203","2","203","2","","","","","","","","4","P -1","-P 1","2","tris[3,5-bis(trifluoromethyl)phenyl]borane","","","- C24 H9 B F18 -","- C24 H9 B F18 -","- C48 H18 B2 F36 -","2","1","","Konze, Wayde V.; Scott, Brian L.; Kubas, Gregory J.","First example of B‒C bond cleavage in the BArF (B[C6H3(CF3)2-3,5]4) anion mediated by a transition metal species, trans-[(Ph3P)2Pt(Me)(OEt2)]+","Chemical Communications","1999","","18","1807","","10.1039/a902274k","","","0.71073","MoKα","","0.1085","0.0628","","","0.1582","0.182","","","","","","0.958","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110542","11.3973","0.0006","11.4539","0.0005","12.826","0.0006","105.675","0.001","111.466","0.001","103.393","0.001","1394.47","0.12","203","2","203","2","","","","","","","","5","P -1","-P 1","2","bis(triphenylphosphine)bis[3,5-bis(trifluoromethyl)phenyl]platinum","","","- C64 H48 F12 P2 Pt -","- C64 H48 F12 P2 Pt -","- C64 H48 F12 P2 Pt -","1","0.5","","Konze, Wayde V.; Scott, Brian L.; Kubas, Gregory J.","First example of B‒C bond cleavage in the BArF (B[C6H3(CF3)2-3,5]4) anion mediated by a transition metal species, trans-[(Ph3P)2Pt(Me)(OEt2)]+","Chemical Communications","1999","","18","1807","","10.1039/a902274k","","","0.71073","MoKα","","0.0186","0.0186","","","0.0473","0.0473","","","","","","1.043","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110543","8.4863","0.0013","8.7703","0.0014","15.43","0.003","90","","98.74","0.003","90","","1135.1","0.3","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H16 O2 S8 -","- C20 H16 O2 S8 -","- C40 H32 O4 S16 -","2","1","","Tsiperman, Evgeny; Regev, Tal; Becker, James Y.; Bernstein, Joel; Ellern, Arkady; Khodorkovsky, Vladimir; Shames, Alex; Shapiro, Lev","Synthesis of a novel rigid tetrathiafulvalene-σ-p-benzoquinone diad (TTF-σ-Q) with inherent structural configuration suitable for intramolecular charge-transfer","Chemical Communications","1999","","12","1125","","10.1039/a902277e","","","0.71073","MoKα","","0.0864","0.0404","","","0.062","0.0697","","","","","","0.812","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110544","8.2377","0.0007","5.965","0.0006","15.0893","0.001","90","","94.986","0.008","90","","738.65","0.11","293","","293","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","complex of 4,4'-bipyridine and 2,5-dichloro-3,6-dihydroxy-1,4-benzoquinone","","- C16 H10 Cl2 N2 O4 -","- C16 H10 Cl2 N2 O4 -","- C32 H20 Cl4 N4 O8 -","2","0.5","","Zaman, Md. Badruz; Tomura, Masaaki; Yamashita, Yoshiro","Novel supramolecular synthon in crystal engineering: ionic complexes of 4,4'-bipyridine and 1,2-bis(2-pyridyl)ethylene with 2,5-dichloro-3,6-dihydroxy-1,4-benzoquinone","Chemical Communications (Cambridge, United Kingdom)","1999","","11","999","1000","10.1039/a902305d","","","1.54178","CuKα","","0.0506","0.0366","","0.1112","0.0932","","","","1.057","1.067","1.067","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110545","9.855","0.001","11.245","0.001","3.9057","0.0006","91.34","0.01","99.69","0.01","111.702","0.008","394.67","0.09","293","","293","","","","","","","","","5","P -1","-P 1","2","","complex of trans-1,2-bis(2-pyridyl)ethylene and 2,5-dichloro-3,6-dihydroxy-1,4-benzoquinone","","- C18 H12 Cl2 N2 O4 -","- C18 H12 Cl2 N2 O4 -","- C18 H12 Cl2 N2 O4 -","1","0.5","","Zaman, Md. Badruz; Tomura, Masaaki; Yamashita, Yoshiro","Novel supramolecular synthon in crystal engineering: ionic complexes of 4,4'-bipyridine and 1,2-bis(2-pyridyl)ethylene with 2,5-dichloro-3,6-dihydroxy-1,4-benzoquinone","Chemical Communications (Cambridge, United Kingdom)","1999","","11","999","1000","10.1039/a902305d","","","0.7107","MoKα","","0.0332","0.0332","","","0.0336","0.0336","","","","","","1.242","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110546","10.63","0.001","17.201","0.001","17.3","0.001","100.001","0.001","90.737","0.001","104.343","0.001","3012.9","0.4","","","","","","","","","","","","7","P -1","-P 1","2","","6,6-Bis(3-dimethylaminopropyl)-2,2,6-triphenyl- 1,3,5-trioxa-2-sila-4-stanna-6-boracyclohexane","","- C30 H52 B N2 O3 Si Sn -","- C28 H39 B N2 O3 Si Sn -","- C112 H156 B4 N8 O12 Si4 Sn4 -","4","2","","Beckmann, Jens; Jurkschat, Klaus; Pieper, Nicole; Schürmann, Markus","The first organoelement oxides containing three different metals; synthesis and structure of (Ph2SiOR2SnOMO) [R = (CH2)3NMe2; M = But2Sn, But2Ge, PhB]† ‡","Chemical Communications","1999","","12","1095","","10.1039/a902428j","","","","MoKα","","0.0521","0.0311","","","0.0735","0.0796","","","","","","0.999","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110547","9.19","0.001","10.833","0.001","17.73","0.001","80.144","0.001","89.614","0.001","86.402","0.001","1735.6","0.3","","","","","","","","","","","","7","P -1","-P 1","2","","6,6-Bis(3-dimethylaminopropyl)-4,4-di-t-butyl-2,2-diphenyl- 1,3,5-trioxa-2-sila-4-germa-6-stannacyclohexane","","- C30 H52 Ge N2 O3 Si Sn -","- C30 H52 Ge N2 O3 Si Sn -","- C60 H104 Ge2 N4 O6 Si2 Sn2 -","2","1","","Beckmann, Jens; Jurkschat, Klaus; Pieper, Nicole; Schürmann, Markus","The first organoelement oxides containing three different metals; synthesis and structure of (Ph2SiOR2SnOMO) [R = (CH2)3NMe2; M = But2Sn, But2Ge, PhB]† ‡","Chemical Communications","1999","","12","1095","","10.1039/a902428j","","","","MoKα","","0.0629","0.0307","","","0.0604","0.0664","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110548","9.302","0.001","10.824","0.001","17.897","0.001","81.611","0.001","88.994","0.001","85.935","0.001","1778.1","0.3","","","","","","","","","","","","6","P -1","-P 1","2","","6,6-Bis(3-dimethylaminopropyl)-4,4-di-t-butyl-2,2-diphenyl- 1,3,5-trioxa-2-sila-4,6-distannacyclohexane","","- C30 H52 N2 O3 Si Sn2 -","- C30 H52 N2 O3 Si Sn2 -","- C60 H104 N4 O6 Si2 Sn4 -","2","1","","Beckmann, Jens; Jurkschat, Klaus; Pieper, Nicole; Schürmann, Markus","The first organoelement oxides containing three different metals; synthesis and structure of (Ph2SiOR2SnOMO) [R = (CH2)3NMe2; M = But2Sn, But2Ge, PhB]† ‡","Chemical Communications","1999","","12","1095","","10.1039/a902428j","","","","MoKα","","0.0768","0.036","","","0.0748","0.0815","","","","","","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110549","22.7866","0.0012","22.7866","0.0012","12.8738","0.0009","90","","90","","120","","5788.9","0.6","298","2","298","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C36 H84 Ag7 O12 P6 Se12.5 -","- C36 Ag6.994 O12 P6 Se12.497 -","- C108 Ag20.982 O36 P18 Se37.491 -","3","0.166667","","Liu, C. W.; Shang, Iu-Jie; Wang, Ju-Chung; Keng, Tai-Chiun","Metal dialkyl diselenophosphates:1 a rare example of co-crystallization with clusters, Ag8(μ8-Se)[Se2P(OPri)2]6 and Ag6[Se2P(OPri)2]6, superimposing in a trigonal lattice†","Chemical Communications","1999","","11","995","","10.1039/a902429h","","","0.71073","MoKα","","0.0446","0.0382","","0.0992","","0.0943","","","1.069","","","1.082","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110550","13.402","0.005","14.735","0.003","14.15","0.003","90","","103.48","0.02","90","","2717.3","1.3","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H38 Cl2 O6 P2 Pd -","- C23 H38 Cl2 O6 P2 Pd -","- C92 H152 Cl8 O24 P8 Pd4 -","4","1","","Gee, Victoria; Guy Orpen, A.; Phetmung, Hirihattaya; Pringle, Paul G.; Pugh, Robert I.","Bis(phospha-adamantyl)alkanes: a new class of very bulky diphosphines","Chemical Communications","1999","","10","901","","10.1039/a902434d","","","0.71073","MoKα","","0.0832","0.0595","","0.1596","0.1387","","","","1.127","1.12","1.12","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110551","13.142","0.002","11.987","0.002","22.167","0.003","90","","102.419","0.008","90","","3410.3","0.9","173","2","173","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C24 H27 Cl5 F12 O6 P2 Pd -","- C24 H27 Cl5 F12 O6 P2 Pd -","- C96 H108 Cl20 F48 O24 P8 Pd4 -","4","1","","Gee, Victoria; Guy Orpen, A.; Phetmung, Hirihattaya; Pringle, Paul G.; Pugh, Robert I.","Bis(phospha-adamantyl)alkanes: a new class of very bulky diphosphines","Chemical Communications","1999","","10","901","","10.1039/a902434d","","","0.71073","MoKα","","0.0304","0.0251","","0.0656","0.0558","","","","0.885","0.906","0.906","","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110552","17.491","0.003","12.133","0.002","7.347","0.002","90","","90","","90","","1559.2","0.6","173","2","173","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C16 H20 O2 P2 -","- C16 H20 O2 P2 -","- C64 H80 O8 P8 -","4","0.5","","Gee, Victoria; Guy Orpen, A.; Phetmung, Hirihattaya; Pringle, Paul G.; Pugh, Robert I.","Bis(phospha-adamantyl)alkanes: a new class of very bulky diphosphines","Chemical Communications","1999","","10","901","","10.1039/a902434d","","","0.71073","MoKα","","0.0649","0.0466","","0.1008","0.0906","","","","1.083","1.101","1.101","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110553","7.934","0.002","8.2681","0.0012","15.118","0.002","85.449","0.013","87.77","0.02","76.846","0.012","962.4","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C16 H20 Au2 Cl2 O2 P2 -","- C16 H20 Au2 Cl2 O2 P2 -","- C32 H40 Au4 Cl4 O4 P4 -","2","1","","Gee, Victoria; Guy Orpen, A.; Phetmung, Hirihattaya; Pringle, Paul G.; Pugh, Robert I.","Bis(phospha-adamantyl)alkanes: a new class of very bulky diphosphines","Chemical Communications","1999","","10","901","","10.1039/a902434d","","","0.71073","MoKα","","0.0281","0.0203","","0.0598","0.0458","","","","0.854","0.899","0.899","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110554","16.055","0.0002","20.355","0.0004","16.491","0.0003","90","","101.323","0.001","90","","5284.35","0.16","150","0.1","150","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H40 P2 Pb -","- C24 H37.03 P2 Pb -","- C192 H296.24 P16 Pb8 -","8","2","","Forissier, Kareen; Ricard, Louis; Carmichael, Duncan; Mathey, François","2,5-Di-(tert-butyl)phospholyl sandwich complexes containing group 14 elements (Ge, Sn, Pb). Synthesis, molecular structure, and ring transfer chemistry of [M(PC4H2But2)2] (M= Sn, Pb)","Chemical Communications","1999","","14","1273","","10.1039/a902909e","","","0.7107","MoKα","","0.0275","0.0237","","","0.0622","0.0635","","","","","","1.01","","","","has coordinates,has disorder","180219","2020-10-21","18:00:00",""
"7110555","16.046","0.0002","20.328","0.0002","16.374","0.0002","90","","101.089","0.0006","90","","5241.2","0.11","150","0.1","150","0.1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H40 P2 Sn -","- C24 H40 P2 Sn -","- C192 H320 P16 Sn8 -","8","2","","Forissier, Kareen; Ricard, Louis; Carmichael, Duncan; Mathey, François","2,5-Di-(tert-butyl)phospholyl sandwich complexes containing group 14 elements (Ge, Sn, Pb). Synthesis, molecular structure, and ring transfer chemistry of [M(PC4H2But2)2] (M= Sn, Pb)","Chemical Communications","1999","","14","1273","","10.1039/a902909e","","","0.7107","MoKα","","0.0305","0.0278","","","0.0737","0.0754","","","","","","1.034","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110556","10.5688","0.0007","11.082","0.0006","17.918","0.0008","72.784","0.006","88.671","0.007","85.959","0.008","1999.6","0.2","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H66 N2 Pb -","- C41 H66 N2 Pb -","- C82 H132 N4 Pb2 -","2","1","","Stabenow, Frank; Saak, Wolfgang; Weidenbruch, Manfred","A zwitterionic carbene‒plumbylene adduct","Chemical Communications","1999","","12","1131","","10.1039/a902919b","","","0.71073","MoKα","","0.0393","0.0311","","","0.0707","0.0733","","","","","","0.986","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110557","9.6249","0.0001","12.551","0.0002","19.6568","0.0003","96.708","0.001","97.968","0.001","107.02","0.01","2217.39","0.14","203","2","203","2","","","","","","","","8","P -1","-P 1","2","","","","- C46 H46 Cl3 N O Os P2 Sn -","- C46 H46 Cl3 N O Os P2 Sn -","- C92 H92 Cl6 N2 O2 Os2 P4 Sn2 -","2","1","","Rickard, Clifton E. F.; Roper, Warren R.; Woodman, Timothy J.; James Wright, L.","Reversible methyl group migration between osmium and tin in reactions of osmium trimethylstannyl complexes","Chemical Communications","1999","","12","1101","","10.1039/a902938i","","","0.71073","MoKα","","0.0396","0.0384","","","0.0944","0.0954","","","","","","1.066","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110558","9.8497","0.0001","11.9753","0.0002","18.5656","0.0003","95.559","0.001","101.214","0.001","103.598","0.001","2064.37","0.05","203","2","203","2","","","","","","","","7","P -1","-P 1","2","","","","- C43 H44 Cl2 O3 Os P2 Sn -","- C43 H44 Cl2 O3 Os P2 Sn -","- C86 H88 Cl4 O6 Os2 P4 Sn2 -","2","1","","Rickard, Clifton E. F.; Roper, Warren R.; Woodman, Timothy J.; James Wright, L.","Reversible methyl group migration between osmium and tin in reactions of osmium trimethylstannyl complexes","Chemical Communications","1999","","12","1101","","10.1039/a902938i","","","0.71073","MoKα","","0.0567","0.0401","","","0.0721","0.0809","","","","","","1.117","","","","has coordinates,has disorder","180219","2020-10-21","18:00:00",""
"7110559","3.758","0.001","3.758","0.001","3.54","0.001","90","","90","","120","","43.3","0.02","297","2","297","2","","","","","","","","3","P -6 m 2","P -6 2","187","","","","- Li N Ni -","- Li N Ni -","- Li N Ni -","1","0.0833333","","Barker, Marten G.; Blake, Alexander J.; Gregory, Duncan H.; Siddons, Daniel J.; Smith, Susan E.; Edwards, Peter P.; Hamor, Thomas A.","Novel layered lithium nitridonickelates; effect of Li vacancy concentration on N co-ordination geometry and Ni oxidation state","Chemical Communications","1999","","13","1187","","10.1039/a902962a","","","0.71073","MoKα","","0.0623","0.0374","","0.1095","0.0803","","","","1.283","1.283","1.283","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110560","6.475","0.003","6.475","0.003","3.555","0.002","90","","90","","120","","129.08","0.11","293","2","293","2","","","","","","","","3","P -6 2 m","P -6 -2","189","","","","- Li5 N3 Ni3 -","- Li5 N3.96 Ni3 -","- Li5 N3.96 Ni3 -","1","0.0833333","","Barker, Marten G.; Blake, Alexander J.; Gregory, Duncan H.; Siddons, Daniel J.; Smith, Susan E.; Edwards, Peter P.; Hamor, Thomas A.","Novel layered lithium nitridonickelates; effect of Li vacancy concentration on N co-ordination geometry and Ni oxidation state","Chemical Communications","1999","","13","1187","","10.1039/a902962a","","","0.7107","MoKa","","0.0351","0.0351","","0.0884","0.0884","","","","1.229","1.229","1.229","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110561","24.883","0.005","37.424","0.008","11.98","0.009","90","","90","","90","","11156","9","180","2","180","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C48 H88 As4 N8 Na4 -","- C48 H88 As4 N8 Na4 -","- C384 H704 As32 N64 Na32 -","8","1","","Bashall, Alan; McPartlin, Mary; Beswick, Michael A.; Harron, Eilis A.; Hopkins, Alexander D.; Kidd, Sara J.; Raithby, Paul R.; Wright, Dominic S.; Steiner, Alexander","Geometric control of cage architecture; observation of ligand-selective behaviour in the structures of [{As2(NCy)4}2M4] (M = Na, Cu; Cy = C6H11)","Chemical Communications","1999","","12","1145","","10.1039/a903010g","","","0.71073","MoKα","","0.1515","0.1047","","","0.2379","0.2643","","","","","","1.284","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110562","10.799","0.002","17.252","0.004","20.326","0.004","90","","90","","90","","3786.8","1.3","153","2","153","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","1,2-dicarbadodecaborane-imino-tris(dimethylamino)phosphorane adduct","","","- C8 H31 B10 N4 P -","- C8 H31 B10 N4 P -","- C64 H248 B80 N32 P8 -","8","1","","Davidson, Matthew G.; Fox, Mark A.; Hibbert, Thomas G.; Howard, Judith A. K.; Mackinnon, Angus; Neretin, Ivan S.; Wade, Kenneth","Deboronation of ortho-carborane by an iminophosphorane: crystal structures of the novel carborane adduct nido-C2B10H12·HNP(NMe2)3 and the borenium salt [(Me2N)3PNHBNP(NMe2)3]2O2+(C2B9H12−)2","Chemical Communications","1999","","17","1649","","10.1039/a903030a","","","0.71073","MoKα","","0.1681","0.0766","","","0.1457","0.1873","","","","","","1.053","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110563","11.58","0.002","13.182","0.003","12.385","0.002","90","","91.88","0.05","90","","1889.5","0.6","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","tris(dimethylamino)phosphiniminium 7,8-dicarba-nido-undecaborane","","- C8 H32 B9 N4 P -","- C8 H32 B9 N4 P -","- C32 H128 B36 N16 P4 -","4","1","","Davidson, Matthew G.; Fox, Mark A.; Hibbert, Thomas G.; Howard, Judith A. K.; Mackinnon, Angus; Neretin, Ivan S.; Wade, Kenneth","Deboronation of ortho-carborane by an iminophosphorane: crystal structures of the novel carborane adduct nido-C2B10H12·HNP(NMe2)3 and the borenium salt [(Me2N)3PNHBNP(NMe2)3]2O2+(C2B9H12−)2","Chemical Communications","1999","","17","1649","","10.1039/a903030a","","","0.71073","MoKα","","0.0534","0.0435","","","0.1093","0.1178","","","","","","1.091","","","","has coordinates,has disorder","180219","2020-10-21","18:00:00",""
"7110564","14.105","0.003","16.529","0.003","25.563","0.005","90","","90","","90","","5960","2","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","7,8-dicarba-nido-undecaborane borenium salt","","","- C28 H98 B20 N16 O P4 -","- C28 H98 B20 N16 O P4 -","- C112 H392 B80 N64 O4 P16 -","4","1","","Davidson, Matthew G.; Fox, Mark A.; Hibbert, Thomas G.; Howard, Judith A. K.; Mackinnon, Angus; Neretin, Ivan S.; Wade, Kenneth","Deboronation of ortho-carborane by an iminophosphorane: crystal structures of the novel carborane adduct nido-C2B10H12·HNP(NMe2)3 and the borenium salt [(Me2N)3PNHBNP(NMe2)3]2O2+(C2B9H12−)2","Chemical Communications","1999","","17","1649","","10.1039/a903030a","","","0.71073","MoKα","","0.2453","0.0619","","","0.0949","0.1383","","","","","","0.893","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110565","24.82","0.005","20.98","0.004","26.87","0.005","90","","97.24","0.03","90","","13880","5","293","2","200","2","","","","","","","","8","C 1 2/m 1","-C 2y","12","","","","- C20 H134 Mo6 N10 O106 S8 Si2 W22 -","- C14 Mo6 N7 O110 S8 Si2 W22 -","- C56 Mo24 N28 O440 S32 Si8 W88 -","4","0.5","","Müller, Achim; Fedin, Vladimir P.; Kuhlmann, Christoph; Bögge, Hartmut; Hauptfleisch, Björn; Fenske, Heinz-Dieter; Baum, Gerhard","‘Adding’ stable functional complementary, nucleophilic and electrophilic clusters: a synthetic route to [{(SiW11O39)Mo3S4(H2O)3(μ-OH)}2]10− and [{(P2W17O61)Mo3S4(H2O)3(μ-OH)}2]14− as examples","Chemical Communications (Cambridge, United Kingdom)","1999","","13","1189","1190","10.1039/a903170g","","","0.71073","MoKα","","0.0888","0.0505","","","0.1141","0.1301","","","","","","0.903","","","","has coordinates","209523","2020-10-21","18:00:00",""
"7110566","22.419","0.005","15.11","0.003","56.036","0.011","90","","90","","90","","18982","7","183","2","183","2","","","","","","","","8","C m c m","-C 2c 2","63","","","","- C28 H176 Mo6 N14 O155 P4 S8 W34 -","- C20 Mo6 N10 O155 P4 S8 W34 -","- C80 Mo24 N40 O620 P16 S32 W136 -","4","0.25","","Müller, Achim; Fedin, Vladimir P.; Kuhlmann, Christoph; Bögge, Hartmut; Hauptfleisch, Björn; Fenske, Heinz-Dieter; Baum, Gerhard","‘Adding’ stable functional complementary, nucleophilic and electrophilic clusters: a synthetic route to [{(SiW11O39)Mo3S4(H2O)3(μ-OH)}2]10− and [{(P2W17O61)Mo3S4(H2O)3(μ-OH)}2]14− as examples","Chemical Communications (Cambridge, United Kingdom)","1999","","13","1189","1190","10.1039/a903170g","","","0.71073","MoKα","","0.1421","0.1225","","","0.2312","0.2363","","","","","","1.789","","","","has coordinates","209523","2020-10-21","18:00:00",""
"7110567","12.6829","0.0017","10.2903","0.0014","24.527","0.003","90","","98.782","0.003","90","","3163.5","0.7","160","2","160","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C32 H40 Li2 N2 O2 P2 -","- C32 H40 Li2 N2 O2 P2 -","- C128 H160 Li8 N8 O8 P8 -","4","1","","Clegg, William; Liddle, Stephen T.; Davies, Robert P.; Dunbar, Lorraine; Feeder, Neil; Snaith, Ronald; Wheatley, Andrew E. H.; Mulvey, Robert E.","Lithiated organophosphorus enamines: a new synthetic approach and the first crystal structures","Chemical Communications","1999","","15","1401","","10.1039/a903175h","","","0.71073","MoKα","","0.15","0.1039","","","0.2926","0.3095","","","","","","1.078","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110568","16.472","0.002","16.472","0.002","13.664","0.003","90","","90","","90","","3707.4","1","180","2","180","2","","","","","","","","6","P 4/n :2","-P 4a","85","","","","- C18.88 H22.25 Li N O P -","- C18.78 H21 Li N O P -","- C150.24 H168 Li8 N8 O8 P8 -","8","1","","Clegg, William; Liddle, Stephen T.; Davies, Robert P.; Dunbar, Lorraine; Feeder, Neil; Snaith, Ronald; Wheatley, Andrew E. H.; Mulvey, Robert E.","Lithiated organophosphorus enamines: a new synthetic approach and the first crystal structures","Chemical Communications","1999","","15","1401","","10.1039/a903175h","","","0.71073","MoKα","","0.0858","0.0618","","0.2018","0.1774","","","","1.068","1.112","1.112","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110569","27.74","0.006","9.803","0.002","20.206","0.004","90","","130.69","0.03","90","","4166","2","180","2","180","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H29 Li N2 O P -","- C21 H29 Li N2 O P -","- C168 H232 Li8 N16 O8 P8 -","8","1","","Clegg, William; Liddle, Stephen T.; Davies, Robert P.; Dunbar, Lorraine; Feeder, Neil; Snaith, Ronald; Wheatley, Andrew E. H.; Mulvey, Robert E.","Lithiated organophosphorus enamines: a new synthetic approach and the first crystal structures","Chemical Communications","1999","","15","1401","","10.1039/a903175h","","","0.71073","MoKα","","0.1363","0.0634","","","0.1201","0.1464","","","","","","0.96","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110570","21.242","0.003","6.219","0.002","20.254","0.002","90","","93.05","0.01","90","","2671.8","1","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C15 H5 F9 O -","- C15 H5 F9 O -","- C120 H40 F72 O8 -","8","1","","Batsanov, Andrei S.; Brooke, Gerald M.; Holling, Darren; Kenwright, Alan M.","Pyrolysis reactions of 4-nonafluorobiphenyl prop-2-enyl ether: a remarkable rearrangement reaction","Chemical Communications","1999","","16","1549","","10.1039/a903209f","","","1.54184","CuKα","","0.0504","0.0367","","","0.0977","0.1061","","","","","","1.034","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110571","13.4461","0.0015","11.0332","0.0014","19.2485","0.0013","90","","108.413","0.006","90","","2709.4","0.5","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C15 H5 F9 O -","- C15 H5 F9 O -","- C120 H40 F72 O8 -","8","2","","Batsanov, Andrei S.; Brooke, Gerald M.; Holling, Darren; Kenwright, Alan M.","Pyrolysis reactions of 4-nonafluorobiphenyl prop-2-enyl ether: a remarkable rearrangement reaction","Chemical Communications","1999","","16","1549","","10.1039/a903209f","","","1.54184","CuKα","","0.0648","0.0462","","","0.1","0.1086","","","","","","1.094","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110572","31.687","0.005","13.955","0.002","19.383","0.002","90","","95.193","0.015","90","","8536","2","143","2","143","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C27.5 H58 I6 P2 Se2 -","- C27.5 H58 I6 P2 Se2 -","- C220 H464 I48 P16 Se16 -","8","1","","Seppälä, Emma; Ruthe, Frank; Jeske, Jörg; du Mont, Wolf-W.; Jones, Peter G.","Coordination and oxidation of phosphine selenides with iodine: from cation pairs [(R3PSe)2I+]2 to (iodoseleno)phosphonium ions [R3PSeI]+ existing as guests in polyiodide matrices","Chemical Communications","1999","","16","1471","","10.1039/a903249e","","","0.71073","MoKα","","0.0614","0.0519","","0.1541","0.133","","","","1.155","1.185","1.185","","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110573","12.6693","0.001","16.4329","0.0012","25.2272","0.0018","90","","90","","90","","5252.1","0.7","143","2","143","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H25 I7 P Se -","- C11 H25 I7 P Se -","- C88 H200 I56 P8 Se8 -","8","2","","Seppälä, Emma; Ruthe, Frank; Jeske, Jörg; du Mont, Wolf-W.; Jones, Peter G.","Coordination and oxidation of phosphine selenides with iodine: from cation pairs [(R3PSe)2I+]2 to (iodoseleno)phosphonium ions [R3PSeI]+ existing as guests in polyiodide matrices","Chemical Communications","1999","","16","1471","","10.1039/a903249e","","","0.71073","MoKα","","0.0351","0.0249","","","0.0368","0.038","","","","","","0.893","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110574","50.655","0.003","15.5224","0.0011","12.5356","0.0008","90","","90","","90","","9856.6","1.1","143","2","143","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C9 H21 I7 P Se -","- C9 H21 I7 P Se -","- C144 H336 I112 P16 Se16 -","16","4","","Seppälä, Emma; Ruthe, Frank; Jeske, Jörg; du Mont, Wolf-W.; Jones, Peter G.","Coordination and oxidation of phosphine selenides with iodine: from cation pairs [(R3PSe)2I+]2 to (iodoseleno)phosphonium ions [R3PSeI]+ existing as guests in polyiodide matrices","Chemical Communications","1999","","16","1471","","10.1039/a903249e","","","0.71073","MoKα","","0.091","0.0585","","","0.1093","0.118","","","","","","0.952","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110575","20.4759","0.0012","22.0944","0.0012","11.443","0.0004","90","","90","","90","","5176.8","0.5","293","2","183","2","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C13 H21 N O -","- C13 H21 N O -","- C208 H336 N16 O16 -","16","1","","Berger, Daniel; Imhof, Wolfgang","One-pot synthesis of γ-lactams in a reaction cascade from α,β-unsaturated imines, CO and ethylene catalysed by Ru3(CO)12†","Chemical Communications","1999","","16","1457","","10.1039/a903266e","","","0.71073","MoKα","","0.0634","0.0562","","0.1547","0.1395","","","","1.081","1.102","1.102","","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110576","16.3458","0.0017","7.3848","0.0005","6.8236","0.0007","90","","112.032","0.004","90","","763.53","0.12","200","0.1","200","0.1","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C4 H4 Mn N8 -","- C4 H4 Mn N8 -","- C16 H16 Mn4 N32 -","4","1","","Manson, Jamie L.; Arif, Atta M.; Miller, Joel S.","MnII(N3)2(pyrazine). A 2-D layered structure consisting of ferromagnetically coupled 1-D {Mn(μ-1,1-N3)2}n chains","Chemical Communications","1999","","16","1479","","10.1039/a903406d","","","0.71073","MoKα","","0.077","0.0625","","","0.1659","0.1823","","","","","","1.038","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110577","27.7834","0.0015","17.0909","0.0009","27.0849","0.0014","90","","107.147","0.0012","90","","12289.4","1.1","298","2","298","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C97 H91 Cl11 F19 Mo6 N3 O17 P6 -","- C97 H80 Cl11 F19 Mo6 N3 O17 P6 -","- C388 H320 Cl44 F76 Mo24 N12 O68 P24 -","4","0.5","","Suen, Maw-Cherng; Tseng, Gwo-Wei; Chen, Jhy-Der; Keng, Tai-Chiun; Wang, Ju-Chun","Novel cyclic hexanuclear complexes containing quadruply bonded units joined by μ6-carbonate ions","Chemical Communications","1999","","13","1185","","10.1039/a903410b","","","0.71073","MoKα","","0.0882","0.062","","","0.0722","0.0796","","","","","","1.59","","","","has coordinates,has disorder","180219","2020-10-21","18:00:00",""
"7110578","27.5726","0.0015","17.2035","0.0009","27.301","0.0015","90","","106.462","0.001","90","","12419.2","1.2","298","2","298","2","","","","","","","","9","C 1 2/c 1","-C 2yc","15","","","","- C97 H91 Br3 Cl8 F19 Mo6 N3 O17 P6 -","- C97 H70 Br3 Cl8 F19 Mo6 N3 O17 P6 -","- C388 H280 Br12 Cl32 F76 Mo24 N12 O68 P24 -","4","0.5","","Suen, Maw-Cherng; Tseng, Gwo-Wei; Chen, Jhy-Der; Keng, Tai-Chiun; Wang, Ju-Chun","Novel cyclic hexanuclear complexes containing quadruply bonded units joined by μ6-carbonate ions","Chemical Communications","1999","","13","1185","","10.1039/a903410b","","","0.71073","MoKα","","0.0667","0.0555","","","0.0754","0.0794","","","","","","1.82","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110579","29.983","0.0016","17.3359","0.0009","23.5145","0.0012","90","","114.462","0.001","90","","11125.3","1","298","2","298","2","","","","","","","","8","C 1 2/c 1","-C 2yc","15","","","","- C93 H75 F19 I3 Mo6 N7 O15 P6 -","- C93 H50 F19 I3 Mo6 N7 O15 P6 -","- C372 H200 F76 I12 Mo24 N28 O60 P24 -","4","0.5","","Suen, Maw-Cherng; Tseng, Gwo-Wei; Chen, Jhy-Der; Keng, Tai-Chiun; Wang, Ju-Chun","Novel cyclic hexanuclear complexes containing quadruply bonded units joined by μ6-carbonate ions","Chemical Communications","1999","","13","1185","","10.1039/a903410b","","","0.71073","MoKα","","0.068","0.0561","","","0.0683","0.0714","","","","","","1.92","","","","has coordinates,has disorder","180219","2020-10-21","18:00:00",""
"7110580","6.5364","0.0006","10.81","0.0012","11.7511","0.0012","79.96","0.005","85.799","0.006","88.868","0.006","815.38","0.14","150","","150","","","","","","","","see text","4","P -1","-P 1","2","","","","- C15 H20 N4 O6 -","- C15 H20 N4 O6 -","- C30 H40 N8 O12 -","2","1","","Lipkowski, Piotr; Bielejewska, Anna; Timmerman, Peter; Reinhoudt, David N.; Kooijman, Huub; Spek, Anthony L.","Self-assembly of a [2 × 2] hydrogen bonded grid","Chemical Communications","1999","","14","1311","","10.1039/a903446c","","","0.71073","MoKα","","0.0333","0.0317","","","0.0882","0.0898","","","","","","1.023","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110581","9.028","0.004","8.436","0.008","24.179","0.008","90","","99.328","","90","","1817","2","295","","295","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H24 O2 -","- C22 H24 O2 -","- C88 H96 O8 -","4","1","","Rudler, Henri; Parlier, Andrée; Martin-Vaca, Blanca; Garrier, Eva; Vaissermann, Jacqueline","Reaction of N-methyldihydropyridines with alkoxycarbene complexes of chromium and tungsten: sequential use of three carbonyl ligands of Cr(CO)6 for the formation of polyoxygenated compounds","Chemical Communications","1999","","15","1439","","10.1039/a903474i","","","0.71069","MoKα","","","0.0544","","","0.0645","","","","","1.1501","1.1501","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110582","11.198","0.005","6.867","0.001","12.192","0.018","90","","90.26","0.07","90","","937.5","1.5","298","","295","","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C23 H24 O3 -","- C23 H24 O3 -","- C46 H48 O6 -","2","1","","Rudler, Henri; Parlier, Andrée; Martin-Vaca, Blanca; Garrier, Eva; Vaissermann, Jacqueline","Reaction of N-methyldihydropyridines with alkoxycarbene complexes of chromium and tungsten: sequential use of three carbonyl ligands of Cr(CO)6 for the formation of polyoxygenated compounds","Chemical Communications","1999","","15","1439","","10.1039/a903474i","","","0.71069","MoKα","","","0.0511","","","0.0643","","","","","1.0758","1.0758","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110583","20.181","0.005","12.4","0.004","15.209","0.008","90","","106.26","0.03","90","","3654","2","300","2","300","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C32 H20 Cr4 O12 S Sb2 -","- C32 H20 Cr4 O12 S Sb2 -","- C128 H80 Cr16 O48 S4 Sb8 -","4","1","","Goh, Lai Yoong; Chen, Wei; Wong, Richard C. S.","A facile reaction of Sb2S3 with [CpCr(CO)3]2: formation of a novel tetrachromium complex [CpCr(CO)3]4(Sb2S)","Chemical Communications","1999","","16","1481","","10.1039/a903616d","","","0.71073","MoKα","","0.2016","0.0836","","0.1262","0.1011","","","","0.864","1.191","1.191","","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110584","9.67","0.002","15.618","0.003","22.563","0.005","90","","90.82","0.03","90","","3407.3","1.2","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C8 H30 F7 Fe5 N6 O26 P7 -","- C10.6667 H45.3333 F5.33333 Fe6.66667 N8 O38.6667 P9.33333 -","- C32 H136 F16 Fe20 N24 O116 P28 -","3","0.75","","Choudhury, Amitava; Natarajan, Srinivasan; Rao, C. N. R.","An open-framework iron phosphate with large voids, exhibiting spin-crossover","Chemical Communications (Cambridge, United Kingdom)","1999","","14","1305","1306","10.1039/a903683k","","","0.71073","MoKα","","0.0894","0.0561","","0.1672","0.1256","","","","1.141","1.127","1.127","","","","","has coordinates","209524","2020-10-21","18:00:00",""
"7110585","14.508","0.009","15.924","0.009","29.018","0.012","90","","90","","90","","6704","6","173","2","173","2","","","","","","","","6","C m c a","-C 2ac 2","64","[PtCl(PMe3)(C15H32O3P3)].2.5(CH2Cl2)","","","- C20.5 H46 Cl6 O3 P4 Pt -","- C20.5 H47 Cl6 O3 P4 Pt -","- C164 H376 Cl48 O24 P32 Pt8 -","8","","","Clendenning, Scott B.; Hitchcock, Peter B.; Nixon, John F.","First η1-ligated 2,4,6-tri-tert-butyl-1,3,5-triphosphabenzene complexes and the remarkable trihydration reaction of trans-[PtCl2(PMe3)(P3C3But3)] to cis-[PtCl(PMe3)(P3O3C3H5But3)], containing the novel CH(But)PH(O)C(But)PH(O)CH(But)P(O) ring system","Chemical Communications","1999","","15","1377","","10.1039/a903745d","","","0.71073","MoKα","","0.0921","0.0746","","","0.1957","0.2088","","","","","","1.12","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110586","8.263","0.002","20.426","0.004","11.556","0.002","90","","90","","90","","1950.4","0.7","150","2","293","2","","","","","","","","5","A b a 2","A 2 -2ab","41","para-bromotetrafluorophenyl-1,2,3,5-dithiadiazolyl","4-(4'-bromo-2',3',5',6'-tetrafluorophenyl)-1,2,3,5-dithiadiazolyl","","- C7 Br F4 N2 S2 -","- C7 Br F4 N2 S2 -","- C56 Br8 F32 N16 S16 -","8","","","Antorrena, Guillermo; Palacio, Fernando; Davies, John E.; Hartley, Matthew; Rawson, Jeremy M.; Smith, J.Nicholas B.; Steiner, Alexander","A novel paramagnetic dithiadiazolyl radical: Crystal structure and magnetic properties of p-BrC6F4CNSSN•","Chemical Communications","1999","","15","1393","","10.1039/a903771c","","","0.71073","MoKα","","0.1328","0.0643","","","0.1173","0.1428","","","","","","1.026","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110587","12.7602","0.0005","13.3286","0.0005","13.3902","0.0005","119.335","0.001","109.098","0.001","92.898","0.001","1813.56","0.12","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H56 N4 Si3 U -","- C24 H56 N4 Si3 U -","- C48 H112 N8 Si6 U2 -","2","1","","Boaretto, Rita; Roussel, Paul; Kingsley, Andrew J.; Munslow, Ian J.; Sanders, Christopher J.; Alcock, Nathaniel W.; Scott, Peter","Structure and reactions of a metallacyclic complex containing a remarkably long uranium‒carbon bond","Chemical Communications","1999","","17","1701","","10.1039/a903783g","","","0.71073","MoKα","","0.0547","0.0459","","","0.1186","0.1206","","","","","","1.022","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110588","17.3244","0.001","12.7945","0.001","18.6257","0.0015","90","","97.709","0.001","90","","4091.2","0.5","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C33 H64 N4 Si3 U -","- C33 H64 N4 Si3 U -","- C132 H256 N16 Si12 U4 -","4","1","","Boaretto, Rita; Roussel, Paul; Kingsley, Andrew J.; Munslow, Ian J.; Sanders, Christopher J.; Alcock, Nathaniel W.; Scott, Peter","Structure and reactions of a metallacyclic complex containing a remarkably long uranium‒carbon bond","Chemical Communications","1999","","17","1701","","10.1039/a903783g","","","0.71073","MoKα","","0.0691","0.0559","","","0.1399","0.1533","","","","","","1.075","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110589","9.61","0.003","11.381","0.002","12.024","0.004","98.9","0.02","104","0.02","105.996","0.019","1191.6","0.6","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H82 Mg2 N2 O4 Si4 -","- C36 H74.2 Mg2 N2 O4 Si4 -","- C36 H74.2 Mg2 N2 O4 Si4 -","1","0.5","","Allan, John F.; Henderson, Kenneth W.; Kennedy, Alan R.","Bis(amido)magnesium mediated aldol additions: first structural characterisation of an amidomagnesium aldolate intermediate","Chemical Communications","1999","","14","1325","","10.1039/a903784e","","","0.71069","MoKα","","0.0661","0.0488","","","0.1337","0.1417","","","","","","1.138","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110590","12.034","0.0001","14.6297","0.0001","31.8468","0.0003","90","","100.692","0.0006","90","","5509.41","0.08","150","2","150","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C116 H34 B4 Cl4 F60 N4 Ni -","- C116 H34 B4 Cl4 F60 N4 Ni -","- C232 H68 B8 Cl8 F120 N8 Ni2 -","2","0.5","","Lancaster, Simon J.; Walker, Dennis A.; Thornton-Pett, Mark; Bochmann, Manfred","New weakly coordinating counter anions for high activity polymerisation catalysts: [(C6F5)3B‒CN‒B(C6F5)3]− and [Ni{CNB(C6F5)3}4]2−","Chemical Communications","1999","","16","1533","","10.1039/a903788h","","","0.71073","MoKα","","0.0453","0.0344","","","0.0806","0.0857","","","","","","1.006","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110591","13.3342","0.0002","14.8405","0.0002","15.8631","0.0002","116.437","0.0006","90.944","0.0007","113.641","0.0005","2501.1","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C56 H15 B2 F30 N -","- C56 H15 B2 F30 N -","- C112 H30 B4 F60 N2 -","2","1","","Lancaster, Simon J.; Walker, Dennis A.; Thornton-Pett, Mark; Bochmann, Manfred","New weakly coordinating counter anions for high activity polymerisation catalysts: [(C6F5)3B–CN–B(C6F5)3]− and [Ni{CNB(C6F5)3}4]2−","Chemical Communications","1999","","16","1533","","10.1039/a903788h","","","0.71073","MoKα","","0.0405","0.0355","","","0.0928","0.0972","","","","","","1.034","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110592","13.686","0.001","4.231","0.001","14.108","0.002","90","","117.924","0.003","90","","721.8","0.2","296.2","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C7 H10 O3 -","- C7 H10 O3 -","- C28 H40 O12 -","4","1","","Mori, Takashi; Oku, Akira","Catalysis of chlorosilane on the ring-expansion of cyclic acetals bearing a carbene precursor. Lewis acid–base effect on the oxonium ylide intermediate","Chemical Communications","1999","","14","1339","","10.1039/a903928g","","","0.7107","MoKα","","","0.0341","","","","0.0463","","","","","","1.176","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110593","14.114","0.001","18.067","0.0007","20.8589","0.0004","90","","90","","90","","5319","0.4","273.2","","273.2","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C60 H36 Ag4 Cl4 O16 -","- C60 H33 Ag4 Cl4 O16 -","- C240 H132 Ag16 Cl16 O64 -","4","0.5","","Munakata, Megumu; Suenaga, Yusaku; Sugimoto, Kunihisa; Kuroda-Sowa, Takayoshi; Maekawa, Masahiko; Ning, Gui Ling","A novel double-strand helical motif in a two-dimensional polymeric complex of silver(I) perchlorate with benzo[e]acephenanthrylene","Chemical Communications","1999","","16","1545","","10.1039/a903941d","","","0.7107","MoKα","","0.1156","0.06","","","0.1374","0.1583","","","","","","1.469","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110594","14.733","0.004","16.338","0.004","17.841","0.005","67.012","0.012","77.864","0.015","75.792","0.013","3800.9","1.8","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C96 H184 Ce2 O7 Si12 Yb -","- C96 H184 Ce2 O7 Si12 Yb -","- C96 H184 Ce2 O7 Si12 Yb -","1","0.5","","Reißmann, Ulrike; Poremba, Peter; Lameyer, Lutz; Stalke, Dietmar; Edelmann, Frank T.","Redox chemistry of cerocene: the first heterobimetallic organolanthanide complex†","Chemical Communications","1999","","18","1865","","10.1039/a903954f","","","0.71073","MoKα","","0.0736","0.0622","","","0.1923","0.2049","","","","","","1.055","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110595","29.4854","0.0003","20.3867","0.0003","28.4247","0.0001","90","","90","","90","","17086.4","0.3","293","2","293","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C100 H228 N6 Nb6 O78 Si2 W18 -","- C99 H216 N6 Nb6 O78 Si2 W18 -","- C396 H864 N24 Nb24 O312 Si8 W72 -","4","1","","Kim, Gyu-Shik; Zeng, Huadong; Rhule, Jeffrey T.; Weinstock, Ira A.; Hill, Craig L.","Synthesis, X-ray structure, and hydrolytic chemistry of the highly potent antiviral polyniobotungstate A-α-[Si2Nb6W18O77]8‒","Chemical Communications","1999","","17","1651","","10.1039/a903983j","","","0.71073","MoKα","","0.0919","0.0506","","","0.0941","0.1107","","","","","","0.988","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110596","21.0827","0.0004","21.0827","0.0004","10.4262","0.0003","90","","90","","90","","4634.24","0.18","293","2","293","2","","","","","","","","6","P 42/n c m :2","-P 4ac 2ac","138","","","","- Cs6 H9 Nb3 O44 Si W9 -","- Cs6 Nb2.984 O44 Si W9.016 -","- Cs24 Nb11.936 O176 Si4 W36.064 -","4","0.25","","Kim, Gyu-Shik; Zeng, Huadong; Rhule, Jeffrey T.; Weinstock, Ira A.; Hill, Craig L.","Synthesis, X-ray structure, and hydrolytic chemistry of the highly potent antiviral polyniobotungstate A-α-[Si2Nb6W18O77]8‒","Chemical Communications","1999","","17","1651","","10.1039/a903983j","","","0.71073","MoKα","","0.0543","0.0363","","0.0991","0.0906","","","","1.037","1.105","1.105","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110597","10.0444","0.0002","19.407","0.0003","16.3157","0.0001","90","","91.34","0.002","90","","3179.58","0.08","293","2","293","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C34 H28 Cl2 Fe O2 P2 Pd -","- C34 H28 Cl2 Fe O2 P2 Pd -","- C136 H112 Cl8 Fe4 O8 P8 Pd4 -","4","1","","Yeo, Jeremy S. L.; Vittal, Jagadese J.; Andy Hor, T. S.","[PdCl2(dppfO2-O,O′)]: a simple palladium(II) complex with a rare tetrahedral structure","Chemical Communications","1999","","16","1477","","10.1039/a904016a","","","0.71073","MoKα","","0.0713","0.0679","","","0.2104","0.2169","","","","","","1.061","","","","has coordinates,has disorder","180219","2020-10-21","18:00:00",""
"7110598","15.53","0.003","15.847","0.004","16.647","0.005","113.08","0.03","111.51","0.02","95.86","0.02","3359","2","143","2","143","2","","","","","","","","6","P -1","-P 1","2","","","","- C134 H220 N8 Na4 Nd2 O22 -","- C134 H220 N8 Na4 Nd2 O22 -","- C134 H220 N8 Na4 Nd2 O22 -","1","0.5","","Campazzi, Elisa; Solari, Euro; Scopelliti, Rosario; Floriani, Carlo","Lanthanide organometallic chemistry based on the porphyrinogen skeleton: acetylene and ethylene bridging praseodymium and neodymium η5:η1:η5:η1-bonded to meso-octaethylporphyrinogen","Chemical Communications","1999","","17","1617","","10.1039/a904032c","","","0.7107","MoKα","","0.1045","0.0842","","","0.2253","0.2489","","","","","","1.021","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110599","15.232","0.001","15.232","0.001","18.729","0.002","90","","90","","90","","4345.4","0.6","143","2","143","2","","","","","","","","5","P 42/n :2","-P 4bc","86","","","","- C98 H120 N8 Na4 Pr2 -","- C98 H120 N8 Na4 Pr2 -","- C196 H240 N16 Na8 Pr4 -","2","0.25","","Campazzi, Elisa; Solari, Euro; Scopelliti, Rosario; Floriani, Carlo","Lanthanide organometallic chemistry based on the porphyrinogen skeleton: acetylene and ethylene bridging praseodymium and neodymium η5:η1:η5:η1-bonded to meso-octaethylporphyrinogen","Chemical Communications","1999","","17","1617","","10.1039/a904032c","","","0.7107","MoKα","","0.0361","0.0303","","","0.0884","0.0971","","","","","","1.133","","","","has coordinates","180219","2020-10-21","18:00:00",""
"7110600","9.1066","0.0003","10.8316","0.0007","11.8213","0.0008","69.101","0.003","70.496","0.004","78.967","0.004","1023.36","0.11","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H66 Al4 N20 -","- C20 H66 Al4 N20 -","- C20 H66 Al4 N20 -","1","0.5","","Silverman, Joel S.; Abernethy, Colin D.; Jones, Richard A.; Cowley, Alan H.","A tetranuclear aluminium hydrazide derivative with a ladder-type structure","Chemical Communications","1999","","17","1645","","10.1039/a904046c","","","0.71073","MoKα","","0.1096","0.0566","","0.1538","0.1275","","","","1.011","1.084","1.084","","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110601","16.1973","0.0009","10.3143","0.0006","13.2818","0.0007","90","","90","","90","","2218.9","0.2","143","2","143","2","","","","","","","","5","I b a 2","I 2 -2c","45","","","","- C12 H20 Au4 N8 S4 -","- C12 H20 Au4 N8 S4 -","- C48 H80 Au16 N32 S16 -","4","0.5","","Jones, Peter G.; Friedrichs, Steffi","Deprotonated ethylenethiourea as a ligand in an unusual tetrameric gold(I) complex†","Chemical Communications","1999","","15","1365","","10.1039/a904137k","","","0.71073","MoKα","","0.0463","0.0323","","","0.0753","0.0807","","","","","","1.032","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110602","9.3905","0.0001","23.1162","0.0005","10.0908","0.0002","90","","99.648","0.001","90","","2159.46","0.07","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H33 N O2 -","- C25 H33 N O2 -","- C100 H132 N4 O8 -","4","1","","Ventrice, Tina; Campi, Eva M.; Roy Jackson, W.; Patti, Antonio F.","A new route to medium and large heterocyclic compounds","Chemical Communications","1999","","16","1463","","10.1039/a904168k","","","0.7107","MoKα","","0.0663","0.0368","","0.0421","","0.0388","","","1.792","","","2.021","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110603","7.045","0.0005","16.646","0.001","16.866","0.001","90","","90","","90","","1977.9","0.2","173","2","173","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C22 H30 N2 O2 -","- C22 H30 N2 O2 -","- C88 H120 N8 O8 -","4","0.5","","Ventrice, Tina; Campi, Eva M.; Roy Jackson, W.; Patti, Antonio F.","A new route to medium and large heterocyclic compounds","Chemical Communications","1999","","16","1463","","10.1039/a904168k","","","0.7107","MoKα","","","0.0637","","","","0.0521","","","","","","3.138","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110604","9.2424","0.0005","5.0502","0.0001","23.455","0.001","90","","101.075","0.001","90","","1074.4","0.08","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H34 N2 O2 -","- C24 H34 N2 O2 -","- C48 H68 N4 O4 -","2","0.5","","Ventrice, Tina; Campi, Eva M.; Roy Jackson, W.; Patti, Antonio F.","A new route to medium and large heterocyclic compounds","Chemical Communications","1999","","16","1463","","10.1039/a904168k","","","0.7107","MoKα","","","0.0531","","","","0.0518","","","","","","2.841","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110605","11.069","0.002","12.17","0.002","25.275","0.005","90","","90","","90","","3404.8","1.1","130","2","130","2","","","","","","","","4","P b c m","-P 2c 2b","57","Bert*GaCl2","","","- C36 H49 Cl2 Ga -","- C36 H49 Cl2 Ga -","- C144 H196 Cl8 Ga4 -","4","0.5","","Twamley, Brendan; Power, Philip P.","Characterization of 2,6-Trip2H3C6GaCl2, {2,6-Trip2H3C6InCl(μ-Cl)}2 and {2,6-Trip2H3C6GaCl(μ-OH)}2 (Trip = 2,4,6-triisopropylphenyl)","Chemical Communications","1999","","18","1805","","10.1039/a904212a","","","0.71073","MoKα","","0.1522","0.0676","","","0.0898","0.1096","","","","","","0.999","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110606","25.654","0.0013","21.227","0.0011","12.7609","0.0006","90","","90","","90","","6949","0.6","299","2","299","2","","","","","","","","4","C m c a","-C 2ac 2","64","[Bert*InCl2]2","","","- C72 H98 Cl4 In2 -","- C72 H98 Cl4 In2 -","- C288 H392 Cl16 In8 -","4","","","Twamley, Brendan; Power, Philip P.","Characterization of 2,6-Trip2H3C6GaCl2, {2,6-Trip2H3C6InCl(μ-Cl)}2 and {2,6-Trip2H3C6GaCl(μ-OH)}2 (Trip = 2,4,6-triisopropylphenyl)","Chemical Communications","1999","","18","1805","","10.1039/a904212a","","","0.71073","MoKα","","0.0876","0.0418","","","0.063","0.0691","","","","","","1.058","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110607","14.2605","0.001","15.9037","0.001","18.0905","0.0012","90","","108.613","0.002","90","","3888.2","0.5","299","2","299","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","[Bert*Ga(mu-OH)Cl]2 2 C6H6","","","- C84 H112 Cl2 Ga2 O2 -","- C84 H112 Cl2 Ga2 O2 -","- C168 H224 Cl4 Ga4 O4 -","2","0.5","","Twamley, Brendan; Power, Philip P.","Characterization of 2,6-Trip2H3C6GaCl2, {2,6-Trip2H3C6InCl(μ-Cl)}2 and {2,6-Trip2H3C6GaCl(μ-OH)}2 (Trip = 2,4,6-triisopropylphenyl)","Chemical Communications","1999","","18","1805","","10.1039/a904212a","","","0.71073","MoKα","","0.1533","0.062","","","0.0899","0.1037","","","","","","1.017","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110608","20.893","0.002","13.0123","0.001","21.455","0.002","90","","98.134","0.011","90","","5774.2","0.9","213","2","213","2","","","","","","","","7","P 1 2/n 1","-P 2yac","13","","Lithium-octa(bis-trimethylsilyl)-dodecalanat","","- C60 H152 Al12 Li N8 O3 Si16 -","- C60 H174 Al12 Li N8 O3 Si16 -","- C120 H348 Al24 Li2 N16 O6 Si32 -","2","0.5","","Purath, Andreas; Köppe, Ralf; Schnöckel, Hansgeorg","An Al12R8− cluster as an intermediate on the way from aluminium(I) compounds to aluminium metal†","Chemical Communications","1999","","19","1933","","10.1039/a904247d","","","0.71073","MoKa","","0.1006","0.0547","","0.1639","0.1432","","","","0.962","1.08","1.08","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110609","10.432","0.001","19.929","0.001","10.026","0.001","90","","90.56","0.01","90","","2084.3","0.3","199","2","199","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 K O P -","- C23 H26 K O P -","- C92 H104 K4 O4 P4 -","4","1","","Karsch, Hans H.; Graf, Volker W.; Reisky, Manfred","Synthesis and X-ray structure of [(THF)K(C5H4CH2CH2PPh2)]∞: a structurally characterized heavier alkali metal phosphane complex","Chemical Communications","1999","","17","1695","","10.1039/a904248b","","","0.71073","MoKα","","0.0712","0.0363","","0.0993","0.0853","","","","1.035","1.065","1.065","","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110610","10.6487","0.0014","22.172","0.003","8.588","0.002","90","","95.726","0.013","90","","2017.5","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H25 N O6 -","- C22 H25 N O6 -","- C88 H100 N4 O24 -","4","1","","Hsieh, Ming-Fang; Rao, Polisetti Dharma; Liao, Chun-Chen","Diels–Alder and Michael addition reactions of indoles with masked o-benzoquinones: synthesis of highly functionalized hydrocarbazoles and 3-arylindoles","Chemical Communications","1999","","15","1441","","10.1039/a904366g","","","0.71073","MoKα","","0.0764","0.043","","0.1403","0.1261","","","","1.068","1.225","1.225","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110611","9.0176","0.0002","9.4144","0.0002","10.3637","0.0001","90.706","0.001","96.918","0.001","117.193","0.001","774.62","0.03","295","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C17 H14 Br N O4 -","- C17 H14 Br N O4 -","- C34 H28 Br2 N2 O8 -","2","1","","Hsieh, Ming-Fang; Rao, Polisetti Dharma; Liao, Chun-Chen","Diels–Alder and Michael addition reactions of indoles with masked o-benzoquinones: synthesis of highly functionalized hydrocarbazoles and 3-arylindoles","Chemical Communications","1999","","15","1441","","10.1039/a904366g","","","0.71073","MoKα","","0.0413","0.0349","","0.0957","0.0893","","","","1.185","1.178","1.178","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110612","9.7912","0.001","10.643","0.001","10.9638","0.001","117.7","0.01","90.14","0.01","105.08","0.01","966.5","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H14 Cl2 Mo N2 O5 -","- C19 H12 Cl2 Mo N2 O5 -","- C38 H24 Cl4 Mo2 N4 O10 -","2","1","","Bandyopadhyay, Ratna; Biswas, Sudeb; Bhattacharyya, Ramgopal; Guha, Subhadra; Mukherjee, Alok K.","Novel oxo-peroxo molybdenum(VI) complexes incorporating 8-quinolinol: synthesis, structure and catalytic uses in the environmentally benign and cost-effective oxidation method of methyl benzenes: Ar(CH3)n (n = 1, 2)","Chemical Communications","1999","","17","1627","","10.1039/a904440j","","","0.71093","MoKa","","0.0478","0.0414","","0.1235","0.119","","","","1.099","1.124","1.124","","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110613","17.297","0.0004","19.5782","0.0004","22.2298","0.0005","106.181","0.0015","108.143","0.0015","106.674","0.0014","6268","0.3","150","","150","","","","","","","","see text","3","P -1","-P 1","2","","","","- C104 H172 Si17 -","- C104 H172 Si17 -","- C208 H344 Si34 -","2","1","","de Groot, Debby; de Wilde, Janine C.; van Haaren, Richard J.; Reek, Joost N. H.; Kamer, Paul C. J.; van Leeuwen, Piet W. N. M.; Eggeling, Eva B.; Vogt, Dieter; Kooijman, Huub; Spek, Anthony L.; van der Made, Alexander W.","Palladium complexes of phosphine functionalised carbosilane dendrimers as catalysts in a continuous flow membrane reactor†","Chemical Communications","1999","","17","1623","","10.1039/a904455h","","","0.71073","MoKα","","0.2399","0.136","","","0.244","0.2949","","","","","","0.886","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110614","19.767","0.002","9.9958","0.001","17.661","0.002","90","","109.882","0.01","90","","3281.6","0.6","150","","150","","","","","","","","see text","2","P 1 21/c 1","-P 2ybc","14","","","","- C116 H48 -","- C116 H48 -","- C232 H96 -","2","0.5","","Marc Veen, E.; Feringa, Ben L.; Postma, Peter M.; Jonkman, Harry T.; Spek, Anthony L.","Solid state organisation of C60 by inclusion crystallisation with triptycenes†","Chemical Communications","1999","","17","1709","","10.1039/a904457d","","","0.71073","MoKα","","0.2605","0.0947","","","0.1882","0.2611","","","","","","1.003","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110615","13.4643","0.0011","13.4643","0.0011","12.6983","0.0009","90","","90","","120","","1993.6","0.3","150","","150","","","","","","","","see text","3","P 63 m c","P 6c -2c","186","","","","- C79 H13 N -","- C79 H13 N -","- C158 H26 N2 -","2","0.166667","","Marc Veen, E.; Feringa, Ben L.; Postma, Peter M.; Jonkman, Harry T.; Spek, Anthony L.","Solid state organisation of C60 by inclusion crystallisation with triptycenes†","Chemical Communications","1999","","17","1709","","10.1039/a904457d","","","0.71073","MoKα","","0.108","0.0861","","","0.2438","0.2717","","","","","","1.051","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110616","23.576","0.003","23.576","0.003","6.5913","0.0008","90","","90","","120","","3172.8","0.7","223","2","223","2","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","2,4,6-tris-(4-methylphenoxy)-1,3,5-triazine","","- C24 H21 N3 O3 -","- C24 H21 N3 O3 -","- C144 H126 N18 O18 -","6","0.333333","","Thalladi, Venkat R.; Boese, Roland; Brasselet, Sophie; Ledoux, Isabelle; Zyss, Joseph; Jetti, Ram K. R.; Desiraju, Gautam R.","Steering non-centrosymmetry into the third dimension: crystal engineering of an octupolar nonlinear optical crystal","Chemical Communications","1999","","17","1639","","10.1039/a904490f","","","0.71073","MoKα","","0.0615","0.0584","","","0.1274","0.1321","","","","","","1.137","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110617","21.592","0.003","21.592","0.003","36.839","0.007","90","","90","","120","","14874","4","193","2","193","2","","","","","","","","5","R -3 :H","-R 3","148","Ca7-Cluster-Dimer","","","- C54 H116 Ca7 I6.5 O21.5 -","- C54 H116 Ca7 I6.5 O21.5 -","- C324 H696 Ca42 I39 O129 -","6","0.333333","","Fromm, Katharina M.","Synthesis and crystal structure of Li[{Ca7(μ3-OH)8I6(thf)12}2(μ-I)]·3THF, a unique H-bound dimer of a Ca7-cluster on the way to sol‒gels","Chemical Communications","1999","","17","1659","","10.1039/a904560k","","","0.71073","MoKα","","0.1208","0.0668","","","0.1716","0.2057","","","","","","1.021","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110618","12.5106","0.0015","17.789","0.002","18.139","0.002","95.794","0.015","106.581","0.013","103.57","0.01","3699.4","0.8","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(nBu4N)3 [Re6S8Cl6]","tris-tetra-n-butylammonium octa-μ~eq~3-sulfido- hexachloro-octahedro-hexarhenate(III)","","- C48 H108 Cl6 N3 Re6 S8 -","- C48 H103 Cl6 N3 Re6 S8 -","- C96 H206 Cl12 N6 Re12 S16 -","2","1","","Guilbaud, Christophe; Deluzet, André; Domercq, Benoît; Molinié, Philippe; Boubekeur, Kamal; Batail, Patrick; Coulon, Claude","(NBun4+)3[Re6S8Cl6]3−·: synthesis and luminescence of the paramagnetic, open shell member of a hexanuclear chalcohalide cluster redox system","Chemical Communications","1999","","18","1867","","10.1039/a904669k","","","0.71069","MoKα","","0.0546","0.0329","","","0.0674","0.0712","","","","","","0.816","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110619","9.966","0.003","9.966","0.003","15.907","0.006","90","","90","","90","","1579.9","0.9","213","2","213","2","","","","","","","synthesis","5","P 4/n :2","-P 4a","85","","","","- C28 H48 Cl2 Ir2 N12 -","- C28 H48 Cl2 Ir2 N12 -","- C56 H96 Cl4 Ir4 N24 -","2","0.25","","Albert Cotton, F.; Murillo, Carlos A.; Timmons, Daren J.; Murillo, Carlos A.","First paddlewheel complex with a doubly-bonded Ir26+ core","Chemical Communications","1999","","15","1427","","10.1039/a904698d","","","0.71073","MoKα","","0.0497","0.0384","","0.0931","0.0803","","","","1.15","1.156","1.156","","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110620","9.885","0.002","18.173","0.003","14.729","0.003","90","","99.85","0.02","90","","2606.9","0.9","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H28 Fe2 N2 O6 P2 -","- C19 H28 Fe2 N2 O6 P2 -","- C76 H112 Fe8 N8 O24 P8 -","4","1","","Bourissou, Didier; Canac, Yves; Gornitzka, Heinz; Baceiredo, Antoine; Bertrand, Guy","Ligand properties of 1H-diphosphirenes and diphosphirenylium salts towards iron carbonyl fragments","Chemical Communications","1999","","16","1535","","10.1039/a904747f","","","0.71073","MoKα","","0.1134","0.0693","","0.1942","0.1628","","","","1.007","1.078","1.078","","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110621","15.7039","0.0004","19.5502","0.0004","20.336","0.0005","90","","90","","90","","6243.4","0.3","193","2","193","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C23 H28 Fe3 N2 O10 P2 -","- C23 H28 Fe3 N2 O10 P2 -","- C184 H224 Fe24 N16 O80 P16 -","8","1","","Bourissou, Didier; Canac, Yves; Gornitzka, Heinz; Baceiredo, Antoine; Bertrand, Guy","Ligand properties of 1H-diphosphirenes and diphosphirenylium salts towards iron carbonyl fragments","Chemical Communications","1999","","16","1535","","10.1039/a904747f","","","0.71073","MoKα","","0.0548","0.0513","","","0.1213","0.1233","","","","","","1.212","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110622","15.871","0.002","14.707","0.002","11.8412","0.0015","90","","123.91","0.006","90","","2293.8","0.5","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H36 Au Cl N4 O4 -","- C18 H36 Au Cl N4 O4 -","- C72 H144 Au4 Cl4 N16 O16 -","4","0.5","","Vicente, José; Chicote, María Teresa; Guerrero, Rita; Carmen Ramírez de Arellano, M.","Synthesis of the first complex with acetonine as ligand: the first crystal structure of an acetonine derivative","Chemical Communications","1999","","16","1541","","10.1039/a904777h","","","0.71073","MoKα","","0.0419","0.0287","","0.0811","0.0709","","","","1.097","1.166","1.166","","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110623","28.97","0.01","20.064","0.008","23.549","0.009","90","","107.44","0.04","90","","13059","9","253","","253","","","","","","","","see paper","5","C 1 2/c 1","-C 2yc","15","Dodecakis(N,N-diisopropylcarbamato)tetraneodimium(iii)","","","- C100 H194 N12 Nd4 O24 -","- C100 H168 N12 Nd4 O24 -","- C400 H672 N48 Nd16 O96 -","4","0.5","","Abram, Ulrich; Dell’Amico, Daniela Belli; Calderazzo, Fausto; Porta, Cinzia Della; Merigo, Alessandra; Englert, Ulli; Marchetti, Fabio","Isotypical N,N-dialkylcarbamato lanthanide complexes covering a range of 11 atomic numbers: direct experimental assessment of the lanthanide contraction in trivalent molecular compounds","Chemical Communications","1999","","20","2053","","10.1039/a904792a","","","0.71073","Mo-Kα","","0.1879","0.0668","","0.1792","0.1563","","","","0.896","1.2","1.2","","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110624","29.041","0.008","19.676","0.002","23.17","0.008","90","","107.52","0.01","90","","12625","6","203","","203","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dodecakis(N,N-diisopropylcarbamato)tetragadolinium(iii)","","- C84 H168 Gd4 N12 O24 -","- C84 H168 Gd4 N12 O24 -","- C336 H672 Gd16 N48 O96 -","4","0.5","","Abram, Ulrich; Dell’Amico, Daniela Belli; Calderazzo, Fausto; Porta, Cinzia Della; Merigo, Alessandra; Englert, Ulli; Marchetti, Fabio","Isotypical N,N-dialkylcarbamato lanthanide complexes covering a range of 11 atomic numbers: direct experimental assessment of the lanthanide contraction in trivalent molecular compounds","Chemical Communications","1999","","20","2053","","10.1039/a904792a","","","0.7093","MoKα","","0.1033","0.0489","","0.1332","0.1209","","","","1.056","1.267","1.267","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110625","29.13","0.002","19.844","0.002","23.131","0.001","90","","107.24","0.01","90","","12770.3","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Dodecakis(N,N-diisopropylcarbamato)tetraholmium(iii)","","- C98 H200 Ho4 N12 O24 -","- C98 H168 Ho4 N12 O24 -","- C392 H672 Ho16 N48 O96 -","4","0.5","","Abram, Ulrich; Dell’Amico, Daniela Belli; Calderazzo, Fausto; Porta, Cinzia Della; Merigo, Alessandra; Englert, Ulli; Marchetti, Fabio","Isotypical N,N-dialkylcarbamato lanthanide complexes covering a range of 11 atomic numbers: direct experimental assessment of the lanthanide contraction in trivalent molecular compounds","Chemical Communications","1999","","20","2053","","10.1039/a904792a","","","0.71073","MoKα","","0.064","0.0392","","","0.0938","0.1102","","","","","","1.038","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110626","16.491","0.008","19.048","0.011","12.838","0.006","98.79","0.05","97.26","0.04","114.35","0.04","3550","4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C74 H97 B Co N4 O8 -","- C74 H97 B Co N4 O8 -","- C148 H194 B2 Co2 N8 O16 -","2","1","","Boxwell, Clive J.; Walton, Paul H.","Structures of [Co(II)(L)(NO3)(HOCH3)n]BPh4 (n = 4, 5) complexes (L = cis,cis-1,3,5-triaminocyclohexane-based ligand): structural ‘snapshots’ of anion binding to a metal centre","Chemical Communications","1999","","17","1647","","10.1039/a904802b","","","0.71069","MoKα","","0.2402","0.063","","","0.1592","0.2251","","","","","","1.023","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110627","10.393","0.004","16.811","0.005","21.737","0.005","90","","97.21","0.02","90","","3768","2","150","2","150","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C75 H97 B Cl4 Co N4 O7 -","- C75 H97 B Cl4 Co N4 O7 -","- C150 H194 B2 Cl8 Co2 N8 O14 -","2","1","","Boxwell, Clive J.; Walton, Paul H.","Structures of [Co(II)(L)(NO3)(HOCH3)n]BPh4 (n = 4, 5) complexes (L = cis,cis-1,3,5-triaminocyclohexane-based ligand): structural ‘snapshots’ of anion binding to a metal centre","Chemical Communications","1999","","17","1647","","10.1039/a904802b","","","0.71069","MoKα","","0.1932","0.064","","","0.1598","0.2319","","","","","","1.025","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110628","9.321","0.008","15.481","0.005","12.756","0.007","90","","105.06","0.05","90","","1777.5","1.9","293.2","","293.2","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C15 H16 O5 S4 -","- C15 H16 O5 S4 -","- C60 H64 O20 S16 -","4","1","","Alan Aitken, R.; Hill, Lawrence; Lightfoot, Philip; Wilson, Neil J.","New reactions of cyclic sulfoxides under Pummerer conditions","Chemical Communications","1999","","17","1673","","10.1039/a904882k","","","0.7107","MoKalpha","","","0.0954","","","0.092","","","","","7.302","7.302","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110629","7.403","0.002","10.964","0.008","12.293","0.003","90","","94.3","0.03","90","","995","0.8","273","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H9 Co O4 -","- C12 H9 Co O4 -","- C48 H36 Co4 O16 -","4","0.5","","Braga, Dario; Maini, Lucia; Polito, Marco; Cojazzi, Gianna; Grepioni, Fabrizia","Seeds obtained from a hydrated polymorph permit crystallisation of an elusive anhydrous organometallic zwitterion","Chemical Communications","1999","","19","1949","","10.1039/a904951g","","","0.71069","MoKα","","0.0424","0.0362","","","0.0996","0.102","","","","","","0.914","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110630","6.707","0.003","14.997","0.004","13.453","0.004","90","","99.84","0.02","90","","1333.3","0.8","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H15 Co O7 -","- C12 H8 Co O7 -","- C48 H32 Co4 O28 -","4","1","","Braga, Dario; Maini, Lucia; Polito, Marco; Cojazzi, Gianna; Grepioni, Fabrizia","Seeds obtained from a hydrated polymorph permit crystallisation of an elusive anhydrous organometallic zwitterion","Chemical Communications","1999","","19","1949","","10.1039/a904951g","","","0.71069","MoKα","","0.126","0.0851","","","0.222","0.2467","","","","","","1","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110631","35.2074","0.0002","15.0195","0.0003","19.6563","0.0004","90","","98.615","0.001","90","","10276.9","0.3","295","1","295","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C104 H104 Cl2 Cr7 N28 O6 -","- C104 H104 Cl2 Cr7 N28 O6 -","- C416 H416 Cl8 Cr28 N112 O24 -","4","1","","Chen, Yu-Hua; Lee, Chung-Chou; Wang, Chih-Chieh; Lee, Gene-Hsiang; Lai, Shie-Yang; Li, Feng-Yin; Mou, Chung-Yuan; Peng, Shie-Ming","A linear metal string [Cr7(μ7-teptra)4Cl2] complex with delocalized heptachromium(II) multiple bonds (teptraH3 = tetrapyridyltriamine)","Chemical Communications","1999","","17","1667","","10.1039/a905001i","","","0.71073","MoKα","","0.1534","0.1123","","0.3228","0.2945","","","","1.143","1.238","1.238","","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110632","4.684","0.004","13.47","0.005","13.786","0.006","73.144","0.01","78.9","0.02","88.302","0.01","816.5","0.8","293","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H15 N5 O3 -","- C18 H15 N5 O3 -","- C36 H30 N10 O6 -","2","1","","Coogan, Michael P.; Smart, Emma; Hibbs, David E.","Asymmetric transformation (deracemisation) of an atropisomeric bisheterocyclic amine†","Chemical Communications","1999","","19","1991","","10.1039/a905018c","","","0.71073","MoKα","","0.2872","0.0595","","","0.0888","0.1412","","","","","","0.914","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110633","6.2074","0.0003","10.0187","0.0005","11.5666","0.0005","103.005","0.002","93.424","0.002","94.572","0.002","696.41","0.06","150","","150","","","","","","","","","3","P -1","-P 1","2","","","","- C10 H12 O2 -","- C10 H12 O2 -","- C30 H36 O6 -","3","1.5","","Bilton, Clair; Howard, Judith A. K.; Laxmi Madhavi, N. N.; Nangia, Ashwini; Desiraju, Gautam R.; Allen, Frank H.; Wilson, Chick C.","When is a polymorph not a polymorph? Helical trimeric O–H···O synthons in trans-1,4-diethynylcyclohexane-1,4-diol","Chemical Communications","1999","","17","1675","","10.1039/a905025f","","","0.71073","MoKα","","0.0511","0.0409","","","0.1026","0.1089","","","","","","1.046","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110634","6.414","0.0002","9.6367","0.0003","11.7852","0.0004","105.689","0.002","101.838","0.001","94.736","0.001","678.98","0.04","150","","150","","","","","","","","","3","P -1","-P 1","2","","","","- C10 H12 O2 -","- C10 H12 O2 -","- C30 H36 O6 -","3","1.5","","Bilton, Clair; Howard, Judith A. K.; Laxmi Madhavi, N. N.; Nangia, Ashwini; Desiraju, Gautam R.; Allen, Frank H.; Wilson, Chick C.","When is a polymorph not a polymorph? Helical trimeric O–H···O synthons in trans-1,4-diethynylcyclohexane-1,4-diol","Chemical Communications","1999","","17","1675","","10.1039/a905025f","","","0.71073","MoKα","","0.0608","0.0461","","","0.0966","0.1077","","","","","","1.145","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110635","9.925","0.002","6.1343","0.0012","16.725","0.003","90","","104.12","0.03","90","","987.5","0.4","150","","150","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C10 H14 O3 -","- C10 H14 O3 -","- C40 H56 O12 -","4","1","","Bilton, Clair; Howard, Judith A. K.; Laxmi Madhavi, N. N.; Nangia, Ashwini; Desiraju, Gautam R.; Allen, Frank H.; Wilson, Chick C.","When is a polymorph not a polymorph? Helical trimeric O–H···O synthons in trans-1,4-diethynylcyclohexane-1,4-diol","Chemical Communications","1999","","17","1675","","10.1039/a905025f","","neutron","","neutron","","0.0889","0.0888","","","0.127","0.127","","","","","","3.792","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110636","10.7824","0.0015","17.348","0.002","14.0835","0.0018","90","","97.405","0.003","90","","2612.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 Cu N3 S -","- C13 H12 Cu N3 S -","- C104 H96 Cu8 N24 S8 -","8","2","","Wang, Quan-Ming; Guo, Guo-Cong; Mak, Thomas C. W.","A coordination polymer based on twofold interpenetrating three-dimensional four-connected nets of 42638 topology, [CuSCN(bpa)] [bpa = 1,2-bis(4-pyridyl)ethane]†","Chemical Communications","1999","","18","1849","","10.1039/a905085j","","","0.71073","MoKα","","0.1718","0.0417","","","0.0759","0.1158","","","","","","0.67","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110637","31.061","0.001","31.061","0.001","12.566","0.001","90","","90","","120","","10499.3","1","180","","","","","","","","","","Local laboratory","3","P -3","-P 3","147","","","","- C58 H84 Si10 -","- C58 H84 Si10 -","- C348 H504 Si60 -","6","1","","Matsuo, Tsukasa; Uchida, Kumiko; Sekiguchi, Akira","Silylacetylene dendrimers: synthesis and characterization","Chemical Communications","1999","","18","1799","","10.1039/a905107d","","","0.71073","xray","","","0.054","","","0.051","","","","","2.782","2.782","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110638","11.486","0.001","12.559","0.001","16.049","0.001","87.64","0.01","89.82","0.01","82.87","0.01","2295.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C44 H57 N O3 Ti3 -","- C44 H57 N O3 Ti3 -","- C88 H114 N2 O6 Ti6 -","2","1","","Gómez-Sal, Pilar; Martín, Avelino; Mena, Miguel; del Carmen Morales, María; Santamaría, Cristina","Photochemical incorporation of N-benzylidene(phenyl)amine into the complex [{Ti(η5-C5Me5)(η-O)}3(μ3-CH)] as a model of the titanium oxide surface†","Chemical Communications","1999","","18","1839","","10.1039/a905129e","","","0.71073","MoKα","","0.1143","0.0769","","","0.2511","0.2807","","","","","","1.076","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110639","17.098","0.007","13.871","0.006","15.366","0.007","90","","110.063","0.0006","90","","3423","3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Cu3(H2L)(L).2H2O","","","- C36 H38 Cu3 N4 O10 -","- C36 H38 Cu3 N4 O10 -","- C144 H152 Cu12 N16 O40 -","4","0.5","","Sanmartín, Jesús; Bermejo, Manuel R.; García-Deibe, Ana M.; Piro, Oscar; Castellano, Eduardo E.","An unusual [4 + 4 + 4] bishelical complex, Cu3(H2L)(L)·2H2O [H4L′ = N,N′-bis(3-hydroxysalicylidene)-1,4-diaminobutane]: synthesis and crystal structure","Chemical Communications","1999","","19","1953","","10.1039/a905133c","","","0.71073","MoKα","","0.2971","0.061","","","0.139","0.2272","","","","","","0.915","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110640","10.89","0.003","12.191","0.003","41.782","0.009","90","","96.39","0.02","90","","5513","2","150","","150","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C38 H74 Cl3 Cu Fe3 N2 Se6 -","- C38 H74 Cl3 Cu Fe3 N2 Se6 -","- C152 H296 Cl12 Cu4 Fe12 N8 Se24 -","4","1","","Lackmann, Jörg; Hauptmann, Ralf; Weißgräber, Stefan; Henkel, Gerald","[NBnMe3]2[Fe2Cu4(SePri)8Cl2] and [NBnMe3]2[Fe3Cu(SePri)6Cl3], novel heterometallic chalcogenolate complexes with dodecahedral and octahedral selenium cages","Chemical Communications","1999","","19","1995","","10.1039/a905134a","","","0.71073","MoKα","","","0.0662","","","0.1467","0.1837","","","","","","1.005","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110641","14.832","0.002","16.45","0.003","26.524","0.004","90","","105.29","0.01","90","","6242.4","1.7","150","","150","","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C44 H88 Cl2 Cu4 Fe2 N2 Se8 -","- C44 H88 Cl2 Cu4 Fe2 N2 Se8 -","- C176 H352 Cl8 Cu16 Fe8 N8 Se32 -","4","1","","Lackmann, Jörg; Hauptmann, Ralf; Weißgräber, Stefan; Henkel, Gerald","[NBnMe3]2[Fe2Cu4(SePri)8Cl2] and [NBnMe3]2[Fe3Cu(SePri)6Cl3], novel heterometallic chalcogenolate complexes with dodecahedral and octahedral selenium cages","Chemical Communications","1999","","19","1995","","10.1039/a905134a","","","0.71073","MoKα","","","0.0714","","0.1879","","","","","1.012","","","","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110642","10.067","0.002","13.036","0.004","17.169","0.004","67.9","0.02","87.66","0.02","72.6","0.01","1985.5","0.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C16.25 H25.5 Cl1.5 Mo O2 P2 -","- C16.25 H25 Cl1.5 Mo O2 P2 -","- C65 H100 Cl6 Mo4 O8 P8 -","4","2","","Weller, Andrew S.; Andrews, Christopher D.; Burrows, Andrew D.; Green, Michael; Lynam, Jason M.; Mahon, Mary F.; Jones, Cameron","Facile, metal promoted, oxidation of η4-1,3-diphosphacyclobutadiene by water or methanol: synthesis of [MoCl(CO)(η4-1,3-P2C2But2)(η5-L)] (L = C5H5, C5Me5) and [MoCl(CO){η3,λ3,λ5-PC2But2PH(OR)}(η5-L)] (L= C5H5,R = H, Me)","Chemical Communications","1999","","21","2147","","10.1039/a905240b","","","0.71069","MoKα","","0.04","0.0299","","0.0771","0.0741","","","","1.042","1.109","1.109","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110643","20.399","0.002","15.674","0.002","18.02","0.002","90","","90","","90","","5761.6","1.1","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","","(Ph4As)2[Ru(S2C2(CN)2]3","","- C60 H40 As2 N6 Ru S6 -","- C60 H40 As2 N6 Ru S6 -","- C240 H160 As8 N24 Ru4 S24 -","4","0.5","","Maiti, Rabindranath; Shang, Maoyu; Graham Lappin, A.","A ruthenium(IV) complex with six sulfur donor atoms","Chemical Communications","1999","","23","2349","","10.1039/a905243g","","","0.71073","MoKα","","0.0898","0.0471","","0.1124","0.0999","","","","0.984","1.167","1.167","","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110644","13.1816","0.0015","27.145","0.005","12.767","0.003","90","","111.319","0.01","90","","4255.6","1.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(Et4N)2[Ru(mnd)2].0.5H2O","","- C32 H41 N10 O0.5 Ru S6 -","- C32.006 H41 N10 O0.5 Ru S6 -","- C128.024 H164 N40 O2 Ru4 S24 -","4","1","","Maiti, Rabindranath; Shang, Maoyu; Graham Lappin, A.","A ruthenium(IV) complex with six sulfur donor atoms","Chemical Communications","1999","","23","2349","","10.1039/a905243g","","","0.71073","MoKα","","0.1077","0.0705","","0.2184","0.1907","","","","1.065","1.195","1.195","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110645","13.494","0.002","13.494","0.002","16.834","0.002","90","","90","","120","","2654.6","0.6","293","2","293","2","","","","","","","","5","P -6 2 c","P -6c -2c","190","","(Et4N)3[Ru(dithiolate)3].2CH3CN","","- C40 H66 N11 Ru S6 -","- C40 H66 N11 Ru S6 -","- C80 H132 N22 Ru2 S12 -","2","0.166667","","Maiti, Rabindranath; Shang, Maoyu; Graham Lappin, A.","A ruthenium(IV) complex with six sulfur donor atoms","Chemical Communications","1999","","23","2349","","10.1039/a905243g","","","0.71073","MoKα","","0.0252","0.0219","","0.0589","0.0568","","","","0.976","0.995","0.995","","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110646","10.776","0.007","7.241","0.006","13.028","0.008","90","","95.84","0.05","90","","1011.3","1.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","1,3,5-N,N',N''-tris(2-methoxyethyl)trimesic amide","","- C18 H27 N3 O6 -","- C18 H27 N3 O6 -","- C36 H54 N6 O12 -","2","1","","Lightfoot, Matthew P.; Mair, Francis S.; Pritchard, Robin G.; Warren, John E.","New supramolecular packing motifs: π-stacked rods encased in triply-helical hydrogen bonded amide strands","Chemical Communications","1999","","19","1945","","10.1039/a905245c","","","0.71069","MoKα","","0.1138","0.0636","","","0.1419","0.1629","","","","","","1.088","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110647","14.966","0.0014","19.7432","0.001","17.0768","0.0013","90","","98.541","0.01","90","","4989.8","0.7","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C97 H66 Ir2 N2 O25 P4 Ru6 -","- C97 H65 Ir2 N2 O25 P4 Ru6 -","- C194 H130 Ir4 N4 O50 P8 Ru12 -","2","0.5","","Haak, Susanne; Neels, Antonia; Stœckli-Evans, Helen; Süss-Fink, Georg; Thomas, Christophe M.","Fixation and spontaneous dehydrogenation of methanol on a triruthenium‒iridium framework: synthesis and structure of the cluster anion [HRu3Ir(CO)12(OMe)]−","Chemical Communications","1999","","19","1959","","10.1039/a905487a","","","0.71073","MoKα","","0.1042","0.0588","","","0.1501","0.1674","","","","","","0.88","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110648","38.53","0.002","19.1969","0.0009","20.3787","0.001","90","","90","","90","","15073.2","1.3","180","2","180","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C102.5 H213 Cl21 O16 P8 Pd4 -","- C102.5 H213 Cl21 O16 P8 Pd4 -","- C410 H852 Cl84 O64 P32 Pd16 -","4","1","","Clegg, William; Elsegood, Mark R. J.; Eastham, Graham R.; Tooze, Robert P.; Wang, Xiao Lan; Whiston, Keith","Highly active and selective catalysts for the production of methyl propanoate via the methoxycarbonylation of ethene","Chemical Communications","1999","","18","1877","","10.1039/a905521e","","","0.71073","MoKα","","0.1329","0.0723","","","0.1407","0.168","","","","","","1.05","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110649","10.993","0.0004","16.4195","0.0005","29.0041","0.0009","90","","93.891","0.001","90","","5223.2","0.3","158","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C44 H73 Cl4 Li2 N6 Y -","- C43.956 H39 Cl4 Li2 N6 Y -","- C175.824 H156 Cl16 Li8 N24 Y4 -","4","1","","Schmidt, Joseph A. R.; Arnold, John","Mono-amidinate complexes stabilized by a new sterically-hindered amidine†","Chemical Communications","1999","","21","2149","","10.1039/a905620c","","","0.7107","MoKα","","0.137","0.054","","","0.063","","","","","1.652","1.652","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110650","17.7707","0.0004","19.7667","0.0005","20.3416","0.0004","90","","90","","90","","7145.4","0.3","160.2","","160.2","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C37 H55 Li N4 -","- C37 H55 Li N4 -","- C296 H440 Li8 N32 -","8","1","","Schmidt, Joseph A. R.; Arnold, John","Mono-amidinate complexes stabilized by a new sterically-hindered amidine†","Chemical Communications","1999","","21","2149","","10.1039/a905620c","","","0.7107","MoKα","","0.056","0.0399","","","0.0428","","","","","1.361","1.361","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110651","18.6326","0.0006","21.4487","0.0005","24.4451","0.0007","90","","90","","90","","9769.4","0.5","140.2","","140.2","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C43 H75 N4 Si4 Y -","- C43 H75 N4 Si4 Y -","- C344 H600 N32 Si32 Y8 -","8","1","","Schmidt, Joseph A. R.; Arnold, John","Mono-amidinate complexes stabilized by a new sterically-hindered amidine†","Chemical Communications","1999","","21","2149","","10.1039/a905620c","","","0.7107","MoKα","","0.105","0.03","","","0.0309","","","","","0.901","0.901","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110652","10.638","0.005","15.753","0.005","18.502","0.004","90","","99.22","0.02","90","","3060.5","1.9","293.2","","293.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H52 O P4 Ru S -","- C25 H52 O P4 Ru S -","- C100 H208 O4 P16 Ru4 S4 -","4","1","","Planas, Jose Giner; Hirano, Masafumi; Komiya, Sanshiro","Regioselective 1,2-insertion of Ru into the C‒S bond in 3-substituted thiophenes","Chemical Communications","1999","","18","1793","","10.1039/a905748j","","","0.7107","MoKα","","0.0433","0.0433","","","0.0449","0.0449","","","","","","0.934","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110653","11.485","0.005","24.678","0.005","18.369","0.004","90","","95.22","0.03","90","","5185","3","293.2","","293.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C51 H77 B O P4 Ru S -","- C51 H77 B O P4 Ru S -","- C204 H308 B4 O4 P16 Ru4 S4 -","4","1","","Planas, Jose Giner; Hirano, Masafumi; Komiya, Sanshiro","Regioselective 1,2-insertion of Ru into the C‒S bond in 3-substituted thiophenes","Chemical Communications","1999","","18","1793","","10.1039/a905748j","","","0.7107","MoKα","","0.07","0.07","","","0.0827","0.081","","","","","","1.98","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110654","13.351","0.003","15.931","0.003","20.478","0.003","86.741","0.005","83.7","0.005","73.329","0.005","4145.8","1.4","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C45.5 H36.75 Ag F6 N4.25 P -","- C45.5 H36.75 Ag F6 N4.25 P -","- C182 H147 Ag4 F24 N17 P4 -","4","2","","Hannon, Michael J.; Painting, Claire L.; Alcock, Nathaniel W.","A metallo-supramolecular double-helix containing a major and a minor groove","Chemical Communications","1999","","20","2023","","10.1039/a905795a","","","0.71073","MoKα","","0.1488","0.0744","","0.2093","0.1736","","","","0.997","1.156","1.156","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110655","8.151","0.001","15.74","0.001","15.857","0.001","90","","95.46","0.01","90","","2025.2","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Pentacarbonylruthenium(0)(ditrifluoroacetato)tricarbonylruthenium(ii)","","- C12 F6 O12 Ru2 -","- C12 F6 O12 Ru2 -","- C48 F24 O48 Ru8 -","4","1","","Funaioli, Tiziana; Fachinetti, Giuseppe; Marchetti, Fabio","Reactive intermediates from carbonylation of ruthenium(I) carbonyl carboxylates. Isolation, molecular structures and chemical properties of dinuclear unbridged ruthenium carbonyl trifluoroacetates","Chemical Communications","1999","","20","2043","","10.1039/a905798f","","","0.71073","MoKα","","0.065","0.0481","","","0.114","0.1241","","","","","","1.018","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110656","9.02","0.001","12.716","0.002","17.748","0.002","90","","90","","90","","2035.7","0.5","293","2","293","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","Bis[tetracarbonyl(trifluoroacetato)ruthenium(i)]","","- C6 F3 O6 Ru -","- C6 F3 O6 Ru -","- C48 F24 O48 Ru8 -","8","1","","Funaioli, Tiziana; Fachinetti, Giuseppe; Marchetti, Fabio","Reactive intermediates from carbonylation of ruthenium(I) carbonyl carboxylates. Isolation, molecular structures and chemical properties of dinuclear unbridged ruthenium carbonyl trifluoroacetates","Chemical Communications","1999","","20","2043","","10.1039/a905798f","","","0.71073","MoKα","","0.1001","0.0536","","","0.1287","0.1557","","","","","","1.028","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110657","11.894","0.002","7.711","0.002","19.067","0.005","90","","107.06","0.02","90","","1671.8","0.7","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H36 Br6 Sb6 -","- C12 H36 Br6 Sb6 -","- C24 H72 Br12 Sb12 -","2","0.5","","Althaus, Henrik; Breunig, Hans J.; Lork, Enno","Crystal structure of [Me3Sb–SbMe2]2[(MeSbBr3)2], a trimethylstibine adduct of the dimethylstibenium ion or a stibinostibonium salt?","Chemical Communications","1999","","19","1971","","10.1039/a905837k","","","0.71073","MoKα","","0.0704","0.0522","","","0.1287","0.1391","","","","","","1.021","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110658","16.979","0.002","17.594","0.003","18.052","0.003","90","","90","","90","","5392.6","1.4","123","2","123","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C52 H50 F6 N2 O8 P2 Pd2 S2 -","- C52 H50 F6 N2 O8 P2 Pd2 S2 -","- C208 H200 F24 N8 O32 P8 Pd8 S8 -","4","1","","Butts, Craig P.; Crosby, John; Lloyd-Jones, Guy C.; Stephen, Susanna C.","Robust and catalytically active mono- and bis-Pd-complexes of the ‘Trost modular ligand’","Chemical Communications","1999","","17","1707","","10.1039/a905851f","","","0.71073","MoKα","","0.0699","0.051","","0.1352","0.1267","","","","1.006","1.067","1.067","","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110659","17.8937","0.0005","31.1163","0.0009","10.8869","0.0003","90","","90","","90","","6061.7","0.3","173","2","173","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C68.46 H60 N4.23 O3 P3 -","- C68.458 H60 N4.229 O3 P3 -","- C273.832 H240 N16.916 O12 P12 -","4","1","","Butts, Craig P.; Crosby, John; Lloyd-Jones, Guy C.; Stephen, Susanna C.","Robust and catalytically active mono- and bis-Pd-complexes of the ‘Trost modular ligand’","Chemical Communications","1999","","17","1707","","10.1039/a905851f","","","0.71073","MoKα","","0.1277","0.0587","","0.1207","0.0983","","","","0.978","1.072","1.072","","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110660","26.121","0.007","26.121","0.007","7.433","0.003","90","","90","","120","","4392","2","296.2","","296.2","","","","","","","","","3","P 6 c c","P 6 -2c","184","","","","- C18 H6 S3 -","- C18 S3 -","- C252 S42 -","14","1.16667","","Imamura, Koichi; Takimiya, Kazuo; Otsubo, Tetsuo; Aso, Yoshio","Triphenyleno[1,12-bcd:4,5-b′c′d′:8,9-b″c″d″]trithiophene: the first bowl-shaped heteroaromatic","Chemical Communications","1999","","18","1859","","10.1039/a905860e","","","0.7107","MoKα","","0.2936","0.0851","","","","0.2502","","","","","","0.995","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110661","18.139","0.002","11.041","0.001","14.406","0.002","90","","109.05","0.01","90","","2727.1","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 S6 -","- C28 H26 S6 -","- C112 H104 S24 -","4","1","","Finn, Terry; Bryce, Martin R.; Batsanov, Andrei S.; Howard, Judith A. K.","The first bridged 9,10-bis(1,3-dithiol-2-ylidene)-9,10-dihydroanthracene derivatives: strained redox-active cyclophanes","Chemical Communications","1999","","18","1835","","10.1039/a905938e","","","0.71073","MoKα","","0.06","0.0347","","","0.0829","0.0924","","","","","","1.012","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110662","19.231","0.002","9.52","0.001","30.089","0.003","90","","90","","90","","5508.7","1","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C28 H26 S6 -","- C28 H26 S6 -","- C224 H208 S48 -","8","2","","Finn, Terry; Bryce, Martin R.; Batsanov, Andrei S.; Howard, Judith A. K.","The first bridged 9,10-bis(1,3-dithiol-2-ylidene)-9,10-dihydroanthracene derivatives: strained redox-active cyclophanes","Chemical Communications","1999","","18","1835","","10.1039/a905938e","","","0.71073","MoKα","","0.1108","0.0487","","","0.0816","0.0993","","","","","","1","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110663","10.944","0.004","14.591","0.005","16.924","0.007","71.18","0.01","89.65","0.02","85.66","0.01","2550.2","1.7","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","","","- C27 H24 S6 -","- C27 H24 S6.0036 -","- C108 H96 S24.0144 -","4","2","","Finn, Terry; Bryce, Martin R.; Batsanov, Andrei S.; Howard, Judith A. K.","The first bridged 9,10-bis(1,3-dithiol-2-ylidene)-9,10-dihydroanthracene derivatives: strained redox-active cyclophanes","Chemical Communications","1999","","18","1835","","10.1039/a905938e","","","0.71073","MoKα","","0.1028","0.0478","","","0.0889","0.1036","","","","","","0.975","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110664","5.619","0.0002","15.8672","0.0006","17.189","0.0007","90","","96.581","0.002","90","","1522.44","0.1","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","6-hexylsulfonyl-2-napthol","","- C16 H20 O3 S -","- C16 H20 O3 S -","- C64 H80 O12 S4 -","4","1","","Kowalik, Janusz; VanDerveer, Donald; Clower, Caroline; Tolbert, Laren M.","Hydrogen bonding and cooperativity effects on the assembly of alkyl- and perfluoroalkyl-sulfonyl naphthols: F···F non-bonded interactions†","Chemical Communications","1999","","19","2007","","10.1039/a905940g","","","0.71073","MoKα","","0.0829","0.0565","","","0.1211","0.1334","","","","","","1.015","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110665","33.2913","0.001","9.9469","0.0002","11.4174","0.0003","90","","99.187","0.001","90","","3732.32","0.17","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-perfluorohexylsulfonyl-2napthol","","- C16 H7 F13 O3 S -","- C16 H7 F13 O3 S -","- C128 H56 F104 O24 S8 -","8","2","","Kowalik, Janusz; VanDerveer, Donald; Clower, Caroline; Tolbert, Laren M.","Hydrogen bonding and cooperativity effects on the assembly of alkyl- and perfluoroalkyl-sulfonyl naphthols: F···F non-bonded interactions†","Chemical Communications","1999","","19","2007","","10.1039/a905940g","","","0.71073","MoKα","","0.1764","0.0971","","","0.232","0.2844","","","","","","1.022","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110666","9.2713","0.0011","10.329","0.003","13.245","0.002","91.773","0.016","93.314","0.011","95.349","0.014","1259.9","0.4","203","2","203","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H22 Cl2 I P Se -","- C25 H22 Cl2 I P Se -","- C50 H44 Cl4 I2 P2 Se2 -","2","1","","Boyle, Philip D.; Godfrey, Stephen M.; McAuliffe, Charles A.; Pritchard, Robin G.; Sheffield, Joanne M.","The structural characterisation of Ph3PSe(Ph)I. The first charge transfer (CT) complex of a tertiary phosphine containing a pseudohalogen","Chemical Communications","1999","","21","2159","","10.1039/a906039a","","","0.71073","MoKα","","0.0323","0.0251","","","0.0543","0.0569","","","","","","1.041","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110667","7.333","0.002","14.455","0.003","22.976","0.004","90","","90","","90","","2435.4","0.9","295","","295","","","","","","","","?","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H24 Cr N2 O4 -","- C27 H24 Cr N2 O4 -","- C108 H96 Cr4 N8 O16 -","4","1","","Rose-Munch, Françoise; Gagliardini, Vanessa; Perrotey, Anne; Tranchier, Jean-Philippe; Rose, Eric; Mangeney, Pierre; Alexakis, Alexandre; Kanger, Tonis; Vaissermann, Jacqueline","Two-step synthesis of homochiral monoaminals of tricarbonylphthalaldehydechromium complex","Chemical Communications","1999","","20","2061","","10.1039/a906043j","","","0.71073","MoKα","","","0.0442","","","0.0438","","","","","2.0941","2.0941","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7110668","8.4839","0.0003","13.709","0.001","17.887","0.001","90","","90","","90","","2080.4","0.2","294","","294","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H31 N O3 -","- C22 H31 N O3 -","- C88 H124 N4 O12 -","4","1","","Bertrand, Samuel; Hoffmann, Norbert; Pete, Jean-Pierre; Bulach, Véronique","Stereoselective radical-tandem reaction of aniline derivatives with (5R)-5-menthyloxy-2,5-dihydrofuran-2-one initiated by photochemical induced electron transfer","Chemical Communications","1999","","22","2291","","10.1039/a906051k","","","0.71073","Mo-Kα","","0.102","0.039","","0.07","","0.051","","","1.416","","","1.046","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110669","14.9058","0.0004","18.86","0.0004","24.56","0.0007","84.044","0.002","80.888","0.002","78.386","0.002","6659.2","0.3","173","","173","","","","","","","","","5","P -1","-P 1","2","","","","- C121 H139 Cl2 O S24 -","- C121 H105 Cl2 O S24 -","- C242 H210 Cl4 O2 S48 -","2","1","","Rao, Photon; Hosseini, Mir Wais; Cian, André De; Fischer, Jean","Synthesis and structural analysis of mercaptothiacalix[4]arene","Chemical Communications","1999","","21","2169","","10.1039/a906058h","","","0.71073","Mo-Kα","","0.194","0.076","","0.353","","0.093","","","5.885","","","1.392","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110670","25.23","0.01","31.84","0.01","20.951","0.008","90","","90","","90","","16830","11","296.2","","296.2","","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C48 H72 Cu7 F24 N9 P4 S9 W3 -","- C48 H72 Cu7 F24 N9 P4 S9 W3 -","- C384 H576 Cu56 F192 N72 P32 S72 W24 -","8","1","","Lang, Jian-Ping; Kawaguchi, Hiroyuki; Tatsumi, Kazuyuki","Synthesis and structures of a triply-fused incomplete-cubane cluster [{(η5-C5Me5)WS3}3Cu7(MeCN)9](PF6)4 and a 2D polymer [(η5-C5Me5)WS3Cu3Cl(MeCN)(pz)]PF6 (pz = pyrazine)","Chemical Communications","1999","","22","2315","","10.1039/a906081b","","","0.7107","MoKα","","0.0541","0.0541","","","0.0644","0.0644","","","","","","2.106","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110671","16.055","0.003","26.78","0.01","12.295","0.005","90","","90","","90","","5286","3","296.2","","296.2","","","","","","","","","9","P b c a","-P 2ac 2ab","61","","","","- C16 H22 Cl Cu3 F6 N3 P S3 W -","- C16 H22 Cl Cu3 F6 N3 P S3 W -","- C128 H176 Cl8 Cu24 F48 N24 P8 S24 W8 -","8","1","","Lang, Jian-Ping; Kawaguchi, Hiroyuki; Tatsumi, Kazuyuki","Synthesis and structures of a triply-fused incomplete-cubane cluster [{(η5-C5Me5)WS3}3Cu7(MeCN)9](PF6)4 and a 2D polymer [(η5-C5Me5)WS3Cu3Cl(MeCN)(pz)]PF6 (pz = pyrazine)","Chemical Communications","1999","","22","2315","","10.1039/a906081b","","","0.7107","MoKα","","0.0464","0.0464","","","0.05","0.05","","","","","","1.631","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110672","19.622","0.001","29.649","0.001","7.513","0.001","90","0.01","99.239","0.01","90","0.01","4314.2","0.6","115","","115","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C72 H50 N8 O17 Zn -","- C48 H30 N4 O9 Zn -","- C96 H60 N8 O18 Zn2 -","2","0.25","","Diskin-Posner, Yael; Goldberg, Israel","From porphyrin sponges to porphyrin sieves: a unique crystalline lattice of aquazinc tetra(4-carboxyphenyl)porphyrin with nanosized channels","Chemical Communications","1999","","19","1961","","10.1039/a906085e","","","0.7107","MoKα","","0.1121","0.071","","","0.1776","0.1982","","","","","","0.985","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7110673","6.0932","0.0007","7.5393","0.0009","19.114","0.002","96.044","0.003","99.102","0.003","96.538","0.003","854.54","0.17","160","2","160","2","","","","","","","","3","P -1","-P 1","2","","","","- C44 H14 F14 -","- C44 H14 F14 -","- C44 H14 F14 -","1","0.5","","Dai, Chaoyang; Nguyen, Paul; Marder, Todd B.; Marder, Todd B.; Scott, Andrew J.; Clegg, William; Viney, Christopher; Viney, Christopher","Control of single crystal structure and liquid crystal phase behaviour via arene–perfluoroarene interactions†","Chemical Communications","1999","","24","2493","","10.1039/a906199a","","","0.71073","MoKα","","0.0931","0.0685","","0.1661","0.1442","","","","1.239","1.251","1.251","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110674","14.447","0.001","14.561","0.001","12.214","0.001","108.002","0.007","106.92","0.007","89.069","0.007","2330.1","0.3","296.2","","296.2","","","","","","","","","7","P -1","-P 1","2","","","","- C37 H41 Cl3 Cu N12 O12 Zn -","- C37 H41 Cl3 Cu N12 O12 Zn -","- C74 H82 Cl6 Cu2 N24 O24 Zn2 -","2","1","","Ohtsu, Hideki; Shimazaki, Yuichi; Odani, Akira; Yamauchi, Osamu; Yamauchi, Osamu","A novel imidazolate-bridged copper–zinc heterodinuclear complex as a Cu, Zn–SOD active site model","Chemical Communications","1999","","23","2393","","10.1039/a906226b","","","1.5418","CuKα","","0.115","0.0762","","0.1266","0.111","","","","1.377","1.47","1.47","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110675","7.814","0.002","20.404","0.002","17.643","0.002","90","","101.77","0.01","90","","2753.8","0.8","296.2","","296.2","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C30 H34 O10 -","- C30 H34 O10 -","- C120 H136 O40 -","4","1","","Ohkita, Masakazu; Suzuki, Takanori; Tsuji, Takashi","Synthesis and reaction of 1,4-acetal-bridged 2,3,5,6-tetramethylidene-bicyclo[2.2.0]hexane: the first Diels–Alder route to Dewar benzenes","Chemical Communications","1999","","19","1999","","10.1039/a906239d","","","0.7107","MoKα","","0.0409","0.0409","","","0.037","0.037","","","","","","1.948","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110676","48.328","0.003","13.47","0.001","21.676","0.001","90","","115.003","0.003","90","","12788.2","1.4","180","","295","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C45 H86 Li4 O4 Si8 -","- C45 H86 Li4 O4 Si8 -","- C360 H688 Li32 O32 Si64 -","8","1","","Matsuo, Tsukasa; Fure, Hidetoshi; Sekiguchi, Akira","Isolation and characterization of the tetralithium salt of [5]radialene tetraanion stabilized by silyl groups","Chemical Communications","1999","","19","1981","","10.1039/a906253j","","","0.7107","MoKα","","0.0775","0.0775","","","0.2358","0.2358","","","","","","1.947","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110677","23.12","0.005","16.007","0.003","32.068","0.008","90","","111.177","0.004","90","","11066","4","296","2","296","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C57.63 H52.63 B4 N4 O6 -","- C57.768 H52.792 B4 N4 O6 -","- C462.144 H422.336 B32 N32 O48 -","8","1","","Comina, Paul J.; Philp, Douglas; Kariuki, Benson M.; Harris, Kenneth D. M.","Covalent self-assembly of a dimeric borazaaromatic macrocycle†","Chemical Communications","1999","","22","2279","","10.1039/a906257b","","","0.71069","MoKα","","0.1827","0.1013","","0.291","0.2386","","","","0.938","1.25","1.25","","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110678","12.931","0.002","10.404","0.002","21.463","0.004","90","","99.65","0.01","90","","2846.6","0.9","296.2","","296.2","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C17 H33 Cl3 Co N5 O14 S3 -","- C17 H33 Cl3 Co N5 O14 S3 -","- C68 H132 Cl12 Co4 N20 O56 S12 -","4","1","","Angus, Patricia M.; Sargeson, Alan M.; Willis, Anthony C.; Angus, Patricia M.; Sargeson, Alan M.","An amidine-functionalized cobalt(III) cage complex: synthesis, structure and properties","Chemical Communications","1999","","19","1975","","10.1039/a906389g","","","0.7107","MoKα","","","0.042","","","","0.024","","","","","","2.14","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110679","20.49","0.005","16.33","0.007","16.311","0.004","90","","120.013","0.016","90","","4726","3","173","2","173","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","","- C49 H58 Cd Cl3 N Pt -","- C48.99 H20 Cd Cl3.02 N Pt -","- C195.96 H80 Cd4 Cl12.08 N4 Pt4 -","4","0.5","","Charmant, J. P. H.; Gómez, J.; Orpen, A. G.; Falvello, L. R.; Forniés, J.; Rueda, A.; Gómez, J.; Lalinde, E.; Moreno, M. T.","Synthesis, structural characterisation and luminescence studies of the first alkynyl stabilised platinum‒cadmium complexes","Chemical Communications","1999","","20","2045","","10.1039/a906394c","","","0.71073","MoKα","","0.0485","0.0383","","","0.1074","0.1116","","","","","","1.036","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110680","40.625","0.006","20.382","0.001","25.482","0.004","90","","106.54","0.01","90","","20226","5","150","2","150","2","","","","","","","","7","I 1 2/a 1","-I 2ya","15","","","","- C64 H93.17 Cd2 Cl4 N2 O0.58 Pt -","- C64 H84 Cd2 Cl4 N2 O0.583333 Pt -","- C768 H1008 Cd24 Cl48 N24 O7 Pt12 -","12","1.5","","Charmant, J. P. H.; Gómez, J.; Orpen, A. G.; Falvello, L. R.; Forniés, J.; Rueda, A.; Gómez, J.; Lalinde, E.; Moreno, M. T.","Synthesis, structural characterisation and luminescence studies of the first alkynyl stabilised platinum‒cadmium complexes","Chemical Communications","1999","","20","2045","","10.1039/a906394c","","","0.71073","MoKα","","0.1748","0.0745","","","0.1673","0.1881","","","","","","0.956","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110681","11.245","0.002","16.635","0.002","10.714","0.002","96.95","0.01","101.14","0.02","73.22","0.01","1878.1","0.6","296.2","","296.2","","","","","","","","","4","P -1","-P 1","2","","","","- C20 H28 N2 O -","- C20 H28 N2 O -","- C80 H112 N8 O4 -","4","2","","Clayden, Jonathan; McCarthy, Catherine; Helliwell, Madeleine","Bonded peri-interactions govern the rate of racemisation of atropisomeric 8-substituted 1-naphthamides†","Chemical Communications","1999","","20","2059","","10.1039/a906398f","","","1.5418","CuKα","","0.1707","0.0744","","0.0595","0.0551","","","","2.158","2.943","2.943","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110682","15.514","0.006","15.239","0.002","15.305","0.003","90","","90","","90","","3618.4","1.6","296.2","","296.2","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C19 H26 N2 O -","- C19 H26 N2 O -","- C152 H208 N16 O8 -","8","1","","Clayden, Jonathan; McCarthy, Catherine; Helliwell, Madeleine","Bonded peri-interactions govern the rate of racemisation of atropisomeric 8-substituted 1-naphthamides†","Chemical Communications","1999","","20","2059","","10.1039/a906398f","","","1.5418","CuKα","","0.0911","0.0529","","0.0474","0.0455","","","","2.843","3.508","3.508","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110683","7.956","0.001","14.53","0.001","14.392","0.002","90","","97.53","0.01","90","","1649.4","0.3","296.2","","296.2","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H23 N O2 -","- C18 H23 N O2 -","- C72 H92 N4 O8 -","4","1","","Clayden, Jonathan; McCarthy, Catherine; Helliwell, Madeleine","Bonded peri-interactions govern the rate of racemisation of atropisomeric 8-substituted 1-naphthamides†","Chemical Communications","1999","","20","2059","","10.1039/a906398f","","","1.5418","CuKα","","0.066","0.0485","","0.0332","0.0326","","","","3.405","3.803","3.803","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110684","10.79","0.003","25.204","0.004","11.938","0.002","90","","104.56","0.02","90","","3142.3","1.2","296.2","","296.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 N O2 -","- C17 H21 N O2 -","- C136 H168 N8 O16 -","8","2","","Clayden, Jonathan; McCarthy, Catherine; Helliwell, Madeleine","Bonded peri-interactions govern the rate of racemisation of atropisomeric 8-substituted 1-naphthamides†","Chemical Communications","1999","","20","2059","","10.1039/a906398f","","","1.5418","CuKα","","0.1909","0.0648","","0.0496","0.0401","","","","1.408","1.796","1.796","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110685","8.753","0.002","13.781","0.002","12.168","0.001","90","","107.865","0.01","90","","1397","0.4","296.2","","296.2","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 N2 O -","- C15 H18 N2 O -","- C60 H72 N8 O4 -","4","1","","Clayden, Jonathan; McCarthy, Catherine; Helliwell, Madeleine","Bonded peri-interactions govern the rate of racemisation of atropisomeric 8-substituted 1-naphthamides†","Chemical Communications","1999","","20","2059","","10.1039/a906398f","","","1.5418","CuKα","","0.083","0.0561","","0.0513","0.0497","","","","2.898","3.354","3.354","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110686","13.485","0.002","19.834","0.003","23.522","0.005","69.66","0.02","75.12","0.02","83.331","0.019","5698.6","1.9","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C172 H212 N8 O40 Rh8 -","- C172 H212 N8 O40 Rh8 -","- C172 H212 N8 O40 Rh8 -","1","0.5","","Bonar-Law, Richard P.; McGrath, Thomas D.; Singh, Nirmal; Bickley, Jamie F.; Steiner, Alexander","Dinuclear complexes as connectors for carboxylates. Self-assembly of a molecular box","Chemical Communications","1999","","24","2457","","10.1039/a906415j","","","0.71073","MoKα","","0.2313","0.0633","","","0.1521","0.1913","","","","","","0.628","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110687","31.6","0.004","31.6","0.004","12.7","0.003","90","","90","","120","","10983","3","213","2","213","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.; Steiner, Alexander","Dinuclear complexes as connectors for carboxylates. Self-assembly of a molecular box","Chemical Communications","1999","","24","2457","","10.1039/a906415j","","","0.71073","MoKα","","0.0769","0.06","","","0.1535","0.1767","","","","","","1.11","","","","has coordinates","287929","2023-12-01","12:10:10",""
"7110688","18.9632","0.0009","22.3542","0.0011","22.7952","0.0012","90","","90","","90","","9663","0.8","223","2","223","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C38 H42 B Cl6 I N6 S3 Zn -","- C38 H42 B Cl6 I N6 S3 Zn -","- C304 H336 B8 Cl48 I8 N48 S24 Zn8 -","8","1","","Kimblin, Clare; Bridgewater, Brian M.; Churchill, David G.; Parkin, Gerard","Mononuclear tris(2-mercapto-1-arylimidazolyl)hydroborato complexes of zinc, [TmAr]ZnX: structural evidence that a sulfur rich coordination environment promotes the formation of a tetrahedral alcohol complex in a synthetic analogue of LADH","Chemical Communications","1999","","22","2301","","10.1039/a906561j","","","0.71073","MoKα","","0.0825","0.0585","","","0.1552","0.1751","","","","","","1.027","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110689","13.592","0.0011","16.3598","0.0012","20.1484","0.0015","90","","92.037","0.002","90","","4477.4","0.6","233","2","233","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C38 H48 B Cl N6 O6 S3 Zn -","- C38 H48 B Cl1.002 N6 O6 S3 Zn -","- C152 H192 B4 Cl4.008 N24 O24 S12 Zn4 -","4","1","","Kimblin, Clare; Bridgewater, Brian M.; Churchill, David G.; Parkin, Gerard","Mononuclear tris(2-mercapto-1-arylimidazolyl)hydroborato complexes of zinc, [TmAr]ZnX: structural evidence that a sulfur rich coordination environment promotes the formation of a tetrahedral alcohol complex in a synthetic analogue of LADH","Chemical Communications","1999","","22","2301","","10.1039/a906561j","","","0.71073","MoKα","","0.1113","0.0477","","","0.1036","0.1194","","","","","","1.051","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110690","19.6233","0.0018","24.93","0.002","33.1","0.002","90","","90","","90","","16193","2","233","2","233","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C36 H42 B Cl N6 O0.5 S3 Zn -","- C36 H40 B Cl N6 O0.5 S3 Zn -","- C576 H640 B16 Cl16 N96 O8 S48 Zn16 -","16","2","","Kimblin, Clare; Bridgewater, Brian M.; Churchill, David G.; Parkin, Gerard","Mononuclear tris(2-mercapto-1-arylimidazolyl)hydroborato complexes of zinc, [TmAr]ZnX: structural evidence that a sulfur rich coordination environment promotes the formation of a tetrahedral alcohol complex in a synthetic analogue of LADH","Chemical Communications","1999","","22","2301","","10.1039/a906561j","","","0.71073","MoKα","","0.1151","0.0461","","","0.1048","0.1208","","","","","","1.067","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110691","17.216","0.005","9.756","0.003","20.381","0.006","90","","97.089","0.005","90","","3397","1.8","223","2","223","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C28 H23 B Cl3 N7 O3 S3 Zn -","- C28 H23 B Cl3 N7 O3 S3 Zn -","- C112 H92 B4 Cl12 N28 O12 S12 Zn4 -","4","1","","Kimblin, Clare; Bridgewater, Brian M.; Churchill, David G.; Parkin, Gerard","Mononuclear tris(2-mercapto-1-arylimidazolyl)hydroborato complexes of zinc, [TmAr]ZnX: structural evidence that a sulfur rich coordination environment promotes the formation of a tetrahedral alcohol complex in a synthetic analogue of LADH","Chemical Communications","1999","","22","2301","","10.1039/a906561j","","","0.71073","MoKα","","0.0823","0.0699","","","0.2019","0.2167","","","","","","1.045","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110692","18.6903","0.0015","12.3699","0.001","14.2711","0.001","90","","90","","90","","3299.4","0.4","203","2","203","2","","","","","","","","8","P n a 21","P 2c -2n","33","","","","- C28 H23 B Cl3 I N6 S3 Zn -","- C28 H23 B Cl3 I N6 S3 Zn -","- C112 H92 B4 Cl12 I4 N24 S12 Zn4 -","4","1","","Kimblin, Clare; Bridgewater, Brian M.; Churchill, David G.; Parkin, Gerard","Mononuclear tris(2-mercapto-1-arylimidazolyl)hydroborato complexes of zinc, [TmAr]ZnX: structural evidence that a sulfur rich coordination environment promotes the formation of a tetrahedral alcohol complex in a synthetic analogue of LADH","Chemical Communications","1999","","22","2301","","10.1039/a906561j","","","0.71073","MoKα","","0.0776","0.0417","","","0.0614","0.0693","","","","","","0.96","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110693","36.693","0.004","14.866","0.005","18.172","0.01","90","","108.61","0.03","90","","9394","6","163","2","163","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Di-tBu-pyrrolyl-THF-strontium","","","- C45 H79 N3 O1.5 Sr1.5 -","- C45 H79 N3 O1.5 Sr1.5 -","- C360 H632 N24 O12 Sr12 -","8","1","","Schumann, Herbert; Gottfriedsen, Jochen; Demtschuk, Jörg","Synthesis and structure of η5-bonded pyrrolyl complexes of calcium and strontium","Chemical Communications","1999","","20","2091","","10.1039/a906654c","","","0.71069","MoKα","","0.1227","0.0594","","","0.1574","0.1869","","","","","","1.022","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110694","36.43","0.02","14.843","0.003","18.053","0.003","90","","108.45","0.03","90","","9260","6","163","2","163","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","Di-tBu-pyrrolyl-THF-calcium","","","- C45 H79 Ca1.5 N3 O1.5 -","- C45 H79 Ca1.5 N3 O1.5 -","- C360 H632 Ca12 N24 O12 -","8","1","","Schumann, Herbert; Gottfriedsen, Jochen; Demtschuk, Jörg","Synthesis and structure of η5-bonded pyrrolyl complexes of calcium and strontium","Chemical Communications","1999","","20","2091","","10.1039/a906654c","","","0.71069","MoKα","","0.1009","0.073","","","0.2139","0.2314","","","","","","1.035","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110695","21.454","0.011","16.315","0.006","29.651","0.012","90","","90","","90","","10379","8","293","2","293","2","","","","","","","","7","P b c a","-P 2ac 2ab","61","vbp-j1","","","- C24 H120 B6 N17 O86 P12 V12 -","- C24 H136.2 B6 N15.2 O85 P12 V12 -","- C96 H544.8 B24 N60.8 O340 P48 V48 -","4","0.5","","Zhao, Yongnan; Zhu, Guangshan; Liu, Wang; Zou, Yongcun; Pang, Wenqin","Synthesis and structures of two new 12-member ring crown-shaped oxovanadium borophosphates","Chemical Communications","1999","","21","2219","","10.1039/a906668c","","","0.71073","MoKα","","0.1014","0.0586","","","0.1708","0.1901","","","","","","0.84","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110696","21.537","0.002","16.2667","0.0013","29.717","0.004","90","","90","","90","","10410.9","1.9","293","2","293","2","","","","","","","","8","P b c a","-P 2ac 2ab","61","vbp-j2","","","- C28 H128 B6 K N20 O84 P12 V12 -","- C30 H132 B6 K N18 O84 P12 V12 -","- C120 H528 B24 K4 N72 O336 P48 V48 -","4","0.5","","Zhao, Yongnan; Zhu, Guangshan; Liu, Wang; Zou, Yongcun; Pang, Wenqin","Synthesis and structures of two new 12-member ring crown-shaped oxovanadium borophosphates","Chemical Communications","1999","","21","2219","","10.1039/a906668c","","","0.71073","MoKα","","0.0839","0.0576","","","0.154","0.1754","","","","","","0.95","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7110697","17.3435","0.0006","17.3435","0.0006","24.104","0.001","90","","90","","90","","7250.4","0.5","173","","173","","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C68 H68 Cl12 N8 O4 -","- C68 H68 Cl12 N8 O4 -","- C272 H272 Cl48 N32 O16 -","4","0.25","","Jaunky, Wojciech; Hosseini, Mir Wais; Planeix, Jean Marc; Cian, André De; Kyritsakas, Nathalie; Fischer, Jean","Molecular braids: quintuple helical hydrogen bonded molecular network†","Chemical Communications","1999","","22","2313","","10.1039/a906728k","","","0.71073","Mo-Kα","","0.183","0.067","","0.14","","0.079","","","2.483","","","1.414","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110698","17.208","0.001","17.208","0.001","23.775","0.001","90","","90","","90","","7040.1","0.6","173","","173","","","","","","","","","4","P 41","P 4w","76","","","","- C77 H77 N9 O8 -","- C77 H62 N9 O8 -","- C308 H248 N36 O32 -","4","1","","Jaunky, Wojciech; Hosseini, Mir Wais; Planeix, Jean Marc; Cian, André De; Kyritsakas, Nathalie; Fischer, Jean","Molecular braids: quintuple helical hydrogen bonded molecular network†","Chemical Communications","1999","","22","2313","","10.1039/a906728k","","","0.71073","Mo-Kα","","0.308","0.099","","0.224","","0.121","","","3.22","","","1.676","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7110699","10.034","0.002","11.487","0.002","16.326","0.003","98.92","0.03","92.62","0.03","90.55","0.03","1856.8","0.6","200","2","200","2","","","","","","","","4","P -1","-P 1","2","","","","- C35 H57 Si3 Ti -","- C35 H57 Si3 Ti -","- C70 H114 Si6 Ti2 -","2","1","","Pellny, Paul-Michael; Kirchbauer, Frank G.; Burlakov, Vladimir V.; Spannenberg, Anke; Rosenthal, Uwe","Unusual formation of a hex-3-ene-1,5-diyne-3-yl ligand from a buta-1,3-diyne in the Cp*2TiCl2‒Mg system","Chemical Communications","1999","","24","2505","","10.1039/a906777i","","","0.71073","MoKα","","0.0808","0.0598","","0.1605","0.1522","","","","1.063","1.186","1.186","","","","","has coordinates,has disorder","180220","2020-10-21","18:00:00",""
"7110700","6.415","0.002","19.871","0.005","21.298","0.008","90","","90","","90","","2714.9","1.5","190","","190","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H33 N3 O9 -","- C28 H33 N3 O9 -","- C112 H132 N12 O36 -","4","1","","Hodgson, David M.; Stupple, Paul A.; Johnstone, Craig","Efficient RhII binaphthol phosphate catalysts for enantioselective intramolecular tandem carbonyl ylide formation–cycloaddition of α-diazo-β-keto esters","Chemical Communications","1999","","21","2185","","10.1039/a906787f","","","1.5418","CuKα","","","0.0456","","","","0.0398","","","","","","1.0493","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110701","12.269","0.003","19.417","0.004","26.192","0.005","90","","103.49","0.03","90","","6067","2","143","2","143","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C56 H96 Li2 N4 Ni O12 -","- C56 H96 Li2 N4 Ni O12 -","- C224 H384 Li8 N16 Ni4 O48 -","4","0.5","","Bonomo, Lucia; Solari, Euro; Scopelliti, Rosario; Floriani, Carlo; Latronico, Mario","Porphodimethene–porphyrinogen relationship: the generation of unprecedented forms of porphyrinogen†","Chemical Communications","1999","","21","2227","","10.1039/a906817a","","","0.7107","MoKα","","0.118","0.0689","","","0.1844","0.2153","","","","","","0.966","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110702","11.755","0.002","20.644","0.004","19.117","0.004","90","","95.22","0.03","90","","4619.9","1.5","143","2","143","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H73 Li4 N5 O6 -","- C46 H73 Li4 N5 O6 -","- C184 H292 Li16 N20 O24 -","4","1","","Bonomo, Lucia; Solari, Euro; Scopelliti, Rosario; Floriani, Carlo; Latronico, Mario","Porphodimethene‒porphyrinogen relationship: the generation of unprecedented forms of porphyrinogen†","Chemical Communications","1999","","21","2227","","10.1039/a906817a","","","0.7107","MoKα","","0.1051","0.0789","","","0.2282","0.2481","","","","","","1.04","","","","has coordinates,has disorder","180221","2020-10-21","18:00:00",""
"7110703","6.977","0.003","10.932","0.0011","12.6768","0.0008","96.151","0.007","99.368","0.014","95.04","0.02","943","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C12 H21 B9 N O3 Re -","- C12 H21 B9 N O3 Re -","- C24 H42 B18 N2 O6 Re2 -","2","1","","Ellis, Dianne D.; Jelliss, Paul A.; Stone, F. Gordon A.","Rhenacarborane complexes with nitrosyl and alkylidene ligands. Structures of the complexes [Re{C(OMe)C6H4Me-4}(NO)(CO)(η5-7,8-C2B9H11)] and [Re(NO)(CNBut){η5,σ-7-CN(H)But-7,8-C2B9H10}]","Chemical Communications","1999","","23","2385","","10.1039/a907144j","","","0.71073","MoKα","","0.0573","0.0429","","0.0981","","0.0919","","","1.074","","","1.103","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110704","18.6363","0.0029","11.7568","0.0016","21.299","0.0061","90","","109.11","0.019","90","","4409.5","1.6","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H29 B9 N3 O Re -","- C12 H29 B9 N3 O Re -","- C96 H232 B72 N24 O8 Re8 -","8","2","","Ellis, Dianne D.; Jelliss, Paul A.; Stone, F. Gordon A.","Rhenacarborane complexes with nitrosyl and alkylidene ligands. Structures of the complexes [Re{C(OMe)C6H4Me-4}(NO)(CO)(η5-7,8-C2B9H11)] and [Re(NO)(CNBut){η5,σ-7-CN(H)But-7,8-C2B9H10}]","Chemical Communications","1999","","23","2385","","10.1039/a907144j","","","0.71073","MoKα","","0.0863","0.0512","","0.0991","","0.0889","","","1.03","","","1.112","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110705","5.98","0.0004","9.509","0.0005","14.1543","0.0008","89.694","0.006","81.471","0.005","87.322","0.005","795.1","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-cyclohexyl-N'-(butylaminocarbonyl)squaramide","","- C15 H23 N3 O3 -","- C15 H23 N3 O3 -","- C30 H46 N6 O6 -","2","1","","Davis, Anthony P.; Draper, Sylvia M.; Dunne, Gavin; Ashton, Peter","The N-carbamoyl squaramide dimer: a compact, strongly associated H-bonding motif","Chemical Communications","1999","","22","2265","","10.1039/a907179b","","","0.71073","MoKα","","0.1081","0.051","","0.1575","0.125","","","","1.07","1.13","1.13","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110706","4.925","0.002","7.121","0.002","8.066","0.002","96.51","0.02","107.12","0.02","108.68","0.02","249.28","0.15","298","","298","","","","","","","","","4","P -1","-P 1","2","","","","- Al2 Cs2 O9 P2 -","- Al2 Cs2 O8.5 P2 -","- Al2 Cs2 O8.5 P2 -","1","0.5","","Huang, Qun; Hwu, Shiou-Jyh","Cs2Al2P2O9: an exception to Löwenstein’s rule. Synthesis and characterization of a novel layered aluminophosphate containing linear Al‒O‒Al linkages","Chemical Communications","1999","","23","2343","","10.1039/a907194f","","","0.71073","MoKα","","0.0242","0.0235","","0.348","0.0345","","","","","1.36","1.36","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110707","8.6242","0.001","20.6008","0.0008","7.2767","0.0011","90","","90","","90","","1292.8","0.3","283","2","283","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","3',O-4'-C-methylene-5-methyluridine","3',O-4'-C-methylene-5-methyluridine","","- C11 H16 N2 O7 -","- C11 H16 N2 O7 -","- C44 H64 N8 O28 -","4","1","","Obika, Satoshi; Morio, Ken-ichiro; Hari, Yoshiyuki; Imanishi, Takeshi","Facile synthesis and conformation of 3′-O,4′-C-methyleneribonucleosides","Chemical Communications","1999","","23","2423","","10.1039/a907218g","","","1.54051","CuKα","","0.0379","0.0321","","0.0854","0.0806","","","","1.08","1.093","1.093","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110708","10.442","0.003","17.347","0.006","17.83","0.005","90","","105.31","0.02","90","","3115.1","1.7","296.2","","296.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H56 Co N8 O7 -","- C25 H54 Co N8 O7 -","- C100 H216 Co4 N32 O28 -","4","0.5","","Geue, Rodney J.; Jin Qin, C.; Ralph, Stephen F.; Sargeson, Alan M.; Skelton, Brian W.; White, Allan H.; Willis, Anthony C.","Sterically induced transmutations in cobalt amine chemistry","Chemical Communications","1999","","23","2351","2352","10.1039/a907237c","","","0.7107","MoKα","","","0.044","","","","0.032","","","","","","2.01","","","","has coordinates","256940","2020-10-21","18:00:00",""
"7110709","10.733","0.004","19.038","0.004","15.678","0.004","90","","90","","90","","3203.6","1.6","296.2","","296.2","","","","","","","","","6","P b c n","-P 2n 2ab","60","","","","- C25 H54 Cl4 Co N6 Zn -","- C25 H54 Cl4 Co N6 Zn -","- C100 H216 Cl16 Co4 N24 Zn4 -","4","0.5","","Geue, Rodney J.; Jin Qin, C.; Ralph, Stephen F.; Sargeson, Alan M.; Skelton, Brian W.; White, Allan H.; Willis, Anthony C.","Sterically induced transmutations in cobalt amine chemistry","Chemical Communications","1999","","23","2351","2352","10.1039/a907237c","","","0.7107","MoKα","","","0.0342","","","","0.0289","","","","","","1.748","","","","has coordinates","256940","2020-10-21","18:00:00",""
"7110710","50.392","0.004","11.614","0.0008","23.8148","0.0012","90","","105.537","0.005","90","","13428.4","1.6","143","2","143","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C66 H96 Li2 Mo2 N4 Ni O12 -","- C66 H96 Li2 Mo2 N4 Ni O12 -","- C528 H768 Li16 Mo16 N32 Ni8 O96 -","8","1","","Bonomo, Lucia; Solari, Euro; Martin, Géraldine; Scopelliti, Rosario; Floriani, Carlo","Porphyrinogen tetraanion functioning as a polymetallic assembler: nickel-meso-octaethylporphyrinogen binding four transition metal ions at the periphery","Chemical Communications","1999","","22","2319","","10.1039/a907268c","","","0.71073","MoKα","","0.063","0.0536","","","0.1303","0.1411","","","","","","1.104","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110711","27.3","0.006","17.269","0.002","18.076","0.002","90","","96.17","0.02","90","","8472","2","143","2","143","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C82 H110 Li2 Mo4 N4 Ni O19 -","- C82 H110 Li2 Mo4 N4 Ni O19 -","- C328 H440 Li8 Mo16 N16 Ni4 O76 -","4","1","","Bonomo, Lucia; Solari, Euro; Martin, Géraldine; Scopelliti, Rosario; Floriani, Carlo","Porphyrinogen tetraanion functioning as a polymetallic assembler: nickel-meso-octaethylporphyrinogen binding four transition metal ions at the periphery","Chemical Communications","1999","","22","2319","","10.1039/a907268c","","","0.7107","MoKα","","0.0547","0.0473","","","0.1273","0.134","","","","","","1.055","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110712","17.02","0.002","6.4973","0.0007","6.4992","0.0007","90","","109.304","0.002","90","","678.3","0.13","223","2","223","2","","","","","","","hydrothermal synthesis","7","C 1 2/m 1","-C 2y","12","","","","- C4 H14.6 F0.4 N2 Nb4 O28.6 P5 -","- C4 N2 Nb4 O27.84 P4.96 -","- C4 N2 Nb4 O27.84 P4.96 -","1","0.125","","Wang, Xiqu; Liu, Lumei; Cheng, Heidi; Jacobson, Allan J.","The synthesis and single crystal structure of an amino acid intercalated layered niobium phosphate: [(NbOPO4)4•(H3NCH2CO2H)2][H2PO4][OH, F]","Chemical Communications","1999","","24","2531","","10.1039/a907293d","","","0.71073","MoKα","","0.0362","0.0345","","0.0892","0.0883","","","","1.173","1.189","1.189","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110713","17.006","0.009","18.764","0.004","13.421","0.007","90","","92.05","0.03","90","","4280","3","294","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H15.5 Br2 Cl1.5 N2 -","- C23 H15.5 Br2 Cl1.5 N2 -","- C184 H124 Br16 Cl12 N16 -","8","1","","Rahman, A. Noman M. M.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Clathrate formation between halogenated species","Chemical Communications","1999","","23","2389","","10.1039/a907357d","","","0.71073","MoKα","","","0.059","","","","0.069","","","","","","2.01","","","","has coordinates","296815","2024-12-10","09:29:12",""
"7110714","14.832","0.007","16.754","0.005","18.084","0.009","90","","110.8","0.02","90","","4201","3","294","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C22.5 H14.5 Br2 Cl1.5 N2 -","- C22.75 H14.75 Br2 Cl2.25 N2 -","- C182 H118 Br16 Cl18 N16 -","8","2","","Rahman, A. Noman M. M.; Bishop, Roger; Craig, Donald C.; Scudder, Marcia L.","Clathrate formation between halogenated species","Chemical Communications","1999","","23","2389","","10.1039/a907357d","","","1.54184","CuKα","","","0.051","","","","0.071","","","","","","2.04","","","","has coordinates","296815","2024-12-10","09:29:12",""
"7110715","11.047","0.003","18.643","0.007","7.433","0.002","90.94","0.03","100.51","0.02","74.04","0.02","1446.2","0.8","296.2","","296.2","","","","","","","","","6","P -1","-P 1","2","","","","- C21 H20 Au1.5 N4 O S8 -","- C21 H20 Au1.5 N4 O S8 -","- C42 H40 Au3 N8 O2 S16 -","2","1","","Fujiwara, Hideki; Kobayashi, Hayao","New π-extended organic donor containing a stable TEMPO radical as a candidate for conducting magnetic multifunctional materials","Chemical Communications","1999","","23","2417","","10.1039/a907363i","","","0.7107","MoKα","","","0.0458","","","0.0472","","","","","1.829","1.829","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110716","9.599","0.002","26.053","0.007","11.809","0.002","90","","104.21","0.01","90","","2862.9","1.1","296.2","","296.2","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C69 H63 Cl3 N4 O Zn -","- C69 H62 Cl3 N4 O Zn0.5 -","- C138 H124 Cl6 N8 O2 Zn -","2","0.5","","Ito, Satoshi; Murashima, Takashi; Ono, Noboru; Uno, Hidemitsu","Synthesis, properties and crystal structures of rigid porphyrins fused with bicyclo[2.2.2]octene units","Chemical Communications","1999","","22","2275","","10.1039/a907460k","","","0.7107","MoKα","","0.0804","0.08","","0.055","","0.055","","","1.947","","","1.95","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110717","11.777","0.0003","15.9118","0.0004","16.058","0.0004","105.459","0.001","90.871","0.001","105.767","0.001","2778.69","0.12","123","1","123","1","","","","","","","","4","P -1","-P 1","2","(calix[5]arene-p-sulfonicacid)(H2SO4)4(H2O)1.5","calix[5]arene-penta-(p-sulfonic acid) tetra-(sulfuric acid) hydrate","","- C35 H49 O37.5 S9 -","- C35 H18 O37.5 S9 -","- C70 H36 O75 S18 -","2","1","","Hardie, Michaele J.; Makha, Mohamed; Raston, Colin L.","Confinement of dimeric sulfuric acid in a self-assembled molecular capsule: [(H2SO4)2⊂(calix[5]arenesulfonic acid)2]","Chemical Communications","1999","","23","2409","","10.1039/a907469d","","","0.71073","MoKα","","0.1995","0.1267","","","0.3569","0.4012","","","","","","1.384","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110718","9.2719","0.0008","10.433","0.001","14.4569","0.0011","106.122","0.004","107.714","0.005","94.691","0.004","1258.5","0.2","90","1","90","1","","","","","","","","5","P -1","-P 1","2","triphenylphosphine oxide p-amino-p'-nitrobiphenyl","","","- C30 H25 N2 O3 P -","- C30 H25 N2 O3 P -","- C60 H50 N4 O6 P2 -","2","1","","Zhang, Yuegang; Coppens, Philip","The change in the X-ray dipole moment as a quantitative measure of the polarizing effect of the molecular environment: application to a complex of p-amino-p′-nitrobiphenyl with triphenylphosphine oxide","Chemical Communications","1999","","23","2425","","10.1039/a907473b","","","0.71073","MoKα","","0.0497","0.0334","","","0.0837","0.0873","","","","","","0.865","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110719","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","","Dinger, Maarten B.; Scott, Michael J.","Selective binding of substrates using sodium salts of linked C3 symmetric aryl oxides","Chemical Communications","1999","","24","2525","","10.1039/a907476g","","","0.71073","MoKα","","0.0755","0.0681","","","0.182","0.1928","","","","","","1.098","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7110720","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","","Dinger, Maarten B.; Scott, Michael J.","Selective binding of substrates using sodium salts of linked C3 symmetric aryl oxides","Chemical Communications","1999","","24","2525","","10.1039/a907476g","","","0.71073","MoKα","","0.1241","0.0746","","","0.2032","0.2395","","","","","","1.029","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110721","10.5718","0.0014","14.8923","0.0014","12.5186","0.0011","90","0.008","91.504","0.01","90","0.012","1970.2","0.4","223","2","223","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C42 H46 Cl2 Mo N2 O4 -","- C42 H46 Cl2 Mo N2 O4 -","- C84 H92 Cl4 Mo2 N4 O8 -","2","1","","A. Kretzschmar, Eike; Kipke, Jennifer; Sundermeyer, Jörg","The first chiral diimido chelate complexes of molybdenum and tungsten: transition metal diimido complexes on the way to asymmetric catalysis","Chemical Communications","1999","","23","2381","","10.1039/a907525i","","","0.71073","MoKα","","0.0344","0.0319","","","0.0817","0.0837","","","","","","1.022","","","","has coordinates","288183","2023-12-08","14:43:00",""
"7110722","26.96","0.005","5.916","0.002","10.299","0.003","90","","90","","90","","1642.6","0.8","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","[C2tBu2P2NPh]","","","- C16 H23 N P2 -","- C16 H23 N P2 -","- C64 H92 N4 P8 -","4","1","","Cloke, F. Geoffrey N.; Hitchcock, Peter B.; Nixon, John F.; James Wilson, D.; Tabellion, Frank; Fischbeck, Uwe; Preuss, Fritz; Regitz, Manfred","Synthetic, structural and theoretical studies on new aromatic 1,2,4-azadiphosphole ring systems: crystal and molecular structure of P2C2But2NPh","Chemical Communications","1999","","23","2363","","10.1039/a907550j","","","0.71073","MoKα","","0.069","0.0444","","0.1058","0.086","","","","1.11","1.031","1.031","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110723","10.96","0.002","21.081","0.004","24.039","0.005","90","","90.42","0.03","90","","5554","1.9","143","2","143","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C61 H73 N7 O8 -","- C61 H73 N7 O8 -","- C244 H292 N28 O32 -","4","1","","Bonomo, Lucia; Solari, Euro; Toraman, Gülsen; Scopelliti, Rosario; Floriani, Carlo; Latronico, Mario","A cylindrical cavity with two different hydrogen-binding boundaries: the calix[4]arene skeleton screwed onto the meso-positions of the calix[4]pyrrole†","Chemical Communications","1999","","23","2413","","10.1039/a907563a","","","0.7107","MoKα","","0.1643","0.0942","","","0.2387","0.2662","","","","","","1.378","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110724","20.054","0.005","20.054","0.005","11.079","0.003","90","","90","","120","","3858.6","1.7","143","2","143","2","","","","","","","","4","P 32","P 32","145","","","","- C58 H64 N4 O11 -","- C58 H64 N4 O11 -","- C174 H192 N12 O33 -","3","1","","Bonomo, Lucia; Solari, Euro; Toraman, Gülsen; Scopelliti, Rosario; Floriani, Carlo; Latronico, Mario","A cylindrical cavity with two different hydrogen-binding boundaries: the calix[4]arene skeleton screwed onto the meso-positions of the calix[4]pyrrole†","Chemical Communications","1999","","23","2413","","10.1039/a907563a","","","0.7107","MoKα","","0.0677","0.0459","","","0.0968","0.1105","","","","","","1.014","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110725","11.358","0.0019","19.927","0.003","35.86","0.004","90","","94.4","0.012","90","","8092","2","143","2","143","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C91 H94 N8 O13 -","- C91 H94 N8 O13 -","- C364 H376 N32 O52 -","4","1","","Bonomo, Lucia; Solari, Euro; Toraman, Gülsen; Scopelliti, Rosario; Floriani, Carlo; Latronico, Mario","A cylindrical cavity with two different hydrogen-binding boundaries: the calix[4]arene skeleton screwed onto the meso-positions of the calix[4]pyrrole†","Chemical Communications","1999","","23","2413","","10.1039/a907563a","","","0.71073","MoKα","","0.219","0.1119","","","0.2542","0.3308","","","","","","1.052","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110726","10.122","0.0003","9.4659","0.0002","15.7849","","90","","95.805","0.001","90","","1504.66","0.05","150","2","150","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C6 H34 Al3 Cl Li2 O25 P6 -","- C6 H18 Al3 Cl Li2 O25 P6 -","- C12 H36 Al6 Cl2 Li4 O50 P12 -","2","1","","Hix, Gary B.; Wragg, David S.; Bull, Ivor; Morris, Russell E.; Wright, Paul A.","Synthesis and structure of Li2Al3(HO3PMe)2(O3PMe)4Cl·7H2O,an ionic, layered lithium aluminium methylphosphonate","Chemical Communications","1999","","23","2421","","10.1039/a907599b","","","0.6894","synchrotron","","0.0552","0.0541","","","0.1368","0.1379","","","","","","0.675","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110727","7.6507","0.0012","19.765","0.004","9.5012","0.0018","90","","108.826","0.015","90","","1359.9","0.4","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C10 H10 Cl4 N2 Zn -","- C10 H10 Cl4 N2 Zn -","- C40 H40 Cl16 N8 Zn4 -","4","1","","Gillon, Amy L.; Guy Orpen, A.; Starbuck, Jonathan; Wang, Xi-Meng; Rodríguez-Martín, Yolanda; Ruiz-Pérez, Catalina","Cation-controlled formation of [{MCl4}n]2n− chains in [4,4′-H2bipy][MCl4] (M = Mn, Cd): an alternative to the A2MCl4 <100> layer perovskite structure†","Chemical Communications","1999","","22","2287","","10.1039/a907681f","","","0.71073","MoKα","","0.048","0.0263","","","0.051","0.0554","","","","","","0.917","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110728","15.526","0.002","12.66","0.003","6.914","0.002","90","","114.896","0.016","90","","1232.7","0.5","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C5 H5 Cl2 Mn0.5 N -","- C5 H5 Cl2 Mn0.5 N -","- C40 H40 Cl16 Mn4 N8 -","8","1","","Gillon, Amy L.; Guy Orpen, A.; Starbuck, Jonathan; Wang, Xi-Meng; Rodríguez-Martín, Yolanda; Ruiz-Pérez, Catalina","Cation-controlled formation of [{MCl4}n]2n− chains in [4,4′-H2bipy][MCl4] (M = Mn, Cd): an alternative to the A2MCl4 <100> layer perovskite structure†","Chemical Communications","1999","","22","2287","","10.1039/a907681f","","","0.71073","MoKα","","0.0233","0.0199","","","0.0505","0.0513","","","","","","0.974","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110729","15.612","0.003","12.746","0.002","7.0261","0.0012","90","","114.984","0.003","90","","1267.3","0.4","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H10 Cd Cl4 N2 -","- C10 H10 Cd Cl4 N2 -","- C40 H40 Cd4 Cl16 N8 -","4","0.5","","Gillon, Amy L.; Guy Orpen, A.; Starbuck, Jonathan; Wang, Xi-Meng; Rodríguez-Martín, Yolanda; Ruiz-Pérez, Catalina","Cation-controlled formation of [{MCl4}n]2n− chains in [4,4′-H2bipy][MCl4] (M = Mn, Cd): an alternative to the A2MCl4 <100> layer perovskite structure†","Chemical Communications","1999","","22","2287","","10.1039/a907681f","","","0.71073","MoKα","","0.0267","0.0245","","","0.0584","0.0587","","","","","","1.03","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110730","12.1187","0.0008","12.1187","0.0008","29.753","0.003","90","","90","","90","","4369.6","0.6","153","2","153","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C40 H28 N4 O12 Rh6 -","- C40 H28 N4 O12 Rh6 -","- C160 H112 N16 O48 Rh24 -","4","0.5","","Tejel, Cristina; Bordonaba, Marta; Ciriano, Miguel A.; Lahoz, Fernando J.; Oro, Luis A.","Bi-edge condensation of imido‒rhodium clusters leading to novel planar hexametallic structures","Chemical Communications","1999","","23","2387","","10.1039/a907853c","","","0.71073","MoKα","","0.1251","0.0619","","","0.0613","0.0722","","","","","","0.959","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110731","7.703","0.0007","12.0995","0.0017","27.223","0.002","90","","90","","90","","2537.3","0.5","200","2","200","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 Br F6 N2 O Ru Sb -","- C20 H26 Br F6 N2 O Ru Sb -","- C80 H104 Br4 F24 N8 O4 Ru4 Sb4 -","4","1","","Davenport, Adam J.; Davies, David L.; Fawcett, John; Garratt, Shaun A.; Russell, David R.","Kinetic control of stereoselectivity of halide substitution in arene ruthenium pyridyloxazoline complexes; a rare case of net inversion†","Chemical Communications","1999","","23","2331","","10.1039/a907873h","","","0.71073","MoKα","","0.0871","0.0579","","","0.1566","0.1804","","","","","","1.058","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110732","8.5892","0.0009","9.5732","0.0014","29.369","0.003","90","","90","","90","","2414.9","0.5","190","2","190","2","","","","","","","","8","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 Br F6 N2 O Ru Sb -","- C20 H26 Br F6 N2 O Ru Sb -","- C80 H104 Br4 F24 N8 O4 Ru4 Sb4 -","4","1","","Davenport, Adam J.; Davies, David L.; Fawcett, John; Garratt, Shaun A.; Russell, David R.","Kinetic control of stereoselectivity of halide substitution in arene ruthenium pyridyloxazoline complexes; a rare case of net inversion†","Chemical Communications","1999","","23","2331","","10.1039/a907873h","","","0.71073","MoKα","","0.0587","0.0534","","0.1364","0.1326","","","","1.09","1.105","1.105","","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110733","18.243","0.004","10.0941","0.0016","14.012","0.0015","90","0.013","116.552","0.003","90","0.01","2308.1","0.7","173","2","173","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C20 H28 B Cl N6 O W -","- C20 H28 B Cl N6 O W -","- C80 H112 B4 Cl4 N24 O4 W4 -","4","1","","Bartlett, Ian M.; Carlton, Susannah; Connelly, Neil G.; Harding, David J.; Hayward, Owen D.; Guy Orpen, A.; Ray, Christopher D.; Rieger, Philip H.","Structure and bonding in the d4/d3 alkyne redox pairs [WX(CO)(MeCCMe)Tp′]z (X = F, Cl, Br and I; z = 0 and 1): halide stabilisation of electron deficient metal alkyne complexes","Chemical Communications","1999","","23","2403","","10.1039/a907912b","","","0.71073","MoKα","","0.0363","0.0265","","","0.0437","0.0457","","","","","","0.923","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110734","8.1371","0.001","11.77","0.003","13.3634","0.0015","87.723","0.007","84.451","0.012","85.235","0.012","1268.8","0.4","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C20 H28 B2 Cl F4 N6 O W -","- C20 H28 B2 Cl F4 N6 O W -","- C40 H56 B4 Cl2 F8 N12 O2 W2 -","2","1","","Bartlett, Ian M.; Carlton, Susannah; Connelly, Neil G.; Harding, David J.; Hayward, Owen D.; Guy Orpen, A.; Ray, Christopher D.; Rieger, Philip H.","Structure and bonding in the d4/d3 alkyne redox pairs [WX(CO)(MeCCMe)Tp′]z (X = F, Cl, Br and I; z = 0 and 1): halide stabilisation of electron deficient metal alkyne complexes","Chemical Communications","1999","","23","2403","","10.1039/a907912b","","","0.71073","MoKα","","0.0255","0.0199","","","0.0406","0.0415","","","","","","0.966","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110735","10.297","0.003","11.663","0.002","13.935","0.002","88.34","0.01","70.03","0.02","78.05","0.01","1537.2","0.6","173","2","173","2","","","","","","","","8","P -1","-P 1","2","","","","- C25.5 H29 B Br Cl3 N6 O W -","- C25.5 H29 B Br Cl3 N6 O W -","- C51 H58 B2 Br2 Cl6 N12 O2 W2 -","2","1","","Bartlett, Ian M.; Carlton, Susannah; Connelly, Neil G.; Harding, David J.; Hayward, Owen D.; Guy Orpen, A.; Ray, Christopher D.; Rieger, Philip H.","Structure and bonding in the d4/d3 alkyne redox pairs [WX(CO)(MeCCMe)Tp′]z (X = F, Cl, Br and I; z = 0 and 1): halide stabilisation of electron deficient metal alkyne complexes","Chemical Communications","1999","","23","2403","","10.1039/a907912b","","","0.71073","MoKα","","0.0446","0.0363","","","0.0851","0.0876","","","","","","0.976","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7110736","8.1498","0.0015","11.8631","0.0019","13.4742","0.0014","89.028","0.01","85.677","0.007","85.247","0.011","1294.5","0.3","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C20 H28 B2 Br F4 N6 O W -","- C20 H28 B2 Br F4 N6 O W -","- C40 H56 B4 Br2 F8 N12 O2 W2 -","2","1","","Bartlett, Ian M.; Carlton, Susannah; Connelly, Neil G.; Harding, David J.; Hayward, Owen D.; Guy Orpen, A.; Ray, Christopher D.; Rieger, Philip H.","Structure and bonding in the d4/d3 alkyne redox pairs [WX(CO)(MeCCMe)Tp′]z (X = F, Cl, Br and I; z = 0 and 1): halide stabilisation of electron deficient metal alkyne complexes","Chemical Communications","1999","","23","2403","","10.1039/a907912b","","","0.71073","MoKα","","0.0375","0.0293","","","0.0571","0.0583","","","","","","0.89","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110737","8.278","0.003","14.908","0.006","16.694","0.006","90","","92.97","0.03","90","","2057.4","1.3","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H19 Mo2 O4 P -","- C22 H19 Mo2 O4 P -","- C88 H76 Mo8 O16 P4 -","4","1","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Woods, Anthony D.","Reactivity of acryloyl chloride towards the anion [Cp2(CO)4Mo2(μ-PPhH)]−; synthesis of an unusual phosphaalkene","Chemical Communications","1999","","24","2455","","10.1039/a907915g","","","0.71069","MoKα","","0.0676","0.0538","","","0.154","0.1655","","","","","","1.024","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110738","9.615","0.003","14.568","0.004","15.191","0.003","90","","90","","90","","2127.8","1","180","2","180","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H19 Mo2 O4 P -","- C22 H19 Mo2 O4 P -","- C88 H76 Mo8 O16 P4 -","4","1","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Woods, Anthony D.","Reactivity of acryloyl chloride towards the anion [Cp2(CO)4Mo2(μ-PPhH)]−; synthesis of an unusual phosphaalkene","Chemical Communications","1999","","24","2455","","10.1039/a907915g","","","0.71069","MoKα","","0.027","0.025","","","0.0735","0.0752","","","","","","0.993","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110739","8.304","0.001","9.978","0.001","16.024","0.001","94.19","0.01","102.92","0.01","106.26","0.01","1229.2","0.2","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H23 Mo2 O4 P -","- C28 H23 Mo2 O4 P -","- C56 H46 Mo4 O8 P2 -","2","1","","Davies, John E.; Mays, Martin J.; Raithby, Paul R.; Woods, Anthony D.","Reactivity of acryloyl chloride towards the anion [Cp2(CO)4Mo2(μ-PPhH)]−; synthesis of an unusual phosphaalkene","Chemical Communications","1999","","24","2455","","10.1039/a907915g","","","0.71069","MoKα","","0.0734","0.0398","","","0.0732","0.0823","","","","","","0.998","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110740","11.64","0.0002","15.9236","0.0003","12.6352","0.0002","90","","95.949","0.001","90","","2329.33","0.07","200","2","200","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C16 H40 Cu N2 P Si2 -","- C16 H40 Cu N2 P Si2 -","- C64 H160 Cu4 N8 P4 Si8 -","4","0.5","","Straub, Bernd F.; Eisenträger, Frank; Hofmann, Peter","A remarkably stable copper(I) ethylene complex: synthesis, spectroscopy and structure","Chemical Communications","1999","","24","2507","","10.1039/a907928i","","","0.71073","MoKα","","0.037","0.0268","","","0.0638","0.0676","","","","","","1.07","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110741","10.2429","0.0002","42.4725","0.001","18.6134","0.0004","90","","98.442","0.001","90","","8009.9","0.3","200","2","200","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C21 H46 Cu N2 P Si2 -","- C21 H46 Cu N2 P Si2 -","- C252 H552 Cu12 N24 P12 Si24 -","12","3","","Straub, Bernd F.; Eisenträger, Frank; Hofmann, Peter","A remarkably stable copper(I) ethylene complex: synthesis, spectroscopy and structure","Chemical Communications","1999","","24","2507","","10.1039/a907928i","","","0.71073","MoKα","","0.1669","0.078","","","0.1585","0.1951","","","","","","1.024","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110742","7.836","0.003","7.925","0.004","11.378","0.007","101.66","0.04","98.03","0.03","95.35","0.05","679.8","0.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H16 O3 -","- C16 H16 O3 -","- C32 H32 O6 -","2","1","","Guo, Richard; Green, James R.","One step synthesis of [7]metacyclophanediyne complexes from bis(propargyldicobalt) dication equivalents","Chemical Communications","1999","","24","2503","","10.1039/a907991b","","","0.71073","MoKα","","0.0657","0.0476","","0.1535","0.1355","","","","1.003","1.103","1.103","","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110743","10.387","0.002","11.762","0.005","14.362","0.002","88.05","0.03","81.1","0.02","73.33","0.03","1660.6","0.9","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C32.5 H39 N2 O4.5 P Ru S -","- C32.5 H39 N2 O4.5 P Ru S -","- C65 H78 N4 O9 P2 Ru2 S2 -","2","1","","Polborn, Kurt; Severin, Kay","Molecular imprinting with an organometallic transition state analogue","Chemical Communications","1999","","24","2481","","10.1039/a908047c","","","0.71073","MoKα","","0.0521","0.0471","","0.138","0.1233","","","","1.136","1.067","1.067","","","","","has coordinates,has disorder","301857","2025-08-21","22:47:12",""
"7110744","6.332","0.004","26","0.004","6.72","0.003","90","","112.63","0.04","90","","1021.1","0.9","123","1","123","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H32 N2 O6 -","- C20 H32 N2 O6 -","- C40 H64 N4 O12 -","2","1","","Spivey, Alan C.; Andrews, Benjamin I.; Brown, Alan D.; Frampton, Christopher S.","First asymmetric desymmetrisation of a centrosymmetric molecule: CBS reduction of a 2-pyridone [4 + 4]-photodimer derivative","Chemical Communications","1999","","24","2523","","10.1039/a908059g","","","1.54178","CuKα","","0.0418","0.0417","","","0.1177","0.1177","","","","","","1.009","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110745","8.067","0.0002","8.3194","0.0003","10.5779","0.0003","109.682","0.0016","95.4661","0.0017","104.713","0.0017","633.65","0.03","696","2","696","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H17 Cl F2 O2 -","- C13 H17 Cl F2 O2 -","- C26 H34 Cl2 F4 O4 -","2","1","","Dimartino, Gianluca; Percy, Jonathan M.; Spencer, Neil S.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.","Oxy-Cope rearrangements of fluorinated divinylcyclohexanols: a modular method for the construction of selectively fluorinated cyclic ketones","Chemical Communications","1999","","24","2535","","10.1039/a908450i","","","0.71073","MoKα","","0.0332","0.0295","","","0.0718","0.0742","","","","","","1.061","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110746","11.0632","0.0018","11.09","0.005","15.682","0.007","77.81","0.04","76.87","0.03","62.15","0.03","1644.3","1.2","173","2","173","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C31 H53 N2 P3 Si -","- C31 H53 N2 P3 Si -","- C62 H106 N4 P6 Si2 -","2","1","","Clendenning, Scott B.; Gehrhus, Barbara; Hitchcock, Peter B.; Nixon, John F.","[1 + 4]-Cycloaddition of a stable silylene to 2,4,6-tri-tert-butyl-1,3,5-triphosphabenzene","Chemical Communications","1999","","24","2451","","10.1039/a908483e","","x-ray","0.71073","MoKα","","0.0739","0.054","","","0.1257","0.1365","","","","","","1.126","","","","has coordinates","301857","2025-08-21","22:47:12",""
"7110747","10.372","0.0002","13.5883","0.0002","16.0282","0.0003","90","","90","","90","","2258.98","0.07","100","2","100","2","","","","","","","","6","P b c 21","P 2c -2b","29","","(butadiene)(tosylimido)octacarbonyltriruthenium","","- C19 H13 N O10 Ru3 S -","- C19 H13 N O10 Ru3 S -","- C76 H52 N4 O40 Ru12 S4 -","4","1","","Ali, Shahbano; Deeming, Antony J.; Hogarth, Graeme; Mehta, Nikesh A.; Steed, Jonathan W.","Reductive coupling of alkynes to give ruthenium and osmium clusters of the type [M3(1,3-diene)(μ3-X)(CO)8] containing μ-η2,η2- or η4-1,3-diene","Chemical Communications","1999","","24","2541","","10.1039/a908706k","","","0.7107","MoKα","","0.018","0.0179","","","0.0455","0.0456","","","1.097","","","","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7110748","9.406","0.002","10.615","0.002","13.885","0.003","91.58","0.03","108.82","0.03","104.51","0.03","1261.5","0.6","293","2","291","2","","","","","","","","5","P -1","-P 1","2","","Octacarbonyl(1,3-diphenylbutadiene)(sulfido)triosmium","","- C24 H14 O8 Os3 S -","- C24 H14 O8 Os3 S -","- C48 H28 O16 Os6 S2 -","2","1","","Ali, Shahbano; Deeming, Antony J.; Hogarth, Graeme; Mehta, Nikesh A.; Steed, Jonathan W.","Reductive coupling of alkynes to give ruthenium and osmium clusters of the type [M3(1,3-diene)(μ3-X)(CO)8] containing μ-η2,η2- or η4-1,3-diene","Chemical Communications","1999","","24","2541","","10.1039/a908706k","","","0.71073","MoKα","","0.0564","0.0501","","0.1453","0.1344","","","","1.06","1.072","1.072","","","","","has coordinates","180221","2020-10-21","18:00:00",""
"7115177","47.065","0.002","43.157","0.002","26.9461","0.0012","90","","104.262","0.001","90","","53046","4","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- H480 Mo75 Na30 O550 S10 V20 -","- Mo75 Na13.5 O534 S10 V20 -","- Mo300 Na54 O2136 S40 V80 -","4","0.5","","Müller, Achim; Koop, Michael; Bögge, Hartmut; Schmidtmann, Marc; Peters, Frank; Kögerler, Paul","Building blocks as disposition in solution: [{MoVIO3(H2O)}10{VIVO(H2O)}20{(MoVI/MoVI5O21)(H2O)3}10({MoVIO2(H2O)2}5/2)2 ({NaSO4}5)2]20−, a giant spherical cluster with unusual structural features of interest for supramolecular and magneto chemistry","Chemical Communications","1999","","18","1885","","10.1039/a904724g","","","0.71073","MoKα","","0.1285","0.0616","","","0.1532","0.2063","","","","","","1.072","","","","has coordinates","190300","2020-10-21","18:00:00",""
"7115178","13.012","0.0007","13.3008","0.0004","21.468","0.001","91.262","0.003","95.245","0.003","94.456","0.003","3687.1","0.3","173","","173","","","","","","","","","4","P -1","-P 1","2","","","","- C154 H180 O17 P6 -","- C154 H138 O17 P6 -","- C154 H138 O17 P6 -","1","0.5","","Dieleman, Cedric B.; Matt, Dominique; Neda, Ion; Schmutzler, Reinhard; Harriman, Anthony; Yaftian, Reza","Hexahomotrioxacalix[3]arene: a scaffold for a C3-symmetric phosphine ligand that traps a hydrido-rhodium fragment inside a molecular funnel","Chemical Communications","1999","","18","1911","","10.1039/a905677g","","","0.71073","Mo-Kα","","0.207","0.091","","0.23","","0.122","","","2.082","","","1.065","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115179","13.7139","0.0002","21.8452","0.0004","22.0843","0.0004","90","","98.321","0.0011","90","","6546.43","0.19","100","2","100","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C24 H40 B17 P S -","- C24 H40 B17 P S -","- C192 H320 B136 P8 S8 -","8","2","","Jelínek, Tomáš; Kilner, Colin A.; Barrett, Simon A.; Thornton-Pett, Mark; Kennedy, John D.","Macropolyhedral boron-containing cluster chemistry. The [SB17H19]− anion: a nido-ten-vertex : arachno-ten-vertex cluster architecture and the first single-sulfur macropolyhedral thiaborane","Chemical Communications","1999","","18","1905","","10.1039/a905473a","","","0.71073","MoKα","","0.0809","0.0594","","","0.1411","0.1557","","","","","","1.031","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115180","11.874","0.003","12.617","0.003","13.005","0.003","90","","90","","90","","1948.3","0.8","150","2","150","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C4 H7 As F6 N2 S -","- C4 H7 As F6 N2 S -","- C32 H56 As8 F48 N16 S8 -","8","1","","Stanley Cameron, T.; Decken, Andreas; Fang, Min; Passmore, Jack; Wood, Dale J.; Parsons, Simon","Oxidation of methyl groups in the reaction of sulfur homopolyatomic cations with acetonitrile: formation and crystal structure of the novel trithietanylium ring","Chemical Communications","1999","","18","1801","","10.1039/a904107i","","","0.71073","MoKα","","0.0758","0.0433","","","0.0636","0.0737","","","","","","1.067","","","","has coordinates,has disorder","301857","2025-08-21","22:47:22",""
"7115181","13.9666","0.0001","10.6426","0.0001","16.5839","0.0001","90","","111.285","0.001","90","","2296.9","0.03","153","","153","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C6 H4 As3 F18 N3 S6 -","- C6 H4 As3 F18 N3 S6 -","- C24 H16 As12 F72 N12 S24 -","4","1","","Stanley Cameron, T.; Decken, Andreas; Fang, Min; Passmore, Jack; Wood, Dale J.; Parsons, Simon","Oxidation of methyl groups in the reaction of sulfur homopolyatomic cations with acetonitrile: formation and crystal structure of the novel trithietanylium ring","Chemical Communications","1999","","18","1801","","10.1039/a904107i","","","0.71073","MoKα","","","0.0593","","","0.1499","","","","","1.11","1.11","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115182","14.746","0.003","8.023","0.002","11.034","0.002","90","","90","","90","","1305.4","0.5","210","2","210","2","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C4 H7 As2 F11 N2 S -","- C4 H7 As2 F10.94 N2 S -","- C16 H28 As8 F43.76 N8 S4 -","4","0.5","","Stanley Cameron, T.; Decken, Andreas; Fang, Min; Passmore, Jack; Wood, Dale J.; Parsons, Simon","Oxidation of methyl groups in the reaction of sulfur homopolyatomic cations with acetonitrile: formation and crystal structure of the novel trithietanylium ring","Chemical Communications","1999","","18","1801","","10.1039/a904107i","","","0.71073","MoKα","","","0.0262","","","0.0615","","","","","1.087","1.087","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115183","11.967","0.004","12.268","0.004","24.076","0.005","90","","96.66","0.03","90","","3510.8","1.8","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 As F15 N2 S -","- C14 As F15 N2 S -","- C112 As8 F120 N16 S8 -","8","1","","Stanley Cameron, T.; Decken, Andreas; Fang, Min; Passmore, Jack; Wood, Dale J.; Parsons, Simon","Oxidation of methyl groups in the reaction of sulfur homopolyatomic cations with acetonitrile: formation and crystal structure of the novel trithietanylium ring","Chemical Communications","1999","","18","1801","","10.1039/a904107i","","","0.71073","MoKα","","","0.0538","","","0.1347","","","","","1.147","1.147","","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115184","17.9704","0.0009","18.3237","0.0009","19.771","0.001","67.629","0.001","67.447","0.001","78.767","0.001","5550.8","0.5","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C104 H112 F24 N8 O12 P4 -","- C107.5 H99.73 F24 N8 O19.5 P4 -","- C215 H199.46 F48 N16 O39 P8 -","2","1","","Peinador, Carlos; Román, Esteban; Kaifer, Angel E.; Abboud, Khalil","Novel cavitands containing electrochemically active 4,4′-bipyridinium subunits","Chemical Communications","1999","","18","1887","","10.1039/a903164b","","","0.71073","MoKα","","0.1552","0.0846","","","0.2058","0.2365","","","","","","1.295","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115185","10.332","0.002","24.982","0.004","9.729","0.002","90","","115.984","0.012","90","","2257.4","0.8","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H37 Al N2 O -","- C21 H37 Al N2 O -","- C84 H148 Al4 N8 O4 -","4","1","","Cameron, Paul A.; Gibson, Vernon C.; Redshaw, Carl; Segal, John A.; Bruce, Michael D.; White, Andrew J. P.; Williams, David J.","Pendant arm Schiff base complexes of aluminium as ethylene polymerisation catalysts","Chemical Communications","1999","","18","1883","","10.1039/a905120a","","","0.71073","MoKα","","0.1359","0.0673","","0.1994","0.1557","","","","0.993","1.082","1.082","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115186","15.009","0.002","12.2073","0.0015","14.1285","0.0013","90","","116.357","0.006","90","","2319.5","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H33 Al N2 O -","- C23 H33 Al N2 O -","- C92 H132 Al4 N8 O4 -","4","1","","Cameron, Paul A.; Gibson, Vernon C.; Redshaw, Carl; Segal, John A.; Bruce, Michael D.; White, Andrew J. P.; Williams, David J.","Pendant arm Schiff base complexes of aluminium as ethylene polymerisation catalysts","Chemical Communications","1999","","18","1883","","10.1039/a905120a","","","0.71073","MoKα","","0.0897","0.0539","","0.163","0.1364","","","","1.014","1.069","1.069","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115187","14.234","0.002","17.771","0.004","18.86","0.004","90","","109.55","0.02","90","","4495.7","1.6","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C32 H68 N8 Si4 Zr2 -","- C32 H68 N8 Si4 Zr2 -","- C128 H272 N32 Si16 Zr8 -","4","0.5","","Daniele, Stephane; Hitchcock, Peter B.; Lappert, Michael F.","meta- and para-Bis[zirconyl(IV)amino]cyclophanes; 1,3- or 1,4-C6H4[N(SiMe3)]2 as bridging ligands†","Chemical Communications","1999","","18","1909","","10.1039/a903921j","","","0.71073","MoKα","","0.0427","0.0306","","0.0774","0.0718","","","","1.066","1.091","1.091","","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115188","9.005","0.004","10.128","0.008","13.168","0.009","69.17","0.06","80.33","0.04","78.63","0.05","1094.1","1.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C32 H68 N8 Si4 Zr2 -","- C32 H68 N8 Si4 Zr2 -","- C32 H68 N8 Si4 Zr2 -","1","0.5","","Daniele, Stephane; Hitchcock, Peter B.; Lappert, Michael F.","meta- and para-Bis[zirconyl(IV)amino]cyclophanes; 1,3- or 1,4-C6H4[N(SiMe3)]2 as bridging ligands†","Chemical Communications","1999","","18","1909","","10.1039/a903921j","","","0.71073","MoKα","","0.0389","0.0312","","0.082","0.0769","","","","1.061","1.072","1.072","","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115189","26.387","0.008","13.177","0.007","19.851","0.007","90","","122.91","0.02","90","","5795","4","293.2","","293.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H33 B F4 S2 -","- C28 H33 B F4 S2 -","- C224 H264 B8 F32 S16 -","8","1","","Ogawa, Satoshi; Kikuchi, Mieko; Sato, Ryu; Kawai, Yasushi; Niizuma, Shigeya","Synthesis, structure and redox reactions of a new crowded benzodithiolium salt: first isolation and characterization of a stable dithiolyl radical with a 7π electron framework","Chemical Communications","1999","","18","1891","","10.1039/a905276c","","","1.5418","CuKα","","","0.1049","","","0.1514","","","","","1.225","1.225","","","","","has coordinates","295880","2024-11-12","08:14:27",""
"7115190","8.4141","0.0009","8.4747","0.0009","18.6833","0.0019","90","","97.371","0.002","90","","1321.2","0.2","50","2","50","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C22 H18 B2 Cu F8 N10 -","- C22 H18 B2 Cu F8 N10 -","- C44 H36 B4 Cu2 F16 N20 -","2","1","","Leech, Michael A.; Howard, Judith A. K.; Dahaoui, Slimane; Solanki, Nayan K.; Halcrow, Malcolm A.","A solid-state phase transition at 41 K involving the cooperative ordering of a fluxional pseudo-Jahn–Teller CuII system","Chemical Communications","1999","","22","2245","","10.1039/a906876g","","","0.71073","MoKα","","0.0232","0.0224","","","0.0588","0.0593","","","","","","1.047","","","","has coordinates,has disorder","301857","2025-08-21","22:47:22",""
"7115191","8.4047","0.0006","25.3897","0.0018","18.6676","0.0013","90","","97.205","0.001","90","","3952.1","0.5","31.5","0.2","31.5","0.2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C22 H18 B2 Cu F8 N10 -","- C22 H18 B2 Cu F8 N10 -","- C132 H108 B12 Cu6 F48 N60 -","6","3","","Leech, Michael A.; Howard, Judith A. K.; Dahaoui, Slimane; Solanki, Nayan K.; Halcrow, Malcolm A.","A solid-state phase transition at 41 K involving the cooperative ordering of a fluxional pseudo-Jahn–Teller CuII system","Chemical Communications","1999","","22","2245","","10.1039/a906876g","","","0.71073","MoKα","","0.0303","0.0272","","","0.0717","0.0738","","","","","","1.046","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115192","8.298","0.001","8.298","0.001","10.519","0.002","90","","90","","120","","627.27","0.16","150","2","150","2","","","","","","","'hydrothermal synthesis at 180 deg C for 4 days'","6","P -3","-P 3","147","en-pillared namuwite","mu-ethylenediaminododecahydroxodisulfatooctacobalt(II)-6-water","","- C H16 Co4 N O13 S -","- C0.99 H9.96 Co4 N0.99 O12.97 S -","- C1.98 H19.92 Co8 N1.98 O25.94 S2 -","2","0.333333","","Rujiwatra, Apinpus; Kepert, Cameron J.; Rosseinsky, Matthew J.","The organo-pillared porous magnetic framework Co4(SO4)(OH)6(H2NC2H4NH2)0.5·3H2O","Chemical Communications","1999","","22","2307","","10.1039/a907315i","","","0.71073","MoKα","","0.0881","0.0859","","","0.2179","0.2193","","","","","","1.321","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115193","7.0433","0.0002","5.9748","0.0003","7.4039","0.0004","90","","90","","90","","311.57","0.02","123.2","","123.2","","","","","","","","","3","P n n m","-P 2 2n","58","","","","- C4 Co N6 -","- C4 Co N6 -","- C8 Co2 N12 -","2","0.25","","Jensen, Paul; Batten, Stuart R.; Fallon, Gary D.; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J.","Structural isomers of M(dca)2 molecule-based magnets. Crystal structure of tetrahedrally coordinated sheet-like β-Zn(dca)2 and β-Co/Zn(dca)2, and the octahedrally coordinated rutile-like α-Co(dca)2, where dca‒ = dicyanamide, N(CN)2−, and magnetism of β-Co(dca)2","Chemical Communications","1999","","2","177","","10.1039/a808777f","","","0.7107","MoKalpha","","","0.0281","","","0.0285","","","","","2.566","2.566","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115194","7.606","0.0003","7.5844","0.0003","11.8422","0.0004","90","","90","","90","","683.14","0.04","123.2","","123.2","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C4 N6 Zn -","- C4 N6 Zn -","- C16 N24 Zn4 -","4","0.5","","Jensen, Paul; Batten, Stuart R.; Fallon, Gary D.; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J.","Structural isomers of M(dca)2 molecule-based magnets. Crystal structure of tetrahedrally coordinated sheet-like β-Zn(dca)2 and β-Co/Zn(dca)2, and the octahedrally coordinated rutile-like α-Co(dca)2, where dca‒ = dicyanamide, N(CN)2−, and magnetism of β-Co(dca)2","Chemical Communications","1999","","2","177","","10.1039/a808777f","","","0.7107","MoKalpha","","","0.0225","","","0.0226","","","","","2.238","2.238","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115195","7.607","0.0003","7.5828","0.0004","11.8468","0.0006","90","","90","","90","","683.35","0.06","123.2","","123.2","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C4 N6 Zn -","- C4 N6 Zn -","- C16 N24 Zn4 -","4","0.5","","Jensen, Paul; Batten, Stuart R.; Fallon, Gary D.; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J.","Structural isomers of M(dca)2 molecule-based magnets. Crystal structure of tetrahedrally coordinated sheet-like β-Zn(dca)2 and β-Co/Zn(dca)2, and the octahedrally coordinated rutile-like α-Co(dca)2, where dca‒ = dicyanamide, N(CN)2−, and magnetism of β-Co(dca)2","Chemical Communications","1999","","2","177","","10.1039/a808777f","","","0.7107","MoKalpha","","","0.0273","","","0.0244","","","","","2.252","2.252","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115196","7.5526","0.0003","12.2167","0.0008","7.5882","0.0004","90","","90","","90","","700.15","0.07","293","2","293","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- C4 N6 Zn -","- C4 N6 Zn -","- C16 N24 Zn4 -","4","0.25","","Jensen, Paul; Batten, Stuart R.; Fallon, Gary D.; Moubaraki, Boujemaa; Murray, Keith S.; Price, David J.","Structural isomers of M(dca)2 molecule-based magnets. Crystal structure of tetrahedrally coordinated sheet-like β-Zn(dca)2 and β-Co/Zn(dca)2, and the octahedrally coordinated rutile-like α-Co(dca)2, where dca‒ = dicyanamide, N(CN)2−, and magnetism of β-Co(dca)2","Chemical Communications","1999","","2","177","","10.1039/a808777f","","","0.7107","MoKalpha","","0.0438","0.039","","","0.1208","0.1246","","","","","","1.217","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115197","18.068","0.002","5.3034","0.0006","21.065","0.003","90","","91.992","0.002","90","","2017.3","0.4","120","2","120","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","Lithium zinc monohydrogenphosphate phosphate ethylenediamine dication hydrate","","- C2 H13 Li N2 O9 P2 Zn -","- C2 H13 Li N2 O9 P2 Zn -","- C16 H104 Li8 N16 O72 P16 Zn8 -","8","1","","Jensen, Torben R.; Hazell, Rita G.","A novel layered templated lithium zinc phosphate prepared by an unusual solution mediated technique","Chemical Communications","1999","","4","371","","10.1039/a809272i","","","0.71073","MoKα","","","0.027","","","0.035","","","","","1.156","1.156","","","","","has coordinates","209504","2020-10-21","18:00:00",""
"7115198","12.156","0.002","18.891","0.003","17.584","0.003","90","","90","","90","","4038","1.2","293","2","293","2","","","","","","","","5","C c c a :2","-C 2a 2ac","68","","","","- C17 H18 N5 Ni O7 -","- C17 H12 N5 Ni O7 -","- C136 H96 N40 Ni8 O56 -","8","0.5","","Kepert, Cameron J.; Rosseinsky, Matthew J.","Zeolite-like crystal structure of an empty microporous molecular framework","Chemical Communications","1999","","4","375","","10.1039/a809746a","","","1.5418","CuKα","","0.1728","0.0848","","0.2435","0.2028","","","","0.945","1.252","1.252","","","","","has coordinates,has disorder","180265","2020-10-21","18:00:00",""
"7115199","11.883","0.001","19.049","0.001","17.415","0.001","90","","90","","90","","3942","0.5","375","2","375","2","","","","","","","","5","C c c a :2","-C 2a 2ac","68","","","","- C15 H12 N5 Ni O6 -","- C15 H12 N5 Ni O6 -","- C120 H96 N40 Ni8 O48 -","8","0.5","","Kepert, Cameron J.; Rosseinsky, Matthew J.","Zeolite-like crystal structure of an empty microporous molecular framework","Chemical Communications","1999","","4","375","","10.1039/a809746a","","","0.71073","MoKα","","0.0819","0.0676","","0.221","0.2085","","","","1.105","1.211","1.211","","","","","has coordinates","180265","2020-10-21","18:00:00",""
"7115200","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","","Clegg, William; Liddle, Stephen T.; Drummond, Allison M.; Mulvey, Robert E.; Robertson, Alan","A novel heterometallic alkoxide: lithium‒potassium tert-butoxide [(ButO)8Li4K4]","Chemical Communications","1999","","16","1569","","10.1039/a904800f","","","0.71073","MoKα","","0.0441","0.0324","","","0.0853","0.088","","","","","","1.035","","","","has coordinates,has disorder","180266","2020-10-21","18:00:00",""
"7115201","18.343","0.0002","15.9372","0.0004","9.1019","0.0002","90","","90.867","0.001","90","","2660.51","0.09","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C12 H15 Ga5 N2 O24 P4 -","- C12 H10 Ga5 N2 O24 P4 -","- C48 H40 Ga20 N8 O96 P16 -","4","0.5","","Chen, Ching-Yeh; Chu, Peter P.; Lii, Kwang-Hwa; Lii, Kwang-Hwa","Synthesis, crystal structure and 71Ga MAS NMR spectroscopy of a novel gallium phosphatooxalate: [Ga5(OH)2(C10H9N2)(C2O4)(PO4)4]·2H2O","Chemical Communications","1999","","16","1473","","10.1039/a903213d","","","0.71073","MoKα","","0.0682","0.041","","","0.0806","0.0921","","","","","","1.072","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115202","10.707","0.004","17.737","0.004","19.081","0.008","90","","103.61","0.02","90","","3522","2","208","2","208","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","[(S6-Cage-C4-OH-CH3)(tosylato)silver(I)] polymer","","- C29 H49 Ag O4 S7 -","- C29 H49 Ag O4 S7 -","- C116 H196 Ag4 O16 S28 -","4","1","","Alberto, Roger; Angst, Daniela; Schubiger, August P.; Abram, Ulrich; Ortner, Kirstin; Kaden, Thomas A.","Unexpected polymeric string formation between Ag(I) and a homoleptic thioether cage: synthesis and crystal structure of [R,R′-S6tricosane] and {[Ag(R,R′-S6hexacosane)]TsO}\ιnfty","Chemical Communications","1999","","16","1513","","10.1039/a903455b","","","0.71073","MoKa","","0.3067","0.0695","","0.1168","0.0671","","","","0.918","1.078","1.078","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115203","18.186","0.004","26.587","0.004","10.255","0.002","90","","101.16","0.01","90","","4864.6","1.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-S6-Hydroxy cage","","- C19 H36 O S6 -","- C19 H36 O S6 -","- C152 H288 O8 S48 -","8","2","","Alberto, Roger; Angst, Daniela; Schubiger, August P.; Abram, Ulrich; Ortner, Kirstin; Kaden, Thomas A.","Unexpected polymeric string formation between Ag(I) and a homoleptic thioether cage: synthesis and crystal structure of [R,R′-S6tricosane] and {[Ag(R,R′-S6hexacosane)]TsO}\ιnfty","Chemical Communications","1999","","16","1513","","10.1039/a903455b","","","1.54184","CuKa","","0.09","0.0553","","0.1634","0.1381","","","","1.015","1.047","1.047","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115204","11.3385","0.0003","22.666","0.0007","10.2516","0.0004","90","","92.1722","0.0018","90","","2632.75","0.15","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C31 H28 N2 O3 S -","- C31 H28 N2 O3 S -","- C124 H112 N8 O12 S4 -","4","1","","Avalos, Martín; Babiano, Reyes; Cintas, Pedro; Jiménez, José L.; López, Ignacio; Palacios, Juan C.; Hursthouse, Michael B.; Light, Mark E.","Unexpected formation of β-lactams and penem isosteres from mesoionics: sequential ring-opening–rearrangement of [3 + 2] cycloadducts","Chemical Communications","1999","","16","1589","","10.1039/a904333k","","","0.71073","MoKα","","0.0765","0.0443","","","0.1031","0.1171","","","","","","0.998","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115205","3.376","0.0007","10.268","0.002","8.575","0.002","90","","99.82","0.03","90","","292.9","0.11","10","1","10","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","di-hydroxy-(μ^6^-squarato)manganese","","- C4 H2 Mn2 O6 -","- C4 H2 Mn2 O6 -","- C8 H4 Mn4 O12 -","2","0.5","","Yufit, Dmitrii S.; Howard, Judith A. K.; Price, Daniel J.; Gutschke, Siegfried O. H.; Powell, Annie K.; Wood, Paul T.","New type of metal squarates. Magnetic and multi-temperature X-ray study of di-hydroxy(μ6-squarato)manganese†","Chemical Communications","1999","","16","1561","","10.1039/a903032h","","","0.71073","MoKα","","0.0307","0.0234","","0.0579","0.0536","","","","1.026","1.034","1.034","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115206","3.377","0.0007","10.268","0.002","8.576","0.002","90","","99.81","0.03","90","","293.02","0.11","20","1","20","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","di-hydroxy-(μ^6^-squarato)manganese","","- C4 H2 Mn2 O6 -","- C4 H2 Mn2 O6 -","- C8 H4 Mn4 O12 -","2","0.5","","Yufit, Dmitrii S.; Howard, Judith A. K.; Price, Daniel J.; Gutschke, Siegfried O. H.; Powell, Annie K.; Wood, Paul T.","New type of metal squarates. Magnetic and multi-temperature X-ray study of di-hydroxy(μ6-squarato)manganese†","Chemical Communications","1999","","16","1561","","10.1039/a903032h","","","0.71073","MoKα","","0.0156","0.0138","","0.0358","0.0325","","","","1.052","1.059","1.059","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115207","3.377","0.0007","10.269","0.002","8.573","0.002","90","","99.8","0.03","90","","292.96","0.11","45","1","45","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","di-hydroxy-(μ^6^-squarato)manganese","","- C4 H2 Mn2 O6 -","- C4 H2 Mn2 O6 -","- C8 H4 Mn4 O12 -","2","0.5","","Yufit, Dmitrii S.; Howard, Judith A. K.; Price, Daniel J.; Gutschke, Siegfried O. H.; Powell, Annie K.; Wood, Paul T.","New type of metal squarates. Magnetic and multi-temperature X-ray study of di-hydroxy(μ6-squarato)manganese†","Chemical Communications","1999","","16","1561","","10.1039/a903032h","","","0.71073","MoKα","","0.0167","0.0144","","0.0357","0.0327","","","","1.093","1.111","1.111","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115208","3.381","0.001","10.268","0.005","8.579","0.004","90","","99.85","0.03","90","","293.4","0.2","120","1","120","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","di-hydroxy-(μ^6^-squarato)manganese","","- C4 H2 Mn2 O6 -","- C4 H2 Mn2 O6 -","- C8 H4 Mn4 O12 -","2","0.5","","Yufit, Dmitrii S.; Howard, Judith A. K.; Price, Daniel J.; Gutschke, Siegfried O. H.; Powell, Annie K.; Wood, Paul T.","New type of metal squarates. Magnetic and multi-temperature X-ray study of di-hydroxy(μ6-squarato)manganese†","Chemical Communications","1999","","16","1561","","10.1039/a903032h","","","0.71073","MoKα","","0.0214","0.0189","","0.0522","0.0482","","","","1.048","1.066","1.066","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115209","14.42","0.003","12.267","0.002","24.062","0.005","90","","90","","90","","4256.3","1.4","83","","83","","","","","","","","","5","P b c n","-P 2n 2ab","60","","1,3-Bis(ferrocenyl)allylium hexafluorophosphate","","- C23 H21 F6 Fe2 P -","- C23 H18 F6 Fe2 P -","- C184 H144 F48 Fe16 P8 -","8","1","","Barlow, Stephen; Henling, Lawrence M.; Day, Michael W.; Marder, Seth R.; Marder, Seth R.","Effect of the end-groups upon delocalisation in polymethines: the first crystallographically characterised bond-alternated cyanine","Chemical Communications","1999","","16","1567","","10.1039/a903868j","","","0.71073","MoKα","","0.1011","0.0711","","","0.1281","0.1327","","","","","","2.656","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7115210","26.409","0.006","15.004","0.003","11.97","0.003","90","","113.83","0.02","90","","4338.7","1.8","84","","84","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","1,3-Bis(ruthenocenyl)allylium hexafluorophosphate","","- C23 H21 F6 P Ru2 -","- C23 H21 F6 P Ru2 -","- C184 H168 F48 P8 Ru16 -","8","1","","Barlow, Stephen; Henling, Lawrence M.; Day, Michael W.; Marder, Seth R.; Marder, Seth R.","Effect of the end-groups upon delocalisation in polymethines: the first crystallographically characterised bond-alternated cyanine","Chemical Communications","1999","","16","1567","","10.1039/a903868j","","","0.71073","MoKα","","0.0238","0.0211","","","0.0485","0.0491","","","","","","1.764","","","","has coordinates,has disorder","180266","2020-10-21","18:00:00",""
"7115211","15.879","0.003","10.122","0.003","7.1085","0.0014","90","","90","","90","","1142.5","0.5","293","2","293","2","","","","","","","","6","P m m a","-P 2a 2a","51","","","","- C10 H24 Br5 Mn O7 Tl -","- C10 H21 Br5 Mn O7 Tl -","- C20 H42 Br10 Mn2 O14 Tl2 -","2","0.25","","Reid, Howard O. N.; Kahwa, Ishenkumba A.; White, Andrew J. P.; Williams, David J.","Seven-coordinate Mn2+ ions in [Mn(15-crown-5)(H2O)2]2+ as luminescent probes for dynamic supramolecular events†","Chemical Communications","1999","","16","1565","","10.1039/a903808f","","","0.71073","MoKα","","0.0774","0.0543","","0.1471","0.1317","","","","1.044","1.097","1.097","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7115212","13.6981","0.0008","15.8731","0.0007","7.782","0.0005","90","","97.946","0.004","90","","1675.8","0.16","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H24 Br2 Mn O7 -","- C10 H24 Br2 Mn O7 -","- C40 H96 Br8 Mn4 O28 -","4","0.5","","Reid, Howard O. N.; Kahwa, Ishenkumba A.; White, Andrew J. P.; Williams, David J.","Seven-coordinate Mn2+ ions in [Mn(15-crown-5)(H2O)2]2+ as luminescent probes for dynamic supramolecular events†","Chemical Communications","1999","","16","1565","","10.1039/a903808f","","","1.54178","CuKα","","0.0257","0.0252","","0.0696","0.0693","","","","1.131","1.142","1.142","","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115213","14.9503","0.0008","5.0031","0.0004","12.1617","0.0011","90","","103.647","0.006","90","","883.99","0.12","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C8 H8 O6 Zn -","- C8 H8 O6 Zn -","- C32 H32 O24 Zn4 -","4","0.5","","Guilera, Gemma; Steed, Jonathan W.","Topological control in coordination polymers by non-covalent forces","Chemical Communications","1999","","16","1563","","10.1039/a903163d","","","0.7107","MoKα","","0.0334","0.031","","","0.0793","0.0802","","","","","","1.076","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115214","5.6508","0.0011","7.2496","0.0014","13.179","0.003","90","","100.47","0.03","90","","530.9","0.2","100","2","100","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C10 H12 N2 O4 Zn -","- C10 H12 N2 O4 Zn -","- C20 H24 N4 O8 Zn2 -","2","0.5","","Guilera, Gemma; Steed, Jonathan W.","Topological control in coordination polymers by non-covalent forces","Chemical Communications","1999","","16","1563","","10.1039/a903163d","","","0.71073","MoKα","","0.0664","0.0511","","","0.1229","0.1297","","","","","","1.103","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115215","16.8315","0.0005","18.176","0.001","39.571","0.003","90","","90","","90","","12105.9","1.2","213","2","213","2","","","","","","","synthesis","5","P b c a","-P 2ac 2ab","61","","","","- C61 H46 Cl4 Cr5 N20 -","- C61 H46 Cl4 Cr5 N20 -","- C488 H368 Cl32 Cr40 N160 -","8","1","","Albert Cotton, F.; Daniels, Lee M.; Murillo, Carlos A.; Wang, Xiaoping; Murillo, Carlos A.","Getting the right answer to a key question concerning molecular wires","Chemical Communications","1999","","24","2461","","10.1039/a906727b","","","0.71073","MoKα","","0.1022","0.0831","","0.2079","0.1895","","","","1.264","1.307","1.307","","","","","has coordinates,has disorder","180266","2020-10-21","18:00:00",""
"7115216","28.417","0.001","13.9755","0.0002","24.8327","0.0007","90","","122.78","0.003","90","","8291.6","0.5","213","2","213","2","","","","","","","synthesis","6","C 1 2/c 1","-C 2yc","15","","","","- C72 H68 Cl14 Cr5 N20 O2 -","- C72 H68 Cl14 Cr5 N20 O2 -","- C288 H272 Cl56 Cr20 N80 O8 -","4","0.5","","Albert Cotton, F.; Daniels, Lee M.; Murillo, Carlos A.; Wang, Xiaoping; Murillo, Carlos A.","Getting the right answer to a key question concerning molecular wires","Chemical Communications","1999","","24","2461","","10.1039/a906727b","","","0.71073","MoKα","","0.0565","0.0469","","0.1112","0.1024","","","","1.135","1.14","1.14","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115217","10.7234","0.0007","10.7234","0.0007","26.663","0.004","90","","90","","90","","3066","0.5","213","2","213","2","","","","","","","","6","I 4/m","-I 4","87","","","","- C64 H54 Cl2 Cr5 N20 O -","- C64.08 H40 Cl2 Cr5 N20 O1.02 -","- C128.16 H80 Cl4 Cr10 N40 O2.04 -","2","0.125","","Albert Cotton, F.; Daniels, Lee M.; Murillo, Carlos A.; Wang, Xiaoping; Murillo, Carlos A.","Getting the right answer to a key question concerning molecular wires","Chemical Communications","1999","","24","2461","","10.1039/a906727b","","","0.71073","MoKα","","0.0737","0.0602","","0.164","0.1441","","","","0.998","1.01","1.01","","","","","has coordinates,has disorder","180266","2020-10-21","18:00:00",""
"7115218","17.973","0.002","14.284","0.003","19.986","0.004","90","","106.05","0.011","90","","4930.9","1.6","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27.5 H27.5 N4 O6 -","- C27.5 H27.5 N4 O6 -","- C220 H220 N32 O48 -","8","2","","Isaacs, Lyle; Fettinger, James C.","Design, synthesis and self-association behavior of water soluble self complementary facial amphiphiles","Chemical Communications","1999","","24","2549","","10.1039/a907474k","","","0.71073","MoKα","","0.0722","0.0488","","","0.1257","0.1455","","","","","","1.032","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115219","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; Sillanpää, Atte; Lämsä, Markku T.; Pursiainen, Jouni; Nissinen, Maija; Rissanen, Kari","Polar crystals with one-dimensional arrays from achiral components: crystal structures of 2:2 complexes of dibenzo-18-crown-6‒imidazolium and pyrazolium perchlorates","Chemical Communications","1999","","10","897","","10.1039/a902014d","","","0.71073","MoKα","","0.0582","0.042","","","0.115","0.1208","","","","","","1.182","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115220","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; Sillanpää, Atte; Lämsä, Markku T.; Pursiainen, Jouni; Nissinen, Maija; Rissanen, Kari","Polar crystals with one-dimensional arrays from achiral components: crystal structures of 2:2 complexes of dibenzo-18-crown-6‒imidazolium and pyrazolium perchlorates","Chemical Communications","1999","","10","897","","10.1039/a902014d","","","0.71073","MoKα","","0.1318","0.0887","","","0.2289","0.2535","","","","","","1.124","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115221","8.116","0.005","8.116","0.005","14.721","0.005","90","","90","","90","","969.7","0.9","293","2","293","2","","","","","","","","5","I 41/a m d :2","-I 4bd 2","141","Cadmium Cyanide 1,2-Dibromoethane","","","- C4 H4 Br2 Cd N2 -","- C4 Br2 Cd N2 -","- C16 Br8 Cd4 N8 -","4","0.125","","Kitazawa, Takafumi","A new mineralomimetic Cd(CN)2 host framework which is intermediate between H- and L-cristobalite-like frameworks","Chemical Communications","1999","","10","891","","10.1039/a901613i","","","0.71069","MoKα","","0.1775","0.0629","","0.2436","0.1757","","","","1.056","1.296","1.296","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115222","10.5466","0.001","10.701","0.0011","13.8717","0.0014","79.915","0.003","82.215","0.003","75.406","0.003","1484.8","0.3","143","2","143","2","","","","","","","","7","P -1","-P 1","2","","","","- C23 H29 N2 O7 P Si2 W -","- C23 H29 N2 O7 P Si2 W -","- C46 H58 N4 O14 P2 Si4 W2 -","2","1","","Streubel, Rainer; Wilkens, Hendrik; Jones, Peter G.","Photochemically generated nitrilium phosphane-ylid tungsten complexes and their reactivity towards alkyne and nitrile derivatives","Chemical Communications","1999","","20","2127","","10.1039/a905752h","","","0.71073","MoKα","","0.0206","0.0186","","","0.0433","0.0438","","","","","","1.019","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115223","11.391","0.004","12.414","0.003","12.846","0.004","71.04","0.03","68.39","0.02","66.88","0.02","1518.3","0.9","150","2","150","2","","","","","","","","7","P -1","-P 1","2","","","","- C10 H12 F2 Ga6 N2 O25 P6 -","- C10 H12 F2 Ga6 N2 O25 P6 -","- C20 H24 F4 Ga12 N4 O50 P12 -","2","1","","Wragg, David S.; Bull, Ivor; Hix, Gary B.; Morris, Russell E.","A novel pyridine-templated open framework gallophosphate","Chemical Communications","1999","","20","2037","","10.1039/a906544j","","","0.6849","","","0.0481","0.0454","","","0.1272","0.1288","","","","","","1.207","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115224","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","","","","- C37.25 H65 N4 Ni O11.75 S -","- C34 H50 N4 Ni O8 S -","- C136 H200 N16 Ni4 O32 S4 -","4","1","","White, David J.; Laing, Norman; Miller, Hamish; Parsons, Simon; Tasker, Peter A.; Coles, Simon","Ditopic ligands for the simultaneous solvent extraction of cations and anions","Chemical Communications","1999","","20","2077","","10.1039/a906490g","","","0.71073","MoKα","","0.0736","0.0502","","","0.1358","0.1457","","","","","","1.084","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7115225","17.662","0.002","11.6074","0.0007","20.335","0.002","90","","112.669","0.004","90","","3846.8","0.6","294","","294","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C50 H36 N4 -","- C50 H34 N4 -","- C200 H136 N16 -","4","1","","Ruppert, Romain; Jeandon, Christophe; Sgambati, Anna; Callot, Henry J.","Reduction of N-arylporphyrins to N-arylphlorins: opposite stereochemical courses as a function of the reducing agent","Chemical Communications","1999","","20","2123","","10.1039/a905676i","","","0.71073","Mo-Kα","","0.296","0.072","","0.988","","0.093","","","","","","1.524","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115226","15.019","0.006","24.783","0.01","12.873","0.008","90","","101.43","0.04","90","","4697","4","220","2","220","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 Cu N4 O4 S2 -","- C20 H30 Cu N4 O4 S2 -","- C160 H240 Cu8 N32 O32 S16 -","8","2","","White, David J.; Cronin, Leroy; Parsons, Simon; Robertson, Neil; Tasker, Peter A.; Bisson, Adrian P.","Control of copper(II) coordination geometry via supramolecular assembly of ligands in the solid state","Chemical Communications","1999","","12","1107","","10.1039/a902196e","","","1.54184","CuKα","","0.1678","0.0612","","","0.1441","0.1923","","","","","","0.857","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115227","32.427","0.007","6.1076","0.0015","23.254","0.005","90","","96.3","0.03","90","","4577.7","1.8","220","2","220","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H30 Cu N4 O4 S2 -","- C20 H30 Cu N4 O4 S2 -","- C160 H240 Cu8 N32 O32 S16 -","8","1","","White, David J.; Cronin, Leroy; Parsons, Simon; Robertson, Neil; Tasker, Peter A.; Bisson, Adrian P.","Control of copper(II) coordination geometry via supramolecular assembly of ligands in the solid state","Chemical Communications","1999","","12","1107","","10.1039/a902196e","","","0.71073","MoKα","","0.1426","0.0524","","","0.0917","0.1157","","","","","","0.945","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115228","10.1145","0.0004","19.0653","0.0008","19.2258","0.0007","82.27","0.005","75.96","0.005","78.414","0.005","3509","0.3","123","1","123","1","","","","","","","","4","P -1","-P 1","2","[{SiPh2(mu-O)}4]C60(toluene)0.5","","","- C111.5 H43.5 O4 Si4 -","- C111.5 H43.5 O4 Si4 -","- C223 H87 O8 Si8 -","2","1","","Grey, Ian E.","Octaphenylcyclotetrasiloxane confinement of C60 into double columnar arrays","Chemical Communications","1999","","12","1139","","10.1039/a901719d","","","0.71073","MoKα","","0.1063","0.0513","","","0.1063","0.1253","","","","","","1.012","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115229","11.214","0.002","13.778","0.002","10.797","0.001","90","","112.72","0.01","90","","1538.8","0.4","180","","0","","","","","","","","?","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H19 Si V -","- C16 H19 Si V -","- C64 H76 Si4 V4 -","4","1","","Choukroun, Robert; Lorber, Christian; Donnadieu, Bruno; Henner, Bernard; Frantz, Richard; Guerin, Christian","A homobimetallic vanadium d2‒d2 complex (Cp2V)2(3η:4η-Me3SiCC‒CC‒CCSiMe3):structure and magnetism","Chemical Communications","1999","","12","1099","","10.1039/a902370d","","","0.71073","MoKα","","","0.0329","","","0.0366","","","","","1.0975","1.0975","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115230","13.731","0.011","20.496","0.009","13.521","0.008","90","","90","","90","","3805","4","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C34 H31 F12 N7 O0 P2 Ru -","- C34 H31 F12 N7 P2 Ru -","- C136 H124 F48 N28 P8 Ru4 -","4","1","","Hesek, Dusan; Inoue, Yoshihisa; Everitt, Simon R. L.; Ishida, Hitoshi; Kunieda, Mieko; Drew, Michael G. B.","Conversion of a new chiral reagent Δ-[Ru(bpy)2 (dmso)Cl]PF6 to Δ-[Ru(bpy)2(dmbpy)]PF6Cl with 96.8% retention of chirality (dmbpy = 4,4′-dimethyl-2,2′-bipyridine)","Chemical Communications","1999","","5","403","","10.1039/a809698h","","","0.71069","MoKα","","0.0972","0.0519","","","0.1444","0.1755","","","","","","0.977","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115231","14.39","0.001","11.928","0.001","19.3","0.001","90","","102.67","0.01","90","","3232.1","0.4","120","2","120","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C51 H72 F9 N8 O17 S3 Yb -","- C51.024 H72 F9 N8 O17 S3 Yb -","- C102.048 H144 F18 N16 O34 S6 Yb2 -","2","1","","Batsanov, Andrei S.; Beeby, Andrew; Bruce, James I.; Howard, Judith A. K.; Kenwright, Alan M.; Parker, David","Direct NMR and luminescence observation of water exchange at cationic ytterbium and europium centres","Chemical Communications","1999","","11","1011","","10.1039/a902260k","","","0.71073","MoKα","","0.0232","0.0212","","","0.0508","0.0522","","","","","","1.028","","","","has coordinates,has disorder","180266","2020-10-21","18:00:00",""
"7115232","12.5731","0.0004","15.4085","0.0005","29.7563","0.001","90","","90","","90","","5764.8","0.3","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C36 H69 Eu F18 N8 O14.5 P3 -","- C36 H66 Eu F18 N8 O14.5 P3 -","- C144 H264 Eu4 F72 N32 O58 P12 -","4","1","","Aime, Silvio; Barge, Alessandro; Botta, Mauro; Howard, Judith A. K.; Kataky, Ritu; Lowe, Mark P.; Moloney, Janet M.; Parker, David; de Sousa, Alvaro S.","Dependence of the relaxivity and luminescence of gadolinium and europium amino-acid complexes on hydrogencarbonate and pH","Chemical Communications","1999","","11","1047","","10.1039/a902238d","","","0.71073","MoKα","","0.0827","0.0481","","","0.0905","0.1042","","","","","","1.081","","","","has coordinates,has disorder","193981","2020-10-21","18:00:00",""
"7115233","12.873","0.004","29.35","0.006","14.826","0.004","90","","110.49","0.03","90","","5247","3","157.2","","157.2","","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","2a","","","- C83 H84 B4 Cl2 F16 N4 O5 P6 Pt3 -","- C83 H76 B4 Cl2 F16 N4 O5 P6 Pt3 -","- C166 H152 B8 Cl4 F32 N8 O10 P12 Pt6 -","2","0.5","","Tanase, Tomoaki; Hamaguchi, Makiko; Ara Begum, Rowshan; Yano, Shigenobu; Yamamoto, Yasuhiro","Unprecedented nitrosyl-bridged double-A-frame triplatinum complexes, [Pt3(μ-triphosphine)2(μ-NO)2(RNC)2](BF4)4","Chemical Communications","1999","","8","745","","10.1039/a900302i","","","0.7107","MoKα","","0.058","0.058","","","0.0725","0.0725","","","","","","2.528","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115234","9.925","0.002","12.94","0.003","15.319","0.005","94.16","0.01","94.13","0.01","99.06","0.01","1930.8","0.9","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H40 O2 S6 -","- C44 H40 O2 S6 -","- C88 H80 O4 S12 -","2","1","","Christensen, Christian A.; Bryce, Martin R.; Batsanov, Andrei S.; Howard, Judith A. K.; Jeppesen, Jan O.; Becher, Jan","The first Diels–Alder reaction of a 9,10-bis(1,3-dithiol-2-ylidene)-9,10-dihydroanthracene derivative: synthesis and crystal structure of a novel donor–π–anthraquinone diad","Chemical Communications","1999","","23","2433","","10.1039/a907768e","","","0.71073","MoKα","","0.0761","0.0394","","","0.0759","0.086","","","","","","0.947","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115235","15.208","0.003","16.298","0.003","16.51","0.003","111.95","0.01","95.52","0.01","113.86","0.01","3320.2","1.2","120","2","120","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H38 O S6 -","- C34 H37.28 O S6 -","- C136 H149.12 O4 S24 -","4","2","","Christensen, Christian A.; Bryce, Martin R.; Batsanov, Andrei S.; Howard, Judith A. K.; Jeppesen, Jan O.; Becher, Jan","The first Diels‒Alder reaction of a 9,10-bis(1,3-dithiol-2-ylidene)-9,10-dihydroanthracene derivative: synthesis and crystal structure of a novel donor‒π‒anthraquinone diad","Chemical Communications","1999","","23","2433","","10.1039/a907768e","","","0.71073","MoKα","","0.0705","0.0418","","","0.0861","0.0961","","","","","","1.015","","","","has coordinates,has disorder","180266","2020-10-21","18:00:00",""
"7115236","11.277","0.002","12.015","0.002","11.056","0.002","97.87","0.01","94.66","0.02","71.73","0.01","1407.9","0.4","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H15 F3 N2 O2 -","- C14 H12 F3 N2 O2 -","- C56 H48 F12 N8 O8 -","4","2","","Miyata, Okiko; Kimura, Yasuo; Naito, Takeaki","Unambiguous characterisation of dienylimines as intermediates in Fischer indolisation of o-substituted N-trifluoroacetyl enehydrazines","Chemical Communications","1999","","23","2429","","10.1039/a907539i","","","1.54178","CuKα","","0.0776","0.0684","","","0.2296","0.2379","","","","","","1.941","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115237","12.399","0.002","7.6006","0.0007","13.0976","0.0011","90","","108.603","0.008","90","","1169.8","0.2","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C22 H24.5 Cl N3 O4.25 Pd -","- C22 H24 Cl N3 O4.25 Pd -","- C44 H48 Cl2 N6 O8.5 Pd2 -","2","1","","Leung, Pak-Hing; Ng, Khim-Hui; Li, Yongxin; White, Andrew J. P.; Williams, David J.","Designer cyclopalladated-amine catalysts for the asymmetric Claisen rearrangement","Chemical Communications","1999","","23","2435","","10.1039/a907617d","","","0.71073","MoKα","","0.0369","0.0321","","0.0795","0.0768","","","","1.031","1.051","1.051","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115238","16.4221","0.0019","27.434","0.003","15.8144","0.0019","101.781","0.007","101.793","0.008","76.902","0.006","6699.2","1.4","99","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C98 H189 Cl2 Mn12 N O50 -","- C98 H181 Cl2 Mn12 N O50 -","- C196 H362 Cl4 Mn24 N2 O100 -","2","1","","Sun, Ziming; Ruiz, Daniel; Hendrickson, David N.; Dilley, Neil R.; Brian Maple, M.; Soler, Mönica; Folting, Kirsten; Christou, George; Ribas, Joan","The origin of the second relaxation process in the [Mn12O12(O2CR)16(H2O)4] single-molecule magnets: ‘Jahn‒Teller isomerism’ in the [Mn12O12] core","Chemical Communications","1999","","19","1973","","10.1039/a906451f","","","0.71069","MoKα","","","0.0725","","","","0.0563","","","","","","1.5464","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7115239","11.563","0.0011","12.068","0.002","12.348","0.002","91.563","0.013","91.289","0.01","92.839","0.01","1719.8","0.4","293","2","293","2","","","","","","","","9","P -1","-P 1","2","","","","- C34 H36 Cl Fe N Ni O2 P2 S3 -","- C34 H36 Cl Fe N Ni O2 P2 S3 -","- C68 H72 Cl2 Fe2 N2 Ni2 O4 P4 S6 -","2","1","","Davies, Sian C.; Evans, David J.; Hughes, David L.; Longhurst, Steven; Roger Sanders, J.","Synthesis and structure of a thiolate-bridged nickel‒iron complex: towards a mimic of the active site of NiFe-hydrogenase","Chemical Communications","1999","","19","1935","","10.1039/a905353k","","","0.71069","Mo-Kα","","0.1296","0.0584","","0.1513","0.1125","","","","0.966","1.101","1.101","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7115240","10.634","0.003","17.432","0.004","19.578","0.004","70.959","0.017","89.846","0.017","77.52","0.02","3340.5","1.5","173","2","173","2","","","","","","","","3","P -1","-P 1","2","dihydroxycalix[4]arene-benzocrown-6","","","- C42 H42 O6 -","- C42 H42 O6 -","- C168 H168 O24 -","4","2","","Sachleben, Richard A.; Urvoas, Agathe; Bryan, Jeffrey C.; Haverlock, Tamara J.; Moyer, Bruce A.; Hay, Benjamin P.","Dideoxygenated calix[4]arene crown-6 ethers enhanced selectivity for caesium over potassium and rubidium","Chemical Communications","1999","","17","1751","","10.1039/a905682c","","","0.71073","MoKα","","0.09","0.043","","","0.1","0.117","","","","","","1.02","","","","has coordinates,has disorder","301857","2025-08-21","22:47:22",""
"7115241","11.632","0.006","16.114","0.005","13.92","0.004","90","","90","","90","","2609.1","1.7","173","2","173","2","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C20 H36 P6 Ti -","- C20 H36 P6 Ti -","- C80 H144 P24 Ti4 -","4","0.5","","Cloke, F. Geoffrey N.; Hanks, John R.; Hitchcock, Peter B.; Nixon, John F.","Synthesis, structure and reactivity of the hexaphospha-titanocene, bis-(η5-3,5-di-tert-butyl-1,2,4-triphosphacyclopentadienyl)titanium(II)","Chemical Communications","1999","","17","1731","","10.1039/a905469c","","","0.71073","MoKα","","0.026","0.0245","","0.063","0.0619","","","","1.063","1.066","1.066","","","","","has coordinates,has disorder","301857","2025-08-21","22:47:22",""
"7115242","10.299","0.005","11.91","0.006","14.23","0.01","86.48","0.05","71","0.05","68.75","0.04","1535","1.7","173","2","173","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C25 H45 P7 Ti -","- C25 H45 P7 Ti -","- C50 H90 P14 Ti2 -","2","1","","Cloke, F. Geoffrey N.; Hanks, John R.; Hitchcock, Peter B.; Nixon, John F.","Synthesis, structure and reactivity of the hexaphospha-titanocene, bis-(η5-3,5-di-tert-butyl-1,2,4-triphosphacyclopentadienyl)titanium(II)","Chemical Communications","1999","","17","1731","","10.1039/a905469c","","","0.71073","MoKα","","0.0992","0.0765","","0.212","0.1964","","","","1.007","1.081","1.081","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115243","15.371","0.002","24.095","0.002","17.319","0.002","90","0.02","106.67","0.02","90","0.03","6144.8","1.3","95","2","95","2","","","","","","","CH3C6H5/CH2Cl2/C6H14","7","P 1 21/n 1","-P 2yn","14","","","","- C64 H40 B F24 Mo O2 P -","- C64 H32 B F24 Mo O2 P -","- C256 H128 B4 F96 Mo4 O8 P4 -","4","1","","Cheng, Tan-Yun; Szalda, David J.; Morris Bullock, R.","An uncommon bonding mode of a familiar ligand: a molybdenum complex with a four-electron donor chelating η3-PPh3 ligand, and its structural determination using synchrotron radiation","Chemical Communications","1999","","17","1629","","10.1039/a905092b","","","1.1","x-rays","","0.0981","0.0738","","0.2097","0.1899","","","","1.016","1.078","1.078","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115244","12.861","0.011","27.762","0.006","6.0068","0.0005","90","","90","","90","","2144.7","1.9","296.2","","296.2","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H20 Cl3 N O7 -","- C18 H20 Cl3 N O7 -","- C72 H80 Cl12 N4 O28 -","4","1","","Donohoe, Timothy J.; Blades, Kevin; Helliwell, Madeleine","Synthesis of amino-sugars using the directed dihydroxylation reaction","Chemical Communications","1999","","17","1733","","10.1039/a904991f","","","1.5418","CuKα","","0.0733","0.0499","","","0.1406","0.1554","","","","","","1.032","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115245","15.0426","0.0012","13.9533","0.0009","27.594","0.002","90","","103.62","0.02","90","","5628.9","0.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H75 Co N3 O3 -","- C60 H75 Co N3 O3 -","- C240 H300 Co4 N12 O12 -","4","1","","Verani, Cláudio Nazari; Gallert, Stefan; Bill, Eckhard; Weyhermüller, Thomas; Wieghardt, Karl; Chaudhuri, Phalguni","[Tris(o-iminosemiquinone)cobalt(III)]—a radical complex with an St = 3/2 ground state","Chemical Communications","1999","","17","1747","","10.1039/a903778k","","","0.71073","MoKα","","0.0643","0.0415","","0.1063","0.0971","","","","1.018","1.086","1.086","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115246","7.9","0.003","14.751","0.005","18.956","0.006","90","","90","","90","","2209","1.3","200","2","200","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H32 O2 Si -","- C24 H32 O2 Si -","- C96 H128 O8 Si4 -","4","1","","Knölker, Hans-Joachim; Schmitt, Oliver; Wanzl, Günter; Baum, Gerhard","Stereoselective total synthesis of (±)-fragranol by TiCl4 promoted [2+2] cycloaddition of allyl-tert-butyldiphenylsilane and methyl methacrylate†","Chemical Communications","1999","","17","1737","","10.1039/a905019a","","","0.71073","MoKα","","0.0552","0.0523","","","0.1392","0.1421","","","","","","1.059","","","","has coordinates","301857","2025-08-21","22:47:22",""
"7115247","11.914","0.004","15.342","0.005","9.66","0.003","104.577","0.017","93.422","0.017","106.063","0.015","1626.2","0.9","105","","105","","","","","","","","","6","P -1","-P 1","2","","","","- C58 H78 Cl2 Mn4 N8 O26 -","- C57 H54 Cl2 Mn4 N8 O23.782 -","- C57 H54 Cl2 Mn4 N8 O23.782 -","1","0.5","","Brechin, Euan K.; Huffman, John C.; Christou, George; Yoo, Jae; Nakano, Motohiro; Hendrickson, David N.","A new class of single-molecule magnets: mixed-valent [Mn4(O2CMe)2(Hpdm)6][ClO4]2 with an S = 8 ground state","Chemical Communications","1999","","9","783","","10.1039/a901106d","","","0.71069","MoKα","","","0.0871","","","","0.0679","","","","","","2.2652","","","","has coordinates,has disorder","180266","2020-10-21","18:00:00",""
"7115248","29.825","0.003","27.377","0.002","38.248","0.003","90","","112.71","0.01","90","","28809","5","173","2","173","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C262.5 H262.9 Cl4.6 Mo12 N46.1 O48 -","- C263.304 H192 Cl4.6 Mo12 N46.102 O48 -","- C1053.22 H768 Cl18.4 Mo48 N184.408 O192 -","4","0.5","","Albert Cotton, F.; Daniels, Lee M.; Lin, Chun; Murillo, Carlos A.; Murillo, Carlos A.","The designed ‘self-assembly’ of a three-dimensional molecule containing six quadruply-bonded Mo24+ units","Chemical Communications","1999","","9","841","","10.1039/a901645g","","","0.71073","MoKα","","0.1231","0.0976","","0.2406","0.2174","","","","1.073","","","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7115249","7.1259","0.0005","10.7296","0.001","13.4298","0.0011","103.584","0.008","96.905","0.007","101.691","0.008","962.08","0.15","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H32 Fe N2 -","- C22 H32 Fe N2 -","- C44 H64 Fe2 N4 -","2","1","","Bradley, Sam; McGowan, Patrick C.; Oughton, Karrie A.; Thornton-Pett, Mark; Walsh, Mark E.","Facile synthesis of amino-functionalised ferrocenes and vanadocenes","Chemical Communications","1999","","1","77","","10.1039/a808685k","","","0.71073","MoKα","","0.0256","0.0248","","0.0695","0.0668","","","","1.066","1.067","1.067","","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115250","7.6238","0.0002","10.4591","0.0003","13.8715","0.0002","102.695","0.002","98.438","0.002","101.327","0.0012","1036.97","0.05","190","2","190","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H32 N2 V -","- C22 H32 N2 V -","- C44 H64 N4 V2 -","2","1","","Bradley, Sam; McGowan, Patrick C.; Oughton, Karrie A.; Thornton-Pett, Mark; Walsh, Mark E.","Facile synthesis of amino-functionalised ferrocenes and vanadocenes","Chemical Communications","1999","","1","77","","10.1039/a808685k","","","0.71073","MoKα","","0.0405","0.0339","","","0.0974","0.0996","","","","","","1.095","","","","has coordinates","180266","2020-10-21","18:00:00",""
"7115251","23.418","0.002","23.418","0.002","21.185","0.003","90","","90","","120","","10061.4","1.9","220","","220","","","","","","","","?","6","P -3","-P 3","147","","","","- C72 H61.33 Eu N3 O6.67 P6 -","- C72 H60 Eu N3 O6.66667 P6 -","- C432 H360 Eu6 N18 O40 P36 -","6","1","","Magennis, Steven W.; Parsons, Simon; Pikramenou, Zoe; Corval, Anne; Derek Woollins, J.","Imidodiphosphinate ligands as antenna units in luminescent lanthanide complexes","Chemical Communications","1999","","1","61","","10.1039/a808046a","","","0.71073","MoKα","","","0.0426","","","0.0418","","","","","1.1338","1.1338","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7115252","23.372","0.004","23.372","0.004","42.956","0.008","90","","90","","120","","20321","6","220","2","220","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C72 H61.5 N3 O6.75 P6 Tb -","- C72 H60 N3 O6.75 P6 Tb -","- C864 H720 N36 O81 P72 Tb12 -","12","0.666667","","Magennis, Steven W.; Parsons, Simon; Pikramenou, Zoe; Corval, Anne; Derek Woollins, J.","Imidodiphosphinate ligands as antenna units in luminescent lanthanide complexes","Chemical Communications","1999","","1","61","","10.1039/a808046a","","","0.71073","MoKα","","0.0965","0.0624","","","0.1492","0.1744","","","","","","1.033","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7125460","9.5552","0.0002","9.5131","0.0003","17.1505","0.0009","88.553","0.004","83.021","0.003","87.903","0.002","1546.05","0.1","298","","298","","","","","","","","local laboratory","2","P -1","-P 1","2","Octapropylcyclooctatetraene","1,2,3,4,5,6,7,8-Octapropyl-1,3,5,7-cyclooctatetraene","","- C32 H56 -","- C32 H56 -","- C64 H112 -","2","1","","Takahashi, Tamotsu; Sun, Wen-Hua; Nakajima, Kiyohiko","Formation of cyclooctatetraenes from zirconacyclopentadienes","Chemical Communications","1999","","16","1595","","10.1039/a902788b","","","1.54184","CuKα","","0.104","0.053","","0.072","0.063","","","","1.64","2.128","2.128","","","","","has coordinates","301860","2025-08-22","09:26:38",""
"7125461","10.861","0.002","20.595","0.003","8.948","0.002","90","","90","","90","","2001.5","0.6","163","","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H32 N2 O3 -","- C20 H32 N2 O3 -","- C80 H128 N8 O12 -","4","1","","Pérollier, Céline; Pécaut, Jacques; Ramasseul, René; Marchon, Jean-Claude; Bau, Robert","High-yield synthesis of a chiroporphyrin by hydrogen bond-directed cyclisation","Chemical Communications","1999","","16","1597","","10.1039/a904134f","","","1.54178","CuKα","","0.0667","0.0608","","0.1882","0.1553","","","","1.187","1.929","1.929","","","","","has coordinates","301860","2025-08-22","09:26:38",""
"7125462","15.091","0.003","15.091","0.003","63.545","0.018","90","","90","","90","","14472","6","293","2","293","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C106 H168 N12 Ni O16 S5 -","- C106 H132 N12 Ni O16 S5 -","- C424 H528 N48 Ni4 O64 S20 -","4","0.5","","Pérollier, Céline; Pécaut, Jacques; Ramasseul, René; Marchon, Jean-Claude; Bau, Robert","High-yield synthesis of a chiroporphyrin by hydrogen bond-directed cyclisation","Chemical Communications","1999","","16","1597","","10.1039/a904134f","","","0.71073","MoKα","","0.3255","0.1198","","","0.265","0.3091","","","","","","1.015","","","","has coordinates","243853","2020-10-21","18:00:00",""
"7125463","15.359","0.001","19.181","0.002","10.616","0.0008","90","","101.12","0.0005","90","","3068.8","0.4","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C41 H28 O4 -","- C41 H28 O4 -","- C164 H112 O16 -","4","0.5","","Yang, Xiao-Ping; Du, Da-Ming; Li, Qi; Mak, Thomas C. W.; Wong, Henry N. C.","Synthesis, structure and inclusion properties of 1,4,15,18-tetrahydro-1,4,15,18-tetraoxodibenzo[b,h]tetraphenylene†","Chemical Communications","1999","","16","1607","","10.1039/a904144c","","","0.71073","MoKα","","0.0928","0.0807","","0.2543","0.2289","","","","0.924","0.93","0.93","","","","","has coordinates","243854","2020-10-21","18:00:00",""
"7125464","15.807","0.002","18.59","0.003","10.59","0.002","90","","100.55","0.011","90","","3059.3","0.9","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C38 H30 O4 -","- C38 H30 O4 -","- C152 H120 O16 -","4","0.5","","Yang, Xiao-Ping; Du, Da-Ming; Li, Qi; Mak, Thomas C. W.; Wong, Henry N. C.","Synthesis, structure and inclusion properties of 1,4,15,18-tetrahydro-1,4,15,18-tetraoxodibenzo[b,h]tetraphenylene†","Chemical Communications","1999","","16","1607","","10.1039/a904144c","","","0.71073","MoKα","","0.0732","0.0632","","0.2095","0.1906","","","","0.731","0.71","0.71","","","","","has coordinates","301860","2025-08-22","09:26:38",""
"7125465","9.345","0.002","10.121","0.003","14.498","0.003","98.648","0.01","101.23","0.013","101.23","0.013","1293.7","0.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C34 H20 O6 -","- C34 H20 O6 -","- C68 H40 O12 -","2","1","","Yang, Xiao-Ping; Du, Da-Ming; Li, Qi; Mak, Thomas C. W.; Wong, Henry N. C.","Synthesis, structure and inclusion properties of 1,4,15,18-tetrahydro-1,4,15,18-tetraoxodibenzo[b,h]tetraphenylene†","Chemical Communications","1999","","16","1607","","10.1039/a904144c","","","0.71073","MoKα","","0.0829","0.0687","","0.202","0.1858","","","","1.269","1.314","1.314","","","","","has coordinates","301860","2025-08-22","09:26:38",""
"7125466","10.498","0.003","9.646","0.002","14.687","0.003","90","","101.08","0.01","90","","1459.5","0.6","293","2","293","2","","","","","","","","3","P 1 2/n 1","-P 2yac","13","","","","- C38 H28 O4 -","- C38 H16 O4 -","- C76 H32 O8 -","2","0.5","","Yang, Xiao-Ping; Du, Da-Ming; Li, Qi; Mak, Thomas C. W.; Wong, Henry N. C.","Synthesis, structure and inclusion properties of 1,4,15,18-tetrahydro-1,4,15,18-tetraoxodibenzo[b,h]tetraphenylene†","Chemical Communications","1999","","16","1607","","10.1039/a904144c","","","0.71073","MoKα","","0.0933","0.0806","","0.2696","0.2358","","","","1.112","1.139","1.139","","","","","has coordinates","243854","2020-10-21","18:00:00",""
"7125467","9.891","0.002","10.419","0.002","13.574","0.003","67.91","0.03","74.89","0.03","87.88","0.03","1248.4","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H38 N2 O4 S2 -","- C23 H38 N2 O4 S2 -","- C46 H76 N4 O8 S4 -","2","1","","Coldham, Iain; Crapnell, Katherine M.; Fernàndez, Joan-Carles; Haxell, Thomas F. N.; Treacy, Alan B.; Coles, Simon J.; Hursthouse, Michael B.; Moseley, Jonathan D.","A new stereoselective approach to the manzamine alkaloids","Chemical Communications","1999","","17","1757","","10.1039/a904667d","","","0.71073","MoKα","","0.0931","0.0556","","","0.1348","0.1593","","","","","","0.964","","","","has coordinates","301860","2025-08-22","09:26:38",""
"7209337","6.201","","6.701","","12.675","","90","","90","","90","","526.683","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Ag Hg2 O2 (N O3)","","- Ag Hg2 N O5 -","- Ag Hg2 N O5 -","- Ag4 Hg8 N4 O20 -","4","0.5","","Mormann, T.J.; Jeitschko, W.","The silver(I) mercury(II) oxide nitrate with the empirical formula Ag Hg2 N O5","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1999","54","","1489","1494","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209365","4.4544","","4.4544","","11.106","","90","","90","","90","","220.362","","","","","","","","","","","","","4","P 4 m m","P 4 -2","99","","Ag2.80 Eu Na0.20 Te4","","- Ag2.8 Eu Na0.2 Te4 -","- Ag2.79 Eu Na0.21 Te4 -","- Ag2.79 Eu Na0.21 Te4 -","1","0.125","","Brazis, P.; Kannewurf, C.R.; Patschke, R.; Kanatzidis, M.G.","Cu0.66 Eu Te2, K Cu2 Eu Te4 and Na0.2 Ag2.8 Eu Te4: compounds with modulated square Te nets","Journal of Materials Chemistry","1999","9","","2293","2296","10.1039/a903945g","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209406","9.286","","4.658","","10.429","","90","","92.28","","90","","450.741","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Eu2 Au2 Sn5","","- Au2 Eu2 Sn5 -","- Au2 Eu2 Sn5 -","- Au4 Eu4 Sn10 -","2","0.5","","Kussmann, D.; Mosel, B.D.; Rodewald, U.C.; Rosenhahn, C.; Kuennen, B.; Kotzyba, G.; Poettgen, R.","Structure and properties of the stannide Eu2 Au2 Sn5, and its relationship with the family of Ba Al4-related structures","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1999","54","","1155","1164","","","","","","","","","","","","","","","","","","","","","","has coordinates","180425","2020-10-21","18:00:00",""
"7212954","15.157","0.009","8.7321","0.0018","13.507","0.015","90","","90.94","0.03","90","","1787","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H16 Ag2 N3 S12 Se4 -","- C23 H16 Ag2 N3 S8 Se5.866 -","- C46 H32 Ag4 N6 S16 Se11.732 -","2","0.5","","Golhen, Stéphane; Ouahab, Lahcène; Lebeuze, Albert; Bouayed, Mounir; Delhaes, Pierre; Kashimura, Yoshiaki; Kato, Reizo; Binet, Laurent; Fabre, Jean-Marc","Preparation, crystal structures, EHT band calculations and physical properties of κ-(EDS-EDT-TTF)2[Ag2(CN)3] and α-(BETS)2Ag(CN)2","Journal of Materials Chemistry","1999","9","2","387","","10.1039/a804995e","","","0.71073","MoKα","","0.1592","0.0552","","","0.1069","0.1337","","","","","","1.035","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212955","9.5839","0.0008","4.983","0.003","34.645","0.006","90","","90","","90","","1654.5","1","293","2","293","2","","","","","","","","6","P 21 21 2","P 2 2ab","18","","","","- C22 H16 Ag N2 S8 Se8 -","- C22 H16 Ag N2 S8 Se8 -","- C44 H32 Ag2 N4 S16 Se16 -","2","0.5","","Golhen, Stéphane; Ouahab, Lahcène; Lebeuze, Albert; Bouayed, Mounir; Delhaes, Pierre; Kashimura, Yoshiaki; Kato, Reizo; Binet, Laurent; Fabre, Jean-Marc","Preparation, crystal structures, EHT band calculations and physical properties of κ-(EDS-EDT-TTF)2[Ag2(CN)3] and α-(BETS)2Ag(CN)2","Journal of Materials Chemistry","1999","9","2","387","","10.1039/a804995e","","","0.71073","MoKα","","0.2658","0.057","","","0.1158","0.1738","","","","","","0.926","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212958","22.4037","0.0002","19.5153","0.0002","12.7108","0.0002","90","","90","","90","","5557.35","0.12","293","2","293","2","","","","","","","see text","5","P n m a","-P 2ac 2n","62","","","","- C16 H57.5 Mo12.5 N6 O41.5 -","- C16 H38 Mo12.5 N6 O41.5 -","- C64 H152 Mo50 N24 O166 -","4","0.5","","Duraisamy, T.; Ramanan, A.; Vittal, J. J.","Two new inorganic-organic hybrid salts: [NH2Me2]4[NMe4]2-[Mo0.5O4⊂(Mo12O36)]·1.5H2O and [NMe4]2[NH4]2[Mo8O26]·2H2O","Journal of Materials Chemistry","1999","9","3","763","","10.1039/a806073h","","","0.71073","MoKα","","0.0595","0.0472","","0.1326","0.125","","","","1.119","1.155","1.155","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7212959","11.2641","0.0001","16.3815","0.0001","10.0775","0.0001","90","","110.242","0.001","90","","1744.68","0.03","293","2","293","2","","","","","","","see text","5","C 1 2/m 1","-C 2y","12","","","","- C8 H36 Mo8 N4 O28 -","- C8 H36 Mo8 N4 O28 -","- C16 H72 Mo16 N8 O56 -","2","0.25","","Duraisamy, T.; Ramanan, A.; Vittal, J. J.","Two new inorganic-organic hybrid salts: [NH2Me2]4[NMe4]2-[Mo0.5O4⊂(Mo12O36)]·1.5H2O and [NMe4]2[NH4]2[Mo8O26]·2H2O","Journal of Materials Chemistry","1999","9","3","763","","10.1039/a806073h","","","0.71073","MoKα","","0.0279","0.0241","","0.064","0.0622","","","","1.101","1.126","1.126","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212960","5.4492","0.0019","7.905","0.0012","8.7156","0.0015","108.173","0.017","99.135","0.019","104.05","0.03","334.65","0.16","288","2","288","2","","","","","","","","5","P -1","-P 1","2","","","","- C3 H5 N3 O4 S -","- C3 H5 N3 O4 S -","- C6 H10 N6 O8 S2 -","2","1","","Ra, Do Young; Cho, Nam Sook; Kang, Sung Kwon; Choi, Eun Suk; Suh, Il Hwan","Synthetic and tautomeric studies of 5-amino-2,3-dihydro-1,2,4-oxadiazol-3-one","Journal of the Chemical Society, Perkin Transactions 2","1999","","1","81","","10.1039/a806491a","","","0.71073","MoKα","","0.0403","0.0354","","","0.0848","0.088","","","","","","0.986","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212961","7.8955","0.0017","11.486","0.002","28.835","0.006","90","","90","","90","","2615","0.9","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C28 H48 O4 -","- C28 H48 O4 -","- C112 H192 O16 -","4","1","","Drosihn, Susanne; Porzel, Andrea; Voigt, Brunhilde; Brandt, Wolfgang; Wagner, Christoph; Merzweiler, Kurt; Adam, Günter","Conformational studies of two new brassinosteroid analogues with a 22,23-trans diol function","Journal of the Chemical Society, Perkin Transactions 2","1999","","2","233","","10.1039/a807440b","","","0.71073","MoKα","","0.0442","0.0314","","","0.0719","0.0765","","","","","","0.968","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212962","8.6488","0.0009","8.919","0.003","11.316","0.002","82.06","0.02","74.331","0.01","85.71","0.02","831.8","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H38 N14 Ni -","- C36 H38 N14 Ni -","- C36 H38 N14 Ni -","1","0.5","","Azcondo, M. Teresa; Ballester, Loreto; Golhen, Stephane; Gutierrez, Angel; Ouahab, Lahcene; Yartsev, Slav; Delhaes, Pierre","Structural, magnetic, electrical and optical characterization of systems built from [M([9]aneN3)2]2+ (M=CuII or NiII) and TCNQ or TCNQF4","Journal of Materials Chemistry","1999","9","6","1237","","10.1039/a807595f","","","0.71073","MoKα","","0.0853","0.0551","","0.1601","0.1423","","","","1.058","1.066","1.066","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212963","8.6806","0.0011","8.915","0.005","11.348","0.002","82.03","0.03","74.109","0.014","84.95","0.02","835.3","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H38 Cu N14 -","- C36 H38 Cu N14 -","- C36 H38 Cu N14 -","1","0.5","","Azcondo, M. Teresa; Ballester, Loreto; Golhen, Stephane; Gutierrez, Angel; Ouahab, Lahcene; Yartsev, Slav; Delhaes, Pierre","Structural, magnetic, electrical and optical characterization of systems built from [M([9]aneN3)2]2+ (M=CuII or NiII) and TCNQ or TCNQF4","Journal of Materials Chemistry","1999","9","6","1237","","10.1039/a807595f","","","0.71073","MoKα","","0.0637","0.0433","","0.1264","0.1135","","","","1.005","0.996","0.996","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212964","8.35","0.002","9.884","0.004","14.369","0.004","74.1","0.02","89.01","0.02","69.11","0.02","1061.3","0.6","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C48 H42 Cu N18 -","- C48 H42 Cu N18 -","- C48 H42 Cu N18 -","1","0.5","","Azcondo, M. Teresa; Ballester, Loreto; Golhen, Stephane; Gutierrez, Angel; Ouahab, Lahcene; Yartsev, Slav; Delhaes, Pierre","Structural, magnetic, electrical and optical characterization of systems built from [M([9]aneN3)2]2+ (M=CuII or NiII) and TCNQ or TCNQF4","Journal of Materials Chemistry","1999","9","6","1237","","10.1039/a807595f","","","0.71073","MoKα","","0.0427","0.0311","","0.0891","0.0829","","","","1.055","1.058","1.058","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212965","15.476","0.005","16.146","0.004","16.441","0.004","77.15","0.02","78.04","0.03","85.43","0.03","3915.9","1.9","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H35 Cu F8 N14 O1.5 -","- C36 H33 Cu F8 N14 O2.5 -","- C144 H132 Cu4 F32 N56 O10 -","4","2","","Azcondo, M. Teresa; Ballester, Loreto; Golhen, Stephane; Gutierrez, Angel; Ouahab, Lahcene; Yartsev, Slav; Delhaes, Pierre","Structural, magnetic, electrical and optical characterization of systems built from [M([9]aneN3)2]2+ (M=CuII or NiII) and TCNQ or TCNQF4","Journal of Materials Chemistry","1999","9","6","1237","","10.1039/a807595f","","","0.71073","MoKα","","0.1726","0.056","","0.1384","0.1039","","","","1.03","1.143","1.143","","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212967","9.556","0.003","6.038","0.002","9.994","0.004","90","","103.69","0.03","90","","560.3","0.3","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(3R)-3-Phenyl-3,4,6,8-tetrahydro-1H-furo[3,4-b]pyrrole[1,2-6]thiazole","","- C14 H13 N O S -","- C14 H13 N O S -","- C28 H26 N2 O2 S2 -","2","1","","M. V. D. Pinho e Melo, Teresa; M. Barbosa, Dália; J. R. S. Ramos, Paulo; M. d’A. Rocha Gonsalves, António; L. Gilchrist, Thomas; M. Beja, Ana; A. Paixão, José; R. Silva, Manuela; Alte da Veiga, Luiz","Intramolecular dipolar cycloaddition reaction of 5H,7H-thiazolo[3,4-c]oxazol-4-ium-1-olates: synthesis of chiral 1H-pyrrolo[1,2-c]thiazole derivatives","Journal of the Chemical Society, Perkin Transactions 1","1999","","9","1219","","10.1039/a807678b","","","0.71073","MoKα","","0.0264","0.0254","","","0.0687","0.0694","","","","","","1.063","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212968","10.217","0.002","11.655","0.002","10.936","0.002","90","","117.38","0.03","90","","1156.4","0.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H32 O7 -","- C22 H32 O7 -","- C44 H64 O14 -","2","1","","Aggarwal, Varinder K.; Masters, Susannah J.; Adams, Harry; Spey, Sharon E.; Brown, George R.; Foubister, Alan J.","The effects of different ester and ketal protecting groups on the reactivity and selectivity of tartrate-derived silylketene acetals","Journal of the Chemical Society, Perkin Transactions 1","1999","","2","155","","10.1039/a807863g","","","0.71073","MoKα","","0.0628","0.0495","","0.1816","0.1253","","","","1.107","1.002","1.002","","","","","has coordinates,has disorder","301864","2025-08-22","15:14:30",""
"7212969","20.403","0.006","10.402","0.003","6.824","0.002","90","","96.69","0.02","90","","1438.4","0.7","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H19 N2 O4 -","- C14 H19 N2 O4 -","- C56 H76 N8 O16 -","4","1","","Stroh, Christophe; Romero, Francisco M.; Kyritsakas, Nathalie; Catala, Laure; Turek, Philippe; Ziessel, Raymond","Synthesis, structure and properties of benzoic acids bearing para- or meta-imino nitroxides or ortho-nitronyl nitroxide radical centres","Journal of Materials Chemistry","1999","9","4","875","","10.1039/a808018f","","","1.54184","Cu-Kα","","0.046","0.039","","0.058","","0.058","","","0.994","","","1.105","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212970","6.916","0.002","20.003","0.006","10.165","0.003","90","","106.68","0.02","90","","1347.1","0.7","294","","294","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H17 N2 O3 -","- C14 H17 N2 O3 -","- C56 H68 N8 O12 -","4","1","","Stroh, Christophe; Romero, Francisco M.; Kyritsakas, Nathalie; Catala, Laure; Turek, Philippe; Ziessel, Raymond","Synthesis, structure and properties of benzoic acids bearing para- or meta-imino nitroxides or ortho-nitronyl nitroxide radical centres","Journal of Materials Chemistry","1999","9","4","875","","10.1039/a808018f","","","0.71073","Mo-Kα","","0.145","0.043","","0.095","","0.055","","","1.728","","","1.034","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212971","25.458","0.002","7.6775","0.0006","15.1702","0.0005","90","","107.158","0.004","90","","2833.1","0.3","294","","294","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C14 H17 N2 O4 -","- C14 H16 N2 O4 -","- C112 H128 N16 O32 -","8","2","","Stroh, Christophe; Romero, Francisco M.; Kyritsakas, Nathalie; Catala, Laure; Turek, Philippe; Ziessel, Raymond","Synthesis, structure and properties of benzoic acids bearing para- or meta-imino nitroxides or ortho-nitronyl nitroxide radical centres","Journal of Materials Chemistry","1999","9","4","875","","10.1039/a808018f","","","0.71073","Mo-Kα","","0.064","0.035","","0.063","","0.046","","","1.395","","","1.067","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7212972","9.937","0.002","13.685","0.002","8.431","0.003","94.18","0.02","97.37","0.02","100.32","0.01","1113.2","0.5","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H10 Cl O8 S8 -","- C16 H10 Cl O8 S8 -","- C32 H20 Cl2 O16 S16 -","2","1","","Iyoda, Masahiko; Ogura, Eiji; Hara, Kenji; Kuwatani, Yoshiyuki; Nishikawa, Hiroyuki; Sato, Tatsuo; Kikuchi, Koichi; Ikemoto, Isao; Mori, Takehiko","Conducting charge-transfer and radical ion salts based on bitetrathiafulvalenes; an approach to organic metals using stoichiometry control","Journal of Materials Chemistry","1999","9","2","335","","10.1039/a808053d","","","0.7107","MoKα","","","0.0479","","","0.0476","","","","","1.6","1.6","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212973","5.452","0.012","7.353","0.006","19.264","0.019","90","","90","","90","","772","2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H11 N O2 S -","- C6 H11 N O2 S -","- C24 H44 N4 O8 S4 -","4","1","","Woydowski, Karsten; Fleischhauer, Jörg; Schiffer, Jan; Liebscher, Jürgen","Synthesis of optically active 3,4,5,6-tetrahydro-2H-1,4-thiazin-3-ones and their benzo analogues by ring transformation of glycidic esters","Journal of the Chemical Society, Perkin Transactions 1","1999","","2","149","","10.1039/a808111e","","","0.71073","MoKα","","0.0474","0.0434","","0.1317","0.1103","","","","1.079","1.077","1.077","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212974","7.992","0.002","9.275","0.001","12.987","0.003","90","","106.356","0.005","90","","923.7","0.3","295","","","","","","","","","","Local laboratory","4","P 1 21/n 1","-P 2yn","14","","","","- C3 H15 B3 N6 -","- C3 H15 B3 N6 -","- C12 H60 B12 N24 -","4","1","","Cornu, David; Miele, Philippe; Faure, René; Bonnetot, Bernard; Mongeot, Henri; Bouix, Jean","Conversion of B(NHCH3)3 into boron nitride and polyborazine fibres and tubular BN structures derived therefrom","Journal of Materials Chemistry","1999","9","3","757","","10.1039/a808213h","","","0.71073","MoKα","","","0.042","","","0.043","","","","","1.211","1.211","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212975","7.987","0.0002","12.6805","0.0004","8.1337","0.0003","90","","105.788","0.002","90","","792.7","0.04","123","2","123","2","","","","","","","","2","P 1 21 1","P 2yb","4","","14,17-Dimethyl-[2](1,3)azuleno[2]paracyclophane","","- C22 H22 -","- C22 H22 -","- C44 H44 -","2","1","","Grimme, Stefan; Mennicke, Wolfram; Vögtle, Fritz; Nieger, Martin","Experimental and theoretical studies of a chiral azulenophane: synthesis, structure and circular dichroism spectra of 14,17-dimethyl[2](1,3)azuleno[2]paracyclophane","Journal of the Chemical Society, Perkin Transactions 2","1999","","3","521","","10.1039/a808320g","","","0.71073","MoKα","","0.047","0.0413","","","0.0965","0.0981","","","","","","1.044","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212976","20.979","0.005","12.7224","0.0011","17.618","0.006","90","","98.88","0.03","90","","4646","2","283","","283","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C54 H58 O9 -","- C54 H58 O9 -","- C216 H232 O36 -","4","1","","Kim, Jong Seung; Pang, Jin Hyun; Yu, Ill Yong; Lee, Won Ku; Suh, Il Hwan; Kim, Jong Kuk; Cho, Moon Hwan; Kim, Eun Tae; Ra, Do Young","Calix[4]arene dibenzocrown ethers as caesium selective extractants","Journal of the Chemical Society, Perkin Transactions 2","1999","","4","837","","10.1039/a808499h","","","0.71069","MoKα","","0.2107","0.0893","","","0.1397","0.164","","","","","","1.32","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212977","13.11","0.004","18.355","0.003","11.861","0.01","90","","97.92","0.04","90","","2827","3","288","2","288","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C62 H74 O9 -","- C62 H74 O9 -","- C124 H148 O18 -","2","1","","Kim, Jong Seung; Pang, Jin Hyun; Yu, Ill Yong; Lee, Won Ku; Suh, Il Hwan; Kim, Jong Kuk; Cho, Moon Hwan; Kim, Eun Tae; Ra, Do Young","Calix[4]arene dibenzocrown ethers as caesium selective extractants","Journal of the Chemical Society, Perkin Transactions 2","1999","","4","837","","10.1039/a808499h","","","0.71073","MoKα","","0.2116","0.0619","","","0.0873","0.1554","","","","","","0.872","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212978","6.056","0.002","20.437","0.005","21.335","0.005","90","","95.2","0.02","90","","2629.7","1.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H30 N4 O -","- C32 H30 N4 O -","- C128 H120 N16 O4 -","4","1","","Sharma, Arun K.; Hundal, Geeta; Obrai, Sangeeta; Mahajan, Mohinder P.","Highly regioselective nucleophilic/cycloaddition reactions of N-arylamino 1,3-diazabuta-1,3-dienes with α-nitrosostyrenes: synthesis of functionalised imidazoles and imidazole oxides","Journal of the Chemical Society, Perkin Transactions 1","1999","","5","615","","10.1039/a808574i","","","0.71073","MoKα","","0.0766","0.0512","","0.1792","0.1488","","","","1.103","1.125","1.125","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212979","12.295","0.001","9.554","0.001","20.636","0.002","90","","99.7","0.01","90","","2389.4","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H24 N4 O2 -","- C29 H24 N4 O2 -","- C116 H96 N16 O8 -","4","1","","Sharma, Arun K.; Hundal, Geeta; Obrai, Sangeeta; Mahajan, Mohinder P.","Highly regioselective nucleophilic/cycloaddition reactions of N-arylamino 1,3-diazabuta-1,3-dienes with α-nitrosostyrenes: synthesis of functionalised imidazoles and imidazole oxides","Journal of the Chemical Society, Perkin Transactions 1","1999","","5","615","","10.1039/a808574i","","","0.71073","MoKα","","0.0693","0.0447","","0.1454","0.1122","","","","1.14","1.061","1.061","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212980","14.998","0.003","9.397","0.002","14.153","0.004","90","","111.847","0.018","90","","1851.4","0.8","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-Ethyl 14-Methyl 3-Methyl-15-oxo-17-oxa-2,16-diazapentacyclo[12.2.1.0^1,12^. 0^5,16^.0^6,11^]heptadeca-6,8,10-triene-4,14-dicarboxylate","","- C20 H22 N2 O6 -","- C20 H22 N2 O6 -","- C80 H88 N8 O24 -","4","1","","Jauk, Birgit; Belaj, Ferdinand; Kappe, C. Oliver","Synthesis and reactions of Biginelli-compounds. Part 14.1 A rhodium-induced cyclization–cycloaddition sequence for the construction of conformationally rigid calcium channel modulators of the dihydropyrimidine type","Journal of the Chemical Society, Perkin Transactions 1","1999","","3","307","","10.1039/a808594c","","","0.71069","MoKα","","0.0826","0.0492","","","0.1058","0.1238","","","","","","1.025","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212981","9.133","0.002","10.921","0.002","22.979","0.005","90","","91.29","0.03","90","","2291.4","0.8","193","2","193","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H28 O10 -","- C24 H28 O10 -","- C96 H112 O40 -","4","1","","Setälä, Harri; Pajunen, Aarne; Rummakko, Petteri; Sipilä, Jussi; Brunow, Gösta","A novel type of spiro compound formed by oxidative cross coupling of methyl sinapate with a syringyl lignin model compound. A model system for the β-1 pathway in lignin biosynthesis","Journal of the Chemical Society, Perkin Transactions 1","1999","","4","461","","10.1039/a808884e","","","0.71073","MoKα","","0.1433","0.0762","","0.2004","0.1651","","","","1.027","1.243","1.243","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212982","13.9032","0.0005","13.9032","0.0005","23.9326","0.0012","90","","90","","90","","4626.1","0.3","298","2","298","2","","","","","","","see text","3","P 43 21 2","P 4nw 2abw","96","Tetraethyl-ET","Bis(1,2-diethyl-ethylenedithio)tetrathiafulvalene","","- C18 H24 S8 -","- C18 H24 S8 -","- C144 H192 S64 -","8","1","","Kini, Aravinda M.; Parakka, James P.; Geiser, Urs; Wang, Hsien-Hau; Rivas, Felix; DiNino, Ernest; Thomas, Seddon; Dudek, James D.; Williams, Jack M.","Tetraalkyl- and dialkyl-substituted BEDT-TTF derivatives and their cation-radical salts: synthesis, structure, and properties","Journal of Materials Chemistry","1999","9","4","883","","10.1039/a809132c","","","0.71073","MoKα","","0.0819","0.0501","","0.1002","0.0898","","","","1.083","1.16","1.16","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212983","18.619","0.002","19.864","0.002","8.4853","0.0008","90","","90","","90","","3138.3","0.5","301","2","301","2","","","","","","","grown by electrocrystallization","5","C m c m","-C 2c 2","63","","Bis(1,2-diethyl-ethylenedithio)tetrathiafulvalenium tetrachloroaurate(III) dichloroaurate(I) (1:1:1)","","- C18 H32 Au2 Cl6 S8 -","- C18 Au2 Cl6 S8 -","- C72 Au8 Cl24 S32 -","4","0.25","","Kini, Aravinda M.; Parakka, James P.; Geiser, Urs; Wang, Hsien-Hau; Rivas, Felix; DiNino, Ernest; Thomas, Seddon; Dudek, James D.; Williams, Jack M.","Tetraalkyl- and dialkyl-substituted BEDT-TTF derivatives and their cation-radical salts: synthesis, structure, and properties","Journal of Materials Chemistry","1999","9","4","883","","10.1039/a809132c","","","0.71073","MoKα","","0.0844","0.059","","0.1232","0.1131","","","","1.155","1.201","1.201","","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212984","13.19","0.003","18.925","0.004","6.5035","0.0013","90","","98.19","0.03","90","","1606.9","0.6","293","2","293","2","","","","","","","grown by electrocrystallization","5","C 1 2/m 1","-C 2y","12","","Bis(1,2-diethyl-ethylenedithio)tetrathiafulvalenium dibromoiodate (1:2)","","- C18 H24 Br4 I2 S8 -","- C18 H24 Br4 I2 S8 -","- C36 H48 Br8 I4 S16 -","2","0.25","","Kini, Aravinda M.; Parakka, James P.; Geiser, Urs; Wang, Hsien-Hau; Rivas, Felix; DiNino, Ernest; Thomas, Seddon; Dudek, James D.; Williams, Jack M.","Tetraalkyl- and dialkyl-substituted BEDT-TTF derivatives and their cation-radical salts: synthesis, structure, and properties","Journal of Materials Chemistry","1999","9","4","883","","10.1039/a809132c","","","0.71073","MoKα","","0.0633","0.0504","","0.1247","0.1174","","","","1.128","1.159","1.159","","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212985","39.754","0.002","13.8902","0.0007","11.4853","0.0006","90","","92.722","0.001","90","","6334.9","0.6","298","2","298","2","","","","","","","diffusion-controlled chemical oxidation","5","C 1 2/c 1","-C 2yc","15","","Bis(1,2-diethyl-ethylenedithio)tetrathiafulvalenium triiodide solvate with 1,1,2-trichloroethane (1:1:ca.1)","","- C20 H27 Cl3 I3 S8 -","- C19 H24 Cl0.83 I3 S8 -","- C152 H192 Cl6.64 I24 S64 -","8","1","","Kini, Aravinda M.; Parakka, James P.; Geiser, Urs; Wang, Hsien-Hau; Rivas, Felix; DiNino, Ernest; Thomas, Seddon; Dudek, James D.; Williams, Jack M.","Tetraalkyl- and dialkyl-substituted BEDT-TTF derivatives and their cation-radical salts: synthesis, structure, and properties","Journal of Materials Chemistry","1999","9","4","883","","10.1039/a809132c","","","0.71073","MoKα","","0.1273","0.0849","","0.1761","0.1591","","","","1.247","1.363","1.363","","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212986","35.639","0.002","9.4278","0.0004","14.7617","0.0007","90","","94.456","0.001","90","","4944.9","0.4","298","2","298","2","","","","","","","crystal grown by electrocrystallization","5","P 1 21/c 1","-P 2ybc","14","","(1,2-diethyl-ethylenedithio)tetrathiafulvalenium dibromoiodate (2:3)","","- C28 H32 Br6 I3 S16 -","- C28 H31.36 Br6 I3 S16 -","- C112 H125.44 Br24 I12 S64 -","4","1","","Kini, Aravinda M.; Parakka, James P.; Geiser, Urs; Wang, Hsien-Hau; Rivas, Felix; DiNino, Ernest; Thomas, Seddon; Dudek, James D.; Williams, Jack M.","Tetraalkyl- and dialkyl-substituted BEDT-TTF derivatives and their cation-radical salts: synthesis, structure, and properties","Journal of Materials Chemistry","1999","9","4","883","","10.1039/a809132c","","","0.71073","MoKα","","0.1597","0.0761","","0.1978","0.1646","","","","1.067","1.352","1.352","","","","","has coordinates,has disorder","180460","2020-10-21","18:00:00",""
"7212987","10.974","0.001","11.421","0.001","11.698","0.001","114.18","0.004","93.573","0.005","116.809","0.006","1137.5","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H52 Cl2 Cu N4 O20 -","- C18 H26 Cl Cu0.5 N2 O10 -","- C36 H52 Cl2 Cu N4 O20 -","2","1","","Lebon, Florence; Ledecq, Marie; Benatallah, Zohra; Sicsic, Sames; Lapouyade, René; Kahn, Olivier; Garçon, Arnaud; Reboud-Ravaux, Michèle; Durant, François","Synthesis and structural analysis of copper(II) pyridine amide complexes as HIV-1 protease inhibitors","Journal of the Chemical Society, Perkin Transactions 2","1999","","4","795","","10.1039/a809270b","","","1.54179","CuKa","","0.0493","0.0473","","0.1416","0.1375","","","","1.082","1.1","1.1","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7212988","8.544","0.001","8.858","0.001","13.707","0.001","88.05","0.005","72.984","0.005","64.944","0.004","893.77","0.17","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C36 H32 Cl2 Cu N4 O12 -","- C18 H16 Cl Cu0.5 N2 O6 -","- C36 H32 Cl2 Cu N4 O12 -","2","1","","Lebon, Florence; Ledecq, Marie; Benatallah, Zohra; Sicsic, Sames; Lapouyade, René; Kahn, Olivier; Garçon, Arnaud; Reboud-Ravaux, Michèle; Durant, François","Synthesis and structural analysis of copper(II) pyridine amide complexes as HIV-1 protease inhibitors","Journal of the Chemical Society, Perkin Transactions 2","1999","","4","795","","10.1039/a809270b","","","1.54178","CuKa","","0.0463","0.0432","","0.1135","0.1116","","","","1.04","1.07","1.07","","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7212989","14.84","0.001","6.813","0.001","22.68","0.001","90","","97.796","0.006","90","","2271.9","0.4","295","","295","","","","","","","","by syntheses","4","I 1 2/a 1","-I 2ya","15","","","","- C14 H11 N O3 -","- C14 H11 N O3 -","- C112 H88 N8 O24 -","8","1","","Ligtenbarg, Alette G. J.; Hage, Ronald; Meetsma, Auke; Feringa, Ben L.","Hydrogen bonding properties and intermediate structure of N-(2-carboxyphenyl)salicylidenimine","Journal of the Chemical Society, Perkin Transactions 2","1999","","4","807","","10.1039/a809497g","","","0.71073","MoKα","","0.05","0.0388","","","0.1102","0.1154","","","","","","1.032","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212990","14.831","0.001","6.718","0.001","22.66","0.005","90","","97.61","0.005","90","","2237.8","0.6","130","","130","","","","","","","","by syntheses","4","I 1 2/a 1","-I 2ya","15","","","","- C14 H11 N O3 -","- C14 H11 N O3 -","- C112 H88 N8 O24 -","8","1","","Ligtenbarg, Alette G. J.; Hage, Ronald; Meetsma, Auke; Feringa, Ben L.","Hydrogen bonding properties and intermediate structure of N-(2-carboxyphenyl)salicylidenimine","Journal of the Chemical Society, Perkin Transactions 2","1999","","4","807","","10.1039/a809497g","","","0.71073","MoKα","","0.0482","0.0359","","","0.0951","0.1001","","","","","","1.05","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212991","12.027","0.003","12.291","0.005","8.642","0.002","93.98","0.03","95.05","0.02","75.6","0.03","1231.1","0.7","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C30 H22 Cl2 O4 -","- C30 H22 Cl2 O4 -","- C60 H44 Cl4 O8 -","2","1","","Iwamoto, Hidetoshi; Takuwa, Akio; Hamada, Kensaku; Fujiwara, Ryuji","Intra- and intermolecular photocyclization of vinylbenzo-1,4-quinones","Journal of the Chemical Society, Perkin Transactions 1","1999","","5","575","","10.1039/a809530b","","","1.5418","CuKα","","0.061","0.059","","","0.1387","0.1403","","","","","","1.135","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212992","9.537","0.001","9.828","0.002","9.09","0.001","115.5","0.01","97.54","0.01","89.19","0.01","761.5","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","dihydropyrene 9a","2,7-di-tert-butyl-10b,10c-bis(trimethylsilylmethyl)-trans-10b,10c-dihydropyrene","","- C32 H48 Si2 -","- C32 H48 Si2 -","- C32 H48 Si2 -","1","0.5","","Sawada, Tsuyoshi; Wakabayashi, Masaki; Takeo, Hiromi; Miyazawa, Akira; Tashiro, Masashi; Thiemann, Thies; Mataka, Shuntaro","Novel, strained 10b,10c-dihydropyrenes bearing bulky TMSCH2 groups at the internal positions","Journal of the Chemical Society, Perkin Transactions 1","1999","","4","403","","10.1039/a809561b","","","1.54184","CuKα","","0.059","0.0454","","0.1265","0.1171","","","","1.032","1.051","1.051","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212993","20.586","0.018","13.153","0.006","19.186","0.008","90","","93.23","0.05","90","","5187","6","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","dihydropyrene 9b","2,7-di-tert-butyl-10b-methyl-10c-trimethylsilylmethyl-trans-10b, 10c-dihydropyrene","","- C29 H40 Si -","- C29 H40 Si -","- C232 H320 Si8 -","8","2","","Sawada, Tsuyoshi; Wakabayashi, Masaki; Takeo, Hiromi; Miyazawa, Akira; Tashiro, Masashi; Thiemann, Thies; Mataka, Shuntaro","Novel, strained 10b,10c-dihydropyrenes bearing bulky TMSCH2 groups at the internal positions","Journal of the Chemical Society, Perkin Transactions 1","1999","","4","403","","10.1039/a809561b","","","1.54184","CuKa","","0.3566","0.0917","","0.3669","0.2042","","","","1.002","1.271","1.271","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7212994","18.0967","0.0013","7.8886","0.0006","9.1507","0.0007","90","","111.838","0.002","90","","1212.59","0.16","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C2 H6 N O4 P Sn -","- C2 H8 N1.33333 O5.33333 P1.33333 Sn1.33333 -","- C12 H48 N8 O32 P8 Sn8 -","6","0.75","","Vaidhyanathan, R.; Natarajan, Srinivasan","New open-framework layered tin(II) phosphates intercalated with amines","Journal of Materials Chemistry","1999","9","8","1807","","10.1039/a809682a","","","0.71073","MoKα","","0.0325","0.0263","","0.0611","0.0588","","","","1.112","1.131","1.131","","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212995","18.1327","0.0013","7.8581","0.0006","9.3441","0.0007","90","","111.3","0.002","90","","1240.48","0.16","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C2 H6 N O4 P Sn -","- C2 H7.44 N1.33333 O6.10667 P1.33333 Sn1.33333 -","- C12 H44.64 N8 O36.64 P8 Sn8 -","6","0.75","","Vaidhyanathan, R.; Natarajan, Srinivasan","New open-framework layered tin(II) phosphates intercalated with amines","Journal of Materials Chemistry","1999","9","8","1807","","10.1039/a809682a","","","0.71073","MoKα","","0.0403","0.0394","","0.1094","0.1087","","","","1.277","1.292","1.292","","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212996","18.026","0.002","23.45","0.003","22.744","0.002","90","","90.299","0.009","90","","9614","1.8","293","2","173.15","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C104 H80 Cu4 N8 O20 S4 -","- C104 H72 Cu4 N8 O18 S4 -","- C416 H288 Cu16 N32 O72 S16 -","4","1","","Yoshida, Noboru; Oshio, Hiroki; Ito, Tasuku","Copper(II)-assisted self-assembly of bis-N,O-bidentate Schiff bases: new building blocks for a double-helical supramolecular motif","Journal of the Chemical Society, Perkin Transactions 2","1999","","5","975","","10.1039/a809743g","","","0.71073","MoKα","","0.1624","0.0667","","0.2381","0.1652","","","","1.021","1.171","1.171","","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212997","17.198","0.003","14.079","0.002","13.644","0.003","90","","112.801","0.011","90","","3045.5","1","293","2","293","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C53 H37 Cl3 Cu2 N4 O6 -","- C54 H36 Cl6 Cu2 N4 O6 -","- C108 H72 Cl12 Cu4 N8 O12 -","2","0.5","","Yoshida, Noboru; Oshio, Hiroki; Ito, Tasuku","Copper(II)-assisted self-assembly of bis-N,O-bidentate Schiff bases: new building blocks for a double-helical supramolecular motif","Journal of the Chemical Society, Perkin Transactions 2","1999","","5","975","","10.1039/a809743g","","","0.71073","MoKα","","0.0828","0.0548","","0.2027","0.1439","","","","1.07","1.094","1.094","","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7212998","11.727","0.004","10.915","0.004","12.109","0.004","90","","112.25","0.02","90","","1434.5","0.9","293.2","","293.2","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C32 H44 O8 -","- C32 H44 O8 -","- C64 H88 O16 -","2","0.5","","Takagi, Hideki; Hayashi, Takashi; Mizutani, Tadashi; Masuda, Hideki; Ogoshi, Hisanobu","Synthesis and structure of tetraols with convergent and divergent arrays of hydroxy groups","Journal of the Chemical Society, Perkin Transactions 1","1999","","13","1885","","10.1039/a809834d","","","0.7107","MoKα","","","0.036","","","0.052","","","","","1.95","1.95","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7212999","11.928","0.001","8.302","0.001","15.736","0.001","90","","103.34","0.01","90","","1516.2","0.3","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","8,9-di(methylsulfanyl)acenaphthyleno[1,2-b][1,4]dithiine","","- C16 H12 S4 -","- C16 H12 S4 -","- C64 H48 S16 -","4","1","","Bryce, Martin R.; Lay, Alexander K.; Chesney, Antony; Batsanov, Andrei S.; Howard, Judith A. K.; Buser, Urs; Gerson, Fabian; Merstetter, Pascal","The radical ions of acenaphtho[1,2-b][1,4]dithiine derivatives and acenaphtho[1,2-b][1,4]oxathiine: Solution EPR and ENDOR studies. The X-ray crystal structures of 8,9-bis(methylsulfanyl)acenaphtho[1,2-b][1,4]dithiine and its complexes with 7,7,8,8-tetracyano-p-quinodimethane (TCNQ), 2,5-dibromo-TCNQ and iodine","Journal of the Chemical Society, Perkin Transactions 2","1999","","4","755","","10.1039/a809872g","","","0.71073","MoKα","","0.0763","0.0466","","0.1048","0.0829","","","","1.106","1.134","1.134","","","","","has coordinates","180460","2020-10-21","18:00:00",""
"7213000","19.451","0.001","18.738","0.001","6.883","0.001","90","","90","","90","","2508.7","0.4","150","2","150","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","8,9-di(methylsulfanyl)acenaphthyleno[1,2-b][1,4]dithiine 7,7,8,8-tetracyano-p-quinodimethane (1:1)","","- C28 H16 N4 S4 -","- C28 H16 N4 S4 -","- C112 H64 N16 S16 -","4","0.5","","Bryce, Martin R.; Lay, Alexander K.; Chesney, Antony; Batsanov, Andrei S.; Howard, Judith A. K.; Buser, Urs; Gerson, Fabian; Merstetter, Pascal","The radical ions of acenaphtho[1,2-b][1,4]dithiine derivatives and acenaphtho[1,2-b][1,4]oxathiine: Solution EPR and ENDOR studies. The X-ray crystal structures of 8,9-bis(methylsulfanyl)acenaphtho[1,2-b][1,4]dithiine and its complexes with 7,7,8,8-tetracyano-p-quinodimethane (TCNQ), 2,5-dibromo-TCNQ and iodine","Journal of the Chemical Society, Perkin Transactions 2","1999","","4","755","","10.1039/a809872g","","","0.71073","MoKα","","0.0827","0.058","","0.1444","0.1275","","","","1.128","1.183","1.183","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213001","7.848","0.001","10.295","0.001","17.309","0.001","77.29","0.01","83.47","0.01","89.59","0.01","1355.1","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","8,9-di(methylsulfanyl)acenaphthyleno[1,2-b][1,4]dithiine 2,5-dibromo-7,7,8,8-tetracyano-p-quinodimethane (1:1)","","- C28 H14 Br2 N4 S4 -","- C28 H14 Br2 N4 S4 -","- C56 H28 Br4 N8 S8 -","2","1","","Bryce, Martin R.; Lay, Alexander K.; Chesney, Antony; Batsanov, Andrei S.; Howard, Judith A. K.; Buser, Urs; Gerson, Fabian; Merstetter, Pascal","The radical ions of acenaphtho[1,2-b][1,4]dithiine derivatives and acenaphtho[1,2-b][1,4]oxathiine: Solution EPR and ENDOR studies. The X-ray crystal structures of 8,9-bis(methylsulfanyl)acenaphtho[1,2-b][1,4]dithiine and its complexes with 7,7,8,8-tetracyano-p-quinodimethane (TCNQ), 2,5-dibromo-TCNQ and iodine","Journal of the Chemical Society, Perkin Transactions 2","1999","","4","755","","10.1039/a809872g","","","0.71073","MoKα","","0.054","0.0344","","0.0809","0.0671","","","","1.108","1.067","1.067","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213002","10.42","0.001","11.263","0.001","13.087","0.001","64.76","0.01","78.8","0.01","79.74","0.01","1354.9","0.2","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","8,9-di(methylsulfanyl)acenaphthyleno[1,2-b][1,4]dithiine bis(diiodine) triiodide","","- C16 H12 I7 S4 -","- C16 H12 I7 S4 -","- C32 H24 I14 S8 -","2","1","","Bryce, Martin R.; Lay, Alexander K.; Chesney, Antony; Batsanov, Andrei S.; Howard, Judith A. K.; Buser, Urs; Gerson, Fabian; Merstetter, Pascal","The radical ions of acenaphtho[1,2-b][1,4]dithiine derivatives and acenaphtho[1,2-b][1,4]oxathiine: Solution EPR and ENDOR studies. The X-ray crystal structures of 8,9-bis(methylsulfanyl)acenaphtho[1,2-b][1,4]dithiine and its complexes with 7,7,8,8-tetracyano-p-quinodimethane (TCNQ), 2,5-dibromo-TCNQ and iodine","Journal of the Chemical Society, Perkin Transactions 2","1999","","4","755","","10.1039/a809872g","","","0.71073","MoKα","","0.0569","0.0395","","0.0992","0.0881","","","","1.104","1.109","1.109","","","","","has coordinates,has disorder","180461","2020-10-21","18:00:00",""
"7213003","6.651","0.0006","10.7485","0.001","13.4022","0.0013","83.003","0.002","85.739","0.002","83.971","0.002","943.87","0.15","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H32 Co N2 O32 V12 -","- C8 H24 Co N2 O32 V12 -","- C8 H24 Co N2 O32 V12 -","1","0.5","","Wang, Xiqu; Liu, Lumei; Jacobson, Allan J.; Ross, Kent","Electrochemical-hydrothermal synthesis and structure of [N(CH3)4]2[Co(H2O)4V12O28]","Journal of Materials Chemistry","1999","9","4","859","","10.1039/a809999e","","","0.71073","MoKα","","0.1172","0.0668","","0.1741","0.1419","","","","1.021","1.035","1.035","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213004","6.135","0.004","8.107","0.004","16.981","0.009","79.98","0.03","79.68","0.03","81.88","0.04","812.9","0.8","295","","295","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H19 O4 S16 -","- C24 H18 O4 S16 -","- C24 H18 O4 S16 -","1","0.5","","Giffard, Michel; Riou, Amédée; Mabon, Gilles; Mercier, Nicolas; Molinié, Philippe; Nguyen, Thien Phap","Structural and electrical properties of bis(ethylenedithio)tetrathiafulvalenium hydrogen fumarate (2/1): a BEDT-TTF mixed-valency salt with a hydrogen-bonding organic anion","Journal of Materials Chemistry","1999","9","4","851","","10.1039/a810002k","","","0.71073","Mo-Kα","","0.091","0.064","","0.1","0.092","","","","2.032","1.865","1.865","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213005","17.216","0.005","10.832","0.003","6.247","0.002","90","","95.71","0.02","90","","1159.2","0.6","173","","173","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H30 N6 O4 -","- C24 H30 N6 O4 -","- C48 H60 N12 O8 -","2","0.5","","Ziessel, Raymond; Ulrich, Gilles; Lawson, Raphael C.; Echegoyen, Luis","Oligopyridine bis(nitronyl nitroxides): synthesis, structures, electrochemical, magnetic and electronic properties","Journal of Materials Chemistry","1999","9","7","1435","","10.1039/a810044f","","","1.54184","Cu-Kα","","0.05","0.04","","0.061","","0.06","","","0.999","","","1.113","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213006","16.334","0.005","10.316","0.003","11.99","0.003","90","","103.3","0.02","90","","1966.1","1","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H27 N5 O4 -","- C19 H27 N5 O4 -","- C76 H108 N20 O16 -","4","1","","Ziessel, Raymond; Ulrich, Gilles; Lawson, Raphael C.; Echegoyen, Luis","Oligopyridine bis(nitronyl nitroxides): synthesis, structures, electrochemical, magnetic and electronic properties","Journal of Materials Chemistry","1999","9","7","1435","","10.1039/a810044f","","","1.54184","Cu-Kα","","0.042","0.033","","0.047","","0.047","","","0.99","","","1.06","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213007","6.192","0.002","11.794","0.003","13.513","0.004","90","","93.74","0.02","90","","984.7","0.5","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H27 N5 O4 -","- C18 H24 N5.86 O4 -","- C36 H48 N11.72 O8 -","2","0.5","","Ziessel, Raymond; Ulrich, Gilles; Lawson, Raphael C.; Echegoyen, Luis","Oligopyridine bis(nitronyl nitroxides): synthesis, structures, electrochemical, magnetic and electronic properties","Journal of Materials Chemistry","1999","9","7","1435","","10.1039/a810044f","","","1.54184","Cu-Kα","","0.05","0.045","","0.078","","0.078","","","1.481","","","1.586","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213008","11.448","0.005","35.68","0.01","8.632","0.003","90","","90","","90","","3526","2","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C15 H9 N S8 -","- C15 H9 N S8 -","- C120 H72 N8 S64 -","8","1","","Xu, Wei; Zhang, Deqing; Li, Hongxiang; Zhu, Daoben","New electron donors: BEDT-TTF derivatives bearing a pyridine group; synthesis, crystal structure, electrochemical studies and the formation of charge transfer complexes","Journal of Materials Chemistry","1999","9","6","1245","","10.1039/a900063a","","","0.71069","MoKα","","0.1036","0.0646","","0.2756","0.1956","","","","1.004","1.101","1.101","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213009","4.881","0.001","9.764","0.001","11.582","0.001","70.542","0.008","88.603","0.008","85.52","0.008","518.86","0.13","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H17 N O4 S4 -","- C21 H17 N O4 S4 -","- C21 H17 N O4 S4 -","1","0.5","","Bueno, B.; Esteve, B.; Irurre, J.; Brillas, E.; Torrelles, X.; Rius, J.; Alvarez-Larena, A.; Piniella, J. F.; Alemán, C.; Juliá, L.","Methyl- and methoxy-substituted di[1,4]benzodithiio[2,3-b:2,3-e]pyridines as new electron donor compounds: synthesis, molecular structure, electrochemical properties, and EPR studies","Journal of the Chemical Society, Perkin Transactions 2","1999","","7","1503","","10.1039/a900148d","","","0.71069","MoKα","","0.0946","0.0444","","0.1155","0.1077","","","","1.071","1.239","1.239","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213010","8.1","0.001","12.52","0.003","18.733","0.003","90","","95.22","0.01","90","","1891.9","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","6-Aza-2,3,9,10-tetramethyl-5,7,12,14-tetrathiapentacene","","- C21 H17 N S4 -","- C21 H17 N S4 -","- C84 H68 N4 S16 -","4","1","","Bueno, B.; Esteve, B.; Irurre, J.; Brillas, E.; Torrelles, X.; Rius, J.; Alvarez-Larena, A.; Piniella, J. F.; Alemán, C.; Juliá, L.","Methyl- and methoxy-substituted di[1,4]benzodithiio[2,3-b:2,3-e]pyridines as new electron donor compounds: synthesis, molecular structure, electrochemical properties, and EPR studies","Journal of the Chemical Society, Perkin Transactions 2","1999","","7","1503","","10.1039/a900148d","","","0.71069","MoKα","","0.0689","0.0358","","0.0913","0.0875","","","","0.913","1.102","1.102","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213011","6.164","0.009","14.114","0.005","14.378","0.005","64.94","0.04","86.34","0.04","80.33","0.04","1117","1.8","180","2","180","2","","","","","","","","3","P 1","P 1","1","","","","- C52 H56 O10 -","- C52 H56 O10 -","- C52 H56 O10 -","1","1","","Painter, Gavin F.; Grove, Simon J. A.; Gilbert, Ian H.; Holmes, Andrew B.; Raithby, Paul R.; Hill, Malcolm L.; Hawkins, Phillip T.; Stephens, Leonard R.","General synthesis of 3-phosphorylated myo-inositol phospholipids and derivatives","Journal of the Chemical Society, Perkin Transactions 1","1999","","8","923","","10.1039/a900278b","","","0.71073","MoKα","","0.0736","0.0553","","","0.1078","0.1163","","","","","","1.012","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213012","13.322","0.005","6.274","0.002","13.281","0.005","90","","107.9","0.02","90","","1056.3","0.7","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C7 H9 N3 O6 S -","- C7 H9 N3 O6 S -","- C28 H36 N12 O24 S4 -","4","2","","Betts, Michael J.; Pritchard, Robin G.; Schofield, Anthony; Stoodley, Richard J.; Vohra, Shaheen","‘Hidden’ axial chirality as a stereodirecting element in reactions involving enol(ate) intermediates. Part 2.† Cyclisation reactions of methyl (4R)-3-(2-diazo-3-oxobutanoyl)-1,1-dioxo-1λ6,3- (and 1-oxo-1λ4,3-) thiazolidine-4-carboxylates","Journal of the Chemical Society, Perkin Transactions 1","1999","","8","1067","","10.1039/a900280d","","","0.71069","MoKα","","0.1352","0.0414","","","0.0953","0.125","","","","","","0.981","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213013","7.352","0.003","7.357","0.002","8.938","0.002","87.39","0.02","100.03","0.03","72.66","0.03","452","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","compound 3a","","","- C7 H10 Cl N3 O2 -","- C7 H10 Cl N3 O2 -","- C14 H20 Cl2 N6 O4 -","2","1","","Devillers, Ingrid; de Wergifosse, Bertrand; Bruneau, Marie-Pierre; Tinant, Bernard; Declercq, Jean-Paul; Touillaux, Roland; Rees, Jean-François; Marchand-Brynaert, Jacqueline","Synthesis, structural characterization and antioxidative properties of aminopyrazine and imidazolopyrazine derivatives","Journal of the Chemical Society, Perkin Transactions 2","1999","","7","1481","","10.1039/a900289h","","","0.71069","MoKa","","0.0989","0.0566","","0.1311","0.1204","","","","0.945","1.134","1.134","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213014","6.832","0.002","9.076","0.006","9.679","0.003","87.86","0.04","101.21","0.03","88.92","0.04","588.1","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","compound 3b","","","- C12 H13 N3 O3 -","- C12 H13 N3 O3 -","- C24 H26 N6 O6 -","2","1","","Devillers, Ingrid; de Wergifosse, Bertrand; Bruneau, Marie-Pierre; Tinant, Bernard; Declercq, Jean-Paul; Touillaux, Roland; Rees, Jean-François; Marchand-Brynaert, Jacqueline","Synthesis, structural characterization and antioxidative properties of aminopyrazine and imidazolopyrazine derivatives","Journal of the Chemical Society, Perkin Transactions 2","1999","","7","1481","","10.1039/a900289h","","","1.54178","CuKa","","0.0754","0.0561","","0.1533","0.1447","","","","1.002","1.137","1.137","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213015","12.022","0.004","8.616","0.002","13.244","0.004","90","","114.22","0.03","90","","1251.1","0.7","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","compoud 5b","","","- C13 H13 N3 O2 -","- C13 H13 N3 O2 -","- C52 H52 N12 O8 -","4","1","","Devillers, Ingrid; de Wergifosse, Bertrand; Bruneau, Marie-Pierre; Tinant, Bernard; Declercq, Jean-Paul; Touillaux, Roland; Rees, Jean-François; Marchand-Brynaert, Jacqueline","Synthesis, structural characterization and antioxidative properties of aminopyrazine and imidazolopyrazine derivatives","Journal of the Chemical Society, Perkin Transactions 2","1999","","7","1481","","10.1039/a900289h","","","0.71069","MoKa","","0.1642","0.0679","","0.1249","0.1054","","","","0.849","1.217","1.217","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213016","6.985","0.002","14.407","0.004","20.427","0.003","90","","93.7","0.02","90","","2051.3","0.9","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H18 F4 N5 O -","- C21 H18 F4 N5 O -","- C84 H72 F16 N20 O4 -","4","1","","Nakatsuji, Shin'ichi; Takai, Atsushi; Nishikawa, Kazuyoshi; Morimoto, Yukio; Yasuoka, Noritake; Suzuki, Kazuya; Enoki, Toshiaki; Anzai, Hiroyuki","CT complexes based on TEMPO radicals","Journal of Materials Chemistry","1999","9","8","1747","","10.1039/a900295b","","","1.5418","CuKα","","","0.059","","","0.047","","","","","3.05","3.05","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213017","12.47","0.004","17.279","0.002","9.599","0.003","90","","101.17","0.03","90","","2029.1","1","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H24 Cl2 N3 O4 -","- C18 H24 Cl2 N3 O4 -","- C72 H96 Cl8 N12 O16 -","4","1","","Nakatsuji, Shin'ichi; Takai, Atsushi; Nishikawa, Kazuyoshi; Morimoto, Yukio; Yasuoka, Noritake; Suzuki, Kazuya; Enoki, Toshiaki; Anzai, Hiroyuki","CT complexes based on TEMPO radicals","Journal of Materials Chemistry","1999","9","8","1747","","10.1039/a900295b","","","0.7107","MoKα","","","0.0543","","","0.0769","","","","","1.17","1.17","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213018","20.309","0.002","20.265","0.003","13.452","0.001","90","","103.987","0.008","90","","5372.2","1.1","296.2","","296.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H23 F4 N6 O -","- C24 H23 F4 N6 O -","- C192 H184 F32 N48 O8 -","8","1","","Nakatsuji, Shin'ichi; Takai, Atsushi; Nishikawa, Kazuyoshi; Morimoto, Yukio; Yasuoka, Noritake; Suzuki, Kazuya; Enoki, Toshiaki; Anzai, Hiroyuki","CT complexes based on TEMPO radicals","Journal of Materials Chemistry","1999","9","8","1747","","10.1039/a900295b","","","1.5418","CuKα","","","0.0975","","","0.1514","","","","","3.152","3.152","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213019","7.3605","0.0001","13.2811","0.0002","12.3457","0.0002","90","","90.496","0.001","90","","1206.82","0.03","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C10 H16 Si2 -","- C10 H16 Si2 -","- C40 H64 Si8 -","4","1","","Haberhauer, Gebhard; Rominger, Frank; Gleiter, Rolf","1,1,2,2-Tetramethyl-1,2-disilacycloocta-3,7-diyne — structure and bonding properties of a highly strained cyclic diyne","Journal of the Chemical Society, Perkin Transactions 2","1999","","5","947","","10.1039/a900318e","","","0.71073","MoKα","","0.0369","0.0285","","","0.0746","0.078","","","","","","1.04","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213020","32.927","0.005","11.611","0.004","11.161","0.005","90","","108.51","0.02","90","","4046","2","233","","233","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H25 I N2 O2 S -","- C20 H25 I N2 O2 S -","- C160 H200 I8 N16 O16 S8 -","8","1","","Callaghan, Owen; Lampard, Christopher; Kennedy, Alan R.; Murphy, John A.","A novel total synthesis of (±)-aspidospermidine","Journal of the Chemical Society, Perkin Transactions 1","1999","","8","995","","10.1039/a900335e","","","0.71069","MoKalpha","","","0.0587","","","0.0603","","","","","1.538","1.538","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213021","10.2919","0.0008","12.0062","0.0009","14.139","0.001","88.543","0.001","76.608","0.001","77.637","0.001","1659.7","0.2","120","","120","","","","","","","","","5","P 1","P 1","1","","","","- C38 H42 Mn N3 O2 -","- C38 H42 Mn N3 O2 -","- C76 H84 Mn2 N6 O4 -","2","2","","Svenstrup, Niels; Bøgevig, Anders; Hazell, Rita G.; Jørgensen, Karl Anker","Enantioselective α-amination of ketones mediated by chiral nitridomanganese(V) complexes using ammonia as the terminal nitrogen source","Journal of the Chemical Society, Perkin Transactions 1","1999","","11","1559","","10.1039/a900358d","","","0.71073","MoKα","","","0.052","","","0.057","","","","","2.79","2.79","","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7213022","9.9795","0.0004","13.4234","0.0006","14.6685","0.0006","63.144","0.001","78.596","0.001","71.541","0.001","1659.37","0.12","122","2","122","2","","","","","","","","5","P 1","P 1","1","","","","- C36 H52 Mn N3 O2 -","- C36 H52 Mn N3 O2 -","- C72 H104 Mn2 N6 O4 -","2","2","","Svenstrup, Niels; Bøgevig, Anders; Hazell, Rita G.; Jørgensen, Karl Anker","Enantioselective α-amination of ketones mediated by chiral nitridomanganese(V) complexes using ammonia as the terminal nitrogen source","Journal of the Chemical Society, Perkin Transactions 1","1999","","11","1559","","10.1039/a900358d","","","0.71073","MoKα","","0.0681","0.0523","","","0.1191","0.1325","","","","","","1.101","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213023","12.2876","0.0005","9.1876","0.0004","24.399","0.001","90","","90.518","0.001","90","","2754.4","0.2","120","","120","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C28 H34 Br2 Mn N3 O2 -","- C28 H34 Br2 Mn N3 O2 -","- C112 H136 Br8 Mn4 N12 O8 -","4","2","","Svenstrup, Niels; Bøgevig, Anders; Hazell, Rita G.; Jørgensen, Karl Anker","Enantioselective α-amination of ketones mediated by chiral nitridomanganese(V) complexes using ammonia as the terminal nitrogen source","Journal of the Chemical Society, Perkin Transactions 1","1999","","11","1559","","10.1039/a900358d","","","0.71073","MoKα","","","0.06","","","0.068","","","","","0.745","0.745","","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7213024","12.749","0.002","16.163","0.002","10.624","0.002","90","","90","","90","","2189.2","0.6","296.2","","296.2","","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C25 H27 N O6 -","- C25 H27 N O6 -","- C100 H108 N4 O24 -","4","1","","Ikeda, Masazumi; Hamada, Masahiro; Yamashita, Takashi; Matsui, Katsuaki; Sato, Tatsunori; Ishibashi, Hiroyuki","Stereoselective synthesis of (3R*,3aS*,7aS*)-3-aryloctahydroindol-2-ones using radical cyclisation: a formal synthesis of (±)-pancracine","Journal of the Chemical Society, Perkin Transactions 1","1999","","14","1949","","10.1039/a900467j","","","1.5418","CuKα","","0.0369","0.0369","","","0.0584","0.0584","","","","","","1.385","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213025","10.716","0.002","12.652","0.002","12.832","0.004","89.17","0.02","66.16","0.02","66.034","0.011","1430.6","0.7","183","2","183","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H42 In N3 O3 S3 -","- C21 H42 In N3 O3 S3 -","- C42 H84 In2 N6 O6 S6 -","2","1","","Horley, Graeme A.; O'Brien, Paul; Park, Jin-Ho; White, Andrew J. P.; Williams, David J.","Deposition of tetragonal β-In2S3 thin films from tris(N,N-diisopropylmonothiocarbamato)indium(III), In(SOCNiPr2)3, by low pressure metal-organic chemical vapour deposition","Journal of Materials Chemistry","1999","9","6","1289","","10.1039/a900503j","","","0.71073","MoKα","","0.0563","0.0416","","0.1024","0.0944","","","","1.035","1.065","1.065","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213026","13.741","0.001","7.2","0.0007","24.483","0.002","90","","109.322","0.005","90","","2285.8","0.3","296.2","","296.2","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C9 H14 Cl N3 O3 -","- C9 H13 Cl N3 O3.5 -","- C72 H104 Cl8 N24 O28 -","8","1","","Momotake, Atsuya; Togo, Hideo; Yokoyama, Masataka","Convenient synthesis of C-aza-2,3-dideoxynucleosides","Journal of the Chemical Society, Perkin Transactions 1","1999","","9","1193","","10.1039/a900689c","","","1.5418","CuKα","","0.0672","0.0672","","","0.0953","0.0953","","","","","","4.318","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213027","4.911","0.004","16.391","0.005","9.146","0.003","90","","97.44","0.04","90","","730","0.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","3-methyl-6-(2-chloroethyl)-8-(2-deoxy-beta-D-ribofuranosyl)-1,2,4,- triazolo[1,5-c]pyrimidin-5-one","","- C13 H17 Cl N4 O4 -","- C13 H17 Cl N4 O4 -","- C26 H34 Cl2 N8 O8 -","2","1","","Loakes, David; Brown, Daniel M.; Salisbury, Stephen A.","A Dimroth rearrangement of pyrimidine nucleosides","Journal of the Chemical Society, Perkin Transactions 1","1999","","10","1333","","10.1039/a900748b","","","0.71069","MoKα","","0.0431","0.037","","0.1028","0.0966","","","","0.937","0.934","0.934","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213028","7.8039","0.0003","16.9741","0.0004","12.6159","0.0006","90","","99.222","0.002","90","","1649.55","0.11","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1-(4-Amino-5,6-dichloro-pyrimidin-2-yl)-4-(pyridin-4-yl)- pyridinium chloride","","- C14 H14 Cl3 N5 O2 -","- C14 H14 Cl3 N5 O2 -","- C56 H56 Cl12 N20 O8 -","4","1","","Schmidt, Andreas; Nieger, Martin","New vinylogous mesomeric betaines: synthesis and tautomerism of pyridiniopyrimidine appended 5-iminopenta-1,3-dienolates","Journal of the Chemical Society, Perkin Transactions 1","1999","","10","1325","","10.1039/a900792j","","","0.71073","MoKα","","0.0452","0.0399","","","0.1052","0.1086","","","","","","1.062","","","","has coordinates,has disorder","301864","2025-08-22","15:14:30",""
"7213029","9.7511","0.0007","7.3223","0.0012","20.122","0.005","90","","101.377","0.012","90","","1408.5","0.4","140","2","140","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C17 H15 N5 -","- C17 H15 N5 -","- C68 H60 N20 -","4","1","","Crabb, Derek L.; McCullough, Kevin J.; Preston, Peter N.; Rosair, Georgina M.; Bishop, Brian C.; Wright, Stanley H. B.; Clegg, William; Coles, Simon","Preparation of [1,2,4]triazoloquinazolinium betaines and molecular rearrangements of putative [1,2,4]triazolo[4,3-a][1,3,5]triazinium betaines","Journal of the Chemical Society, Perkin Transactions 1","1999","","11","1517","","10.1039/a900941h","","","0.71069","MoKα","","0.0617","0.0437","","0.1333","0.1031","","","","0.976","1.077","1.077","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213030","8.023","0.002","11.419","0.002","11.582","0.002","91.53","0.03","97.3","0.03","105.76","0.03","1010.8","0.4","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","","","- C19 H25 N11 -","- C19 H25 N11 -","- C38 H50 N22 -","2","1","","Crabb, Derek L.; McCullough, Kevin J.; Preston, Peter N.; Rosair, Georgina M.; Bishop, Brian C.; Wright, Stanley H. B.; Clegg, William; Coles, Simon","Preparation of [1,2,4]triazoloquinazolinium betaines and molecular rearrangements of putative [1,2,4]triazolo[4,3-a][1,3,5]triazinium betaines","Journal of the Chemical Society, Perkin Transactions 1","1999","","11","1517","","10.1039/a900941h","","","0.71073","MoKα","","0.0634","0.0496","","0.1353","0.1227","","","","0.942","1.088","1.088","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213031","9.576","0.007","12.716","0.009","13.076","0.009","78.89","0.02","76.29","0.02","78.57","0.02","1498.3","1.8","160","2","160","2","","","","","","","","4","P -1","-P 1","2","","","","- C27 H28 Cl3 N12 -","- C27 H28 Cl3 N12 -","- C54 H56 Cl6 N24 -","2","1","","Crabb, Derek L.; McCullough, Kevin J.; Preston, Peter N.; Rosair, Georgina M.; Bishop, Brian C.; Wright, Stanley H. B.; Clegg, William; Coles, Simon","Preparation of [1,2,4]triazoloquinazolinium betaines and molecular rearrangements of putative [1,2,4]triazolo[4,3-a][1,3,5]triazinium betaines","Journal of the Chemical Society, Perkin Transactions 1","1999","","11","1517","","10.1039/a900941h","","","0.6879","synchrotron","","0.0812","0.0735","","0.2262","0.2136","","","","0.999","1.043","1.043","","","","","has coordinates,has disorder","180461","2020-10-21","18:00:00",""
"7213032","9.766","0.001","11.568","0.001","9.367","0.001","112.21","0.01","117.65","0.02","75.36","0.02","864","0.2","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C19 H24 O6 -","- C19 H24 O6 -","- C38 H48 O12 -","2","1","","Fujita, Morifumi; Lainé, Dramane; Ley, Steven V.","Dispiroketals in synthesis. Part 25.1 Further reactions of dispiroketal protected glycolate to afford optically active 1,2,3,4-tetraols","Journal of the Chemical Society, Perkin Transactions 1","1999","","12","1647","","10.1039/a900951e","","","0.71069","MoKα","","0.0582","0.0527","","0.1252","0.1204","","","","1.203","1.216","1.216","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213033","5.44","0.001","5.413","0.001","23.74","0.005","90","","90","","90","","699.1","0.2","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- Bi2 O9 W2 -","- Bi2 O9 W2 -","- Bi8 O36 W8 -","4","1","","Champarnaud-Mesjard, Jean-Claude; Frit, Bernard; Watanabe, Akiteru","Crystal structure of Bi2W2O9, the n=2 member of the homologous series (Bi2O2)BVInO3n+1 of cation-deficient Aurivillius phases","Journal of Materials Chemistry","1999","9","6","1319","","10.1039/a900992b","","","0.71073","MoKα","","0.0696","0.0458","","","0.0925","0.1002","","","","","","1.037","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213034","5.939","0.004","14.95","0.007","11.748","0.007","90","","91.14","0.06","90","","1042.9","1.1","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H28 O4 S -","- C24 H28 O4 S -","- C48 H56 O8 S2 -","2","1","","Lam, Hon Wai; Cooke, Paul A.; Pattenden, Gerald; Bandaranayake, Wickramasinghe M.; Wickramasinghe, Wasantha A.","Structure and total synthesis of benzylthiocrellidone, a novel dimedone-based vinyl sulfide from the sponge Crella spinulata","Journal of the Chemical Society, Perkin Transactions 1","1999","","8","847","","10.1039/a901323g","","","0.71073","MoKα","","0.1605","0.0988","","","0.1951","0.2436","","","","","","1.195","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213035","19.028","0.004","19.028","0.004","7.014","0.003","90","","90","","90","","2539.5","1.3","293","2","293","2","","","","","","","","4","P -4 21 c","P -4 2n","114","","","","- C12 H11 N5 O -","- C12 H11 N5 O -","- C96 H88 N40 O8 -","8","1","","Booth, Brian L.; Costa, Flora A. T.; Mahmood, Zahid; Pritchard, Robin G.; Proença, M. Fernanda","Synthesis of (Z )-N-(2-amino-1,2-dicyanovinyl)formamide O-alkyloximes and a study of their cyclization in the presence of base","Journal of the Chemical Society, Perkin Transactions 1","1999","","13","1853","","10.1039/a901332f","","","0.71069","MoKα","","0.2003","0.0468","","","0.1282","0.1869","","","","","","1.007","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213036","8.3838","0.001","6.638","0.001","10.58","0.002","90","","93.35","0.02","90","","587.79","0.16","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H11 N5 O -","- C12 H11 N5 O -","- C24 H22 N10 O2 -","2","1","","Booth, Brian L.; Costa, Flora A. T.; Mahmood, Zahid; Pritchard, Robin G.; Proença, M. Fernanda","Synthesis of (Z )-N-(2-amino-1,2-dicyanovinyl)formamide O-alkyloximes and a study of their cyclization in the presence of base","Journal of the Chemical Society, Perkin Transactions 1","1999","","13","1853","","10.1039/a901332f","","","0.71069","MoKα","","0.0434","0.0343","","","0.1057","0.1151","","","","","","0.964","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213037","8.767","0.004","24.309","0.006","12.476","0.004","90","","110.44","0.03","90","","2491.4","1.6","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H17 F N2 -","- C14 H17 F N2 -","- C112 H136 F8 N16 -","8","2","","Kao, Kuo-Hsi; Sheu, Ren-Shyang; Chen, Yuh-Shih; Lin, Wen-Wei; Liu, Ju-Tsung; Yao, Ching-Fa","Face selectivity in the reactions of Grignard reagents with 5-substituted-2-dicyanomethyleneadamantanes","Journal of the Chemical Society, Perkin Transactions 1","1999","","16","2383","","10.1039/a901484e","","","0.7093","MolybdenumKα","","0.295","0.067","","0.237","0.066","","","","","0.56","0.56","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213038","7.5393","0.0009","9.1199","0.001","23.597","0.005","90","","95.474","0.013","90","","1615.1","0.4","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H21 F N2 -","- C20 H21 F N2 -","- C80 H84 F4 N8 -","4","1","","Kao, Kuo-Hsi; Sheu, Ren-Shyang; Chen, Yuh-Shih; Lin, Wen-Wei; Liu, Ju-Tsung; Yao, Ching-Fa","Face selectivity in the reactions of Grignard reagents with 5-substituted-2-dicyanomethyleneadamantanes","Journal of the Chemical Society, Perkin Transactions 1","1999","","16","2383","","10.1039/a901484e","","","0.7093","MolybdenumKα","","0.079","0.052","","0.067","0.056","","","","","1.83","1.83","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213039","6.79","0.001","7.614","0.002","12.02","0.002","93.73","0.03","99.86","0.03","115.41","0.03","546.3","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H16 O2 -","- C14 H16 O2 -","- C28 H32 O4 -","2","1","","Chow, Tahsin J.; Hon, Yung-Son; Jen, Chung-Chi; Chern, Jyh-Haur; Lin, Kuan-Jiuh","Chemistry of cage-shaped hydrocarbons. Ring transformations on a tricyclo[5.2.1.0 4,10]decane system","Journal of the Chemical Society, Perkin Transactions 1","1999","","13","1847","","10.1039/a901536a","","","0.71069","MoKα","","0.0593","0.0403","","0.1396","0.1216","","","","0.777","0.815","0.815","","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213040","5.076","0.002","13.123","0.016","15.19","0.005","71.9","0.07","81.91","0.04","80.04","0.07","943.2","1.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-Propyl-4-nitroaniline","","- C9 H12 N2 O2 -","- C9 H12 N2 O2 -","- C36 H48 N8 O8 -","4","2","","Gangopadhyay, P.; Venugopal Rao, S.; Narayana Rao, D.; Radhakrishnan, T. P.","N-Alkyl-p-nitroanilines: impact of alkyl chain length on crystal structures and optical SHG","Journal of Materials Chemistry","1999","9","8","1699","","10.1039/a901591d","","","0.71073","MoKα","","0.0769","0.0405","","","0.1564","0.2487","","","","","","0.914","","","","has coordinates","301864","2025-08-22","15:14:30",""
"7213041","7.468","","15.348","0.018","18.528","","90","0.05","90","","90","0.01","2124","2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-Butyl-4-nitroaniline","","- C10 H14 N2 O2 -","- C10 H14 N2 O2 -","- C80 H112 N16 O16 -","8","2","","Gangopadhyay, P.; Venugopal Rao, S.; Narayana Rao, D.; Radhakrishnan, T. P.","N-Alkyl-p-nitroanilines: impact of alkyl chain length on crystal structures and optical SHG","Journal of Materials Chemistry","1999","9","8","1699","","10.1039/a901591d","","","0.71073","MoKα","","0.1394","0.0551","","","0.1232","0.1778","","","","","","1.046","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213042","6.192","0.003","15.61","0.07","11.851","0.006","90","0.13","97.52","0.04","90","0.13","1136","5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","N-Pentyl-4-nitroaniline","","- C11 H16 N2 O2 -","- C11 H16 N2 O2 -","- C44 H64 N8 O8 -","4","1","","Gangopadhyay, P.; Venugopal Rao, S.; Narayana Rao, D.; Radhakrishnan, T. P.","N-Alkyl-p-nitroanilines: impact of alkyl chain length on crystal structures and optical SHG","Journal of Materials Chemistry","1999","9","8","1699","","10.1039/a901591d","","","0.71073","MoKα","","0.0753","0.046","","","0.1338","0.1627","","","","","","1.259","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213043","5.2702","0.0015","5.2674","0.0007","14.231","0.0011","90","","90","","90","","395.06","0.13","297","2","297","2","","","","","","","","5","I 2 2 2","I 2 2","23","","","","- C H Mo0.5 N0.5 O1.5 -","- C H Mo0.5 N0.5 O1.5 -","- C8 H8 Mo4 N4 O12 -","8","1","","Xu, Yan; Lu, Jianjiang; Goh, Ngoh K.","Hydrothermal assembly and crystal structures of three novel open frameworks based on molybdenum(vi) oxides","Journal of Materials Chemistry","1999","9","7","1599","","10.1039/a901592b","","","0.71073","MoKα","","0.0179","0.0169","","0.0433","0.0414","","","","1.194","1.201","1.201","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213044","5.568","0.002","6.829","0.002","9.246","0.0012","100.716","0.012","101.521","0.015","112.5","0.03","304.6","0.17","297","2","297","2","","","","","","","","6","P -1","-P 1","2","","","","- C2 H5 Cu Mo N O4 -","- C2 H5 Cu Mo N O4 -","- C4 H10 Cu2 Mo2 N2 O8 -","2","1","","Xu, Yan; Lu, Jianjiang; Goh, Ngoh K.","Hydrothermal assembly and crystal structures of three novel open frameworks based on molybdenum(vi) oxides","Journal of Materials Chemistry","1999","9","7","1599","","10.1039/a901592b","","","0.71073","MoKα","","0.0324","0.0254","","0.0606","0.0532","","","","1.067","1.089","1.089","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213045","5.358","0.006","5.574","0.015","7.632","0.006","103.74","0.15","106.25","0.09","97.37","0.23","207.9","0.7","297","2","297","2","","","","","","","","4","P -1","-P 1","2","","","","- Cu1.5 H Mo O5 -","- Cu1.5 H Mo O5 -","- Cu3 H2 Mo2 O10 -","2","1","","Xu, Yan; Lu, Jianjiang; Goh, Ngoh K.","Hydrothermal assembly and crystal structures of three novel open frameworks based on molybdenum(vi) oxides","Journal of Materials Chemistry","1999","9","7","1599","","10.1039/a901592b","","","0.71073","MoKα","","0.0295","0.025","","0.0721","0.0645","","","","1.067","1.08","1.08","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213046","16.008","0.003","15.932","0.003","9.647","0.002","90","","90","","90","","2460.4","0.8","293","2","293","2","","","","","","","synthesized at Adam Mickiewicz University","4","P b c a","-P 2ac 2ab","61","5-(N-piperidine)valeric acid dihydrate","","","- C10 H23 N O4 -","- C10 H23 N O4 -","- C80 H184 N8 O32 -","8","1","","Dega-Szafran, Zofia; Katrusiak, Andrzej; Szafran, Mirosław","Conformations of, and NHO hydrogen bond in, piperidine-1-valeric acid and its dihydrate","Journal of the Chemical Society, Perkin Transactions 2","1999","","9","1967","","10.1039/a901635j","","","1.54178","CuKα","","0.0873","0.0612","","0.207","0.1973","","","","1.1","0.894","0.894","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213047","9.2079","0.001","10.2328","0.001","10.764","0.002","105.59","0.015","99.435","0.013","91.538","0.011","961","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H18 N4 S -","- C21 H18 N4 S -","- C42 H36 N8 S2 -","2","1","","Butler, Richard N.; Cloonan, Martin O.; McArdle, P.; Cunningham, D.","1,2,3-Thiadiazol-3-ium-3-methanide (ylide) 1,3-dipoles: cycloaddition–rearrangement sequences leading to substituted 1-(2-vinylthioethenyl)pyrazole systems: azolium 1,3-dipoles","Journal of the Chemical Society, Perkin Transactions 1","1999","","11","1415","","10.1039/a901727e","","","0.71069","MoKα","","0.081","0.0392","","","0.1055","0.1173","","","","","","1.031","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213048","10.605","0.002","11.781","0.002","12.306","0.003","97.974","0.015","105.989","0.016","111.055","0.012","1330","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H24 N2 O8 S -","- C27 H24 N2 O8 S -","- C54 H48 N4 O16 S2 -","2","1","","Butler, Richard N.; Cloonan, Martin O.; McArdle, P.; Cunningham, D.","1,2,3-Thiadiazol-3-ium-3-methanide (ylide) 1,3-dipoles: cycloaddition–rearrangement sequences leading to substituted 1-(2-vinylthioethenyl)pyrazole systems: azolium 1,3-dipoles","Journal of the Chemical Society, Perkin Transactions 1","1999","","11","1415","","10.1039/a901727e","","","0.71069","MoKα","","0.0832","0.0725","","","0.2244","0.2348","","","","","","1.089","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213049","18.856","0.003","13.736","0.004","12.722","0.002","90","","90.156","0.01","90","","3295.1","1.2","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H25 Cu3 Mo N6 O S4 -","- C26 H25 Cu3 Mo N6 O S4 -","- C104 H100 Cu12 Mo4 N24 O4 S16 -","4","1","","Hou, Hongwei; Ghee Ang, How; Gek Ang, Siau; Fan, Yaoting; Low, Michael K. M.; Ji, Wei; Wang Lee, Yiew","Synthesis, crystal structure and large third-order nonlinear optical properties of two novel nest-shaped clusters [MOS3Cu3(SCN)(Py)5] (M=Mo, W)","Physical Chemistry Chemical Physics","1999","1","13","3145","","10.1039/a901789e","","","0.71073","MoKα","","0.0554","0.0321","","","0.0713","0.0869","","","","","","0.839","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213050","24.645","0.005","9.058","0.002","19.58","0.004","90","","112.52","0.03","90","","4037.6","1.7","120","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","5,17-Diphenyl-25,26,27,28-tetrapropoxy-calixarene","","- C52 H56 O4 -","- C52 H56 O4 -","- C208 H224 O16 -","4","0.5","","Larsen, Mogens; Krebs, Frederik C.; Harrit, Niels; Jørgensen, Mikkel","Synthesis and conformational studies of a series of 5,17-bis-aryl-25,26,27,28-tetrapropoxycalix[4]arenes: the influence of π–π interactions on the molecular structure","Journal of the Chemical Society, Perkin Transactions 2","1999","","8","1749","","10.1039/a901881f","","","0.71073","MoKα","","0.159","0.073","","0.208","0.1543","","","","1.061","1.108","1.108","","","","","has coordinates,has disorder","301864","2025-08-22","15:14:31",""
"7213051","30.89","0.006","9.59","0.002","18.151","0.004","90","","123.02","0.03","90","","4508","2","120","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","5,17-Bis(3-bromophenyl)-25,26,27,28-tetrapropoxycalixarene","","- C52 H54 Br2 O4 -","- C52 H54 Br2 O4 -","- C208 H216 Br8 O16 -","4","0.5","","Larsen, Mogens; Krebs, Frederik C.; Harrit, Niels; Jørgensen, Mikkel","Synthesis and conformational studies of a series of 5,17-bis-aryl-25,26,27,28-tetrapropoxycalix[4]arenes: the influence of π–π interactions on the molecular structure","Journal of the Chemical Society, Perkin Transactions 2","1999","","8","1749","","10.1039/a901881f","","","0.71073","MoKα","","0.076","0.0512","","0.1431","0.1234","","","","1.023","1.039","1.039","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213052","10.854","0.002","12.946","0.003","19.085","0.004","109.39","0.03","98.08","0.03","99.64","0.03","2437.8","1.1","120","2","293","2","","","","","","","","4","P -1","-P 1","2","","5,17-bis(1-naphthyl)-25,26,27,28-tetrapropoxycalixarene","","- C62 H63 N O4 -","- C61 H61.5 N0.5 O4 -","- C122 H123 N O8 -","2","1","","Larsen, Mogens; Krebs, Frederik C.; Harrit, Niels; Jørgensen, Mikkel","Synthesis and conformational studies of a series of 5,17-bis-aryl-25,26,27,28-tetrapropoxycalix[4]arenes: the influence of π‒π interactions on the molecular structure","Journal of the Chemical Society, Perkin Transactions 2","1999","","8","1749","","10.1039/a901881f","","","0.71073","MoKα","","0.0754","0.0512","","0.1431","0.1252","","","","1.029","1.063","1.063","","","","","has coordinates,has disorder","180461","2020-10-21","18:00:00",""
"7213053","13.047","0.003","14.178","0.003","15.207","0.003","115.31","0.03","96.69","0.03","95.82","0.03","2489.6","1.2","120","2","293","2","","","","","","","","4","P -1","-P 1","2","","5,17-Bis(9H-Carbazol-9-yl)-25,26,27,28-tetrapropoxycalixarene","","- C64 H62 N2 O4 -","- C64 H62 N2 O4 -","- C128 H124 N4 O8 -","2","1","","Larsen, Mogens; Krebs, Frederik C.; Harrit, Niels; Jørgensen, Mikkel","Synthesis and conformational studies of a series of 5,17-bis-aryl-25,26,27,28-tetrapropoxycalix[4]arenes: the influence of π–π interactions on the molecular structure","Journal of the Chemical Society, Perkin Transactions 2","1999","","8","1749","","10.1039/a901881f","","","0.71073","MoKα","","0.0931","0.0486","","0.1285","0.106","","","","1.042","1.085","1.085","","","","","has coordinates,has disorder","301864","2025-08-22","15:14:31",""
"7213054","8.2588","0.0002","13.6878","0.0001","24.1712","0.0004","90","","96.55","0.001","90","","2714.59","0.08","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H38 N4 O6 -","- C26 H38 N4 O6 -","- C104 H152 N16 O24 -","4","2","","Efskind, Jon; Rømming, Christian; Undheim, Kjell","Ru(II)-Catalysis in preparation of sterically congested and stereochemically homogeneous heterospiranes","Journal of the Chemical Society, Perkin Transactions 1","1999","","12","1677","","10.1039/a901913h","","","0.71073","MoKα","","0.131","0.0802","","0.2912","0.2187","","","","1.151","1.163","1.163","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213055","7.2499","0.0008","8.1244","0.0009","8.6529","0.0009","73.472","0.002","80.085","0.002","85.077","0.002","480.94","0.09","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- H12 N2 O10 P2 V -","- N2 O10 P2 V -","- N4 O20 P4 V2 -","2","2","","Liu, Lumei; Wang, Xiqu; Bontchev, Ranko; Ross, Kent; Jacobson, Allan J.","Influence of reaction conditions on the electrochemical-hydrothermal synthesis of two ammonium vanadium phosphates: (NH4)2VO(HPO4)2·H2O and (NH4)2VO(V0.88P1.12O7)","Journal of Materials Chemistry","1999","9","7","1585","","10.1039/a901956a","","","0.71073","MoKα","","0.1001","0.0797","","0.2045","0.1937","","","","0.995","1.096","1.096","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213056","6.006","0.004","9.517","0.004","10.396","0.005","78.99","0.03","73.84","0.05","85.86","0.05","560.1","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C9 H8 N2 O8 -","- C9 H8 N2 O8 -","- C18 H16 N4 O16 -","2","1","","Senthil Kumar, V. S.; Kuduva, Srinivasan S.; Desiraju, Gautam R.","Pseudopolymorphs of 3,5-dinitrosalicylic acid","Journal of the Chemical Society, Perkin Transactions 2","1999","","6","1069","","10.1039/a902134e","","","0.71073","MoKα","","0.1331","0.0578","","","0.1469","0.1766","","","","","","0.991","","","","has coordinates","288183","2023-12-08","14:43:01",""
"7213057","6.6852","0.0008","9.7347","0.0018","10.5534","0.0018","79.468","0.017","80.152","0.014","82.99","0.012","662.35","0.19","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H12 N2 O9 -","- C11 H12 N2 O9 -","- C22 H24 N4 O18 -","2","1","","Senthil Kumar, V. S.; Kuduva, Srinivasan S.; Desiraju, Gautam R.","Pseudopolymorphs of 3,5-dinitrosalicylic acid","Journal of the Chemical Society, Perkin Transactions 2","1999","","6","1069","","10.1039/a902134e","","","0.71073","MoKα","","0.1128","0.0568","","","0.1368","0.1541","","","","","","1.03","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213058","9.149","0.015","11.912","0.003","13.318","0.004","111.22","0.03","90.13","0.06","101.12","0.04","1323","2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H12 N2 O9 -","- C11 H11.25 N2 O9 -","- C44 H45 N8 O36 -","4","2","","Senthil Kumar, V. S.; Kuduva, Srinivasan S.; Desiraju, Gautam R.","Pseudopolymorphs of 3,5-dinitrosalicylic acid","Journal of the Chemical Society, Perkin Transactions 2","1999","","6","1069","","10.1039/a902134e","","","0.71073","MoKα","","0.1169","0.063","","","0.1642","0.1883","","","","","","1.049","","","","has coordinates","288183","2023-12-08","14:43:01",""
"7213059","11.3053","0.001","6.0266","0.0005","16.9126","0.0002","90","","97.921","0.009","90","","1141.3","0.14","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H4 N2 O8 -","- C9.001 H4 N2 O8 -","- C36.004 H16 N8 O32 -","4","1","","Senthil Kumar, V. S.; Kuduva, Srinivasan S.; Desiraju, Gautam R.","Pseudopolymorphs of 3,5-dinitrosalicylic acid","Journal of the Chemical Society, Perkin Transactions 2","1999","","6","1069","","10.1039/a902134e","","","0.71073","MoKα","","0.1348","0.0704","","","0.2114","0.2424","","","","","","1.045","","","","has coordinates","288183","2023-12-08","14:43:01",""
"7213060","16.487","0.004","5.8204","0.0016","13.462","0.004","90","","132.58","0.02","90","","951.2","0.5","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C7 H6 N2 O8 -","- C7 H6 N2 O8 -","- C28 H24 N8 O32 -","4","1","","Senthil Kumar, V. S.; Kuduva, Srinivasan S.; Desiraju, Gautam R.","Pseudopolymorphs of 3,5-dinitrosalicylic acid","Journal of the Chemical Society, Perkin Transactions 2","1999","","6","1069","","10.1039/a902134e","","","0.71073","MoKα","","0.1226","0.0592","","","0.1143","0.1296","","","","","","1.012","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213061","10.29","0.004","5.972","0.003","22.928","0.007","90","","90","","90","","1409","1","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C11 H14 N2 O8 -","- C11 H14 N2 O8 -","- C44 H56 N8 O32 -","4","1","","Senthil Kumar, V. S.; Kuduva, Srinivasan S.; Desiraju, Gautam R.","Pseudopolymorphs of 3,5-dinitrosalicylic acid","Journal of the Chemical Society, Perkin Transactions 2","1999","","6","1069","","10.1039/a902134e","","","0.71073","MoKα","","0.0923","0.0499","","","0.1191","0.136","","","","","","0.984","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213062","7.4889","0.0012","8.9188","0.0012","16.948","0.002","90","","101.972","0.017","90","","1107.4","0.3","213","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H34 N2 O4 S -","- C22 H34 N2 O4 S -","- C44 H68 N4 O8 S2 -","2","1","","Alves, M. José; Bickley, Jamie F.; Gilchrist, Thomas L.","Diastereoselectivity in the addition and cycloaddition reactions of a chiral ester of 2H-azirine-3-carboxylic acid","Journal of the Chemical Society, Perkin Transactions 1","1999","","11","1399","","10.1039/a902182e","","","0.71073","MoKα","","0.0616","0.0524","","","0.1246","0.1289","","","","","","0.978","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213063","10.5115","0.0012","11.468","0.003","20.141","0.003","90","","90","","90","","2427.9","0.8","213","2","213","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H34 N2 O4 S2 -","- C23 H34 N2 O4 S2 -","- C92 H136 N8 O16 S8 -","4","1","","Alves, M. José; Bickley, Jamie F.; Gilchrist, Thomas L.","Diastereoselectivity in the addition and cycloaddition reactions of a chiral ester of 2H-azirine-3-carboxylic acid","Journal of the Chemical Society, Perkin Transactions 1","1999","","11","1399","","10.1039/a902182e","","","0.71073","MoKα","","0.044","0.0344","","","0.0779","0.0812","","","","","","0.974","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213064","12.171","0.002","5.2299","0.0007","16.567","0.002","90","","107.709","0.01","90","","1004.6","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 Ni S8 -","- C16 H20 Ni S8 -","- C32 H40 Ni2 S16 -","2","0.5","","Bai, Jun‐Feng; Zuo, Jing‐Lin; Tan, Wei‐Lian; Ji, Wei; Shen, Zhen; Fun, Hoong‐Kun; Chinnakali, Kandasamy; Abdul Razak, Ibrahim; You, Xiao‐Zeng; Che, Chi‐Ming","Synthesis, structure and optical limiting effect of two new nickel complexes containing strongly bound geometrically fixed multi‐sulfur 1,2‐dithiolene ligands showing remarkable near‐IR absorption","Journal of Materials Chemistry","1999","9","10","2419","","10.1039/a902295c","","","0.71073","MoKα","","0.0247","0.0211","","0.0528","0.051","","","","1.06","1.074","1.074","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213065","12.812","0.002","9.449","0.001","8.199","0.001","111.55","0.01","74.84","0.01","111.21","0.01","851.1","0.2","298","","298","","","","","","","","","4","P -1","-P 1","2","","2,4-Cyclohexadiene-1-one-2,4-dinitro-6-[2-(1,3,3-trimethyl-2- indolinidene)ethylidene]","","- C19 H17 N3 O5 -","- C19 H17 N3 O5 -","- C38 H34 N6 O10 -","2","1","","Hobley, Jonathan; Malatesta, Vincenzo; Millini, Roberto; Montanari, Luciano; O Neil Parker, Jr, Wallace","Proton exchange and isomerisation reactions of photochromic and reverse photochromic spiro-pyrans and their merocyanine forms","Physical Chemistry Chemical Physics","1999","1","14","3259","","10.1039/a902379h","","","0.71069","MoKα","","","0.0518","","0.1088","","","","","1.887","","","1.231","","","","has coordinates","282086","2023-03-28","13:50:54",""
"7213066","26.276","0.004","16.196","0.003","24.731","0.002","90","","112.66","0.01","90","","9712","3","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(5_a,7b_a,8_a,13_a,13a_a,16a_a,17_a)-7b-Bromo- 7b,8,13,13a,16a,17-hexahydro-5,8,13,17-tetraphenyl-5,17:8,13- diepoxynaphth[2',3'-2,3]azuleno[5,6-c][2]benzoxepin- 14(5H)-one","","- C62 H45 Br O4 -","- C62 H45 Br O4 -","- C496 H360 Br8 O32 -","8","1","","Mori, Akira; Yan, Yong Zhe; Kato, Nobuo; Takeshita, Hitoshi; Nozoe, Tetsuo","Thermal cycloaddition reactions of azulene-1,5-quinones and azulene-1,7-quinones with cyclic dienes and cycloheptatriene","Journal of the Chemical Society, Perkin Transactions 1","1999","","15","2129","","10.1039/a902493j","","","1.54184","CuKα","","0.059","0.0463","","","0.1292","0.1381","","","","","","1.044","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213067","41.133","0.009","12.545","0.002","18.353","0.003","90","","99.29","0.02","90","","9346","3","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(5_a,6_b,8b_b,9_a,14_a,14a_b,16_b,17_a)-8b-Bromo- 5,6,8b,9,14,14a,16,17-octahydro-5,9,14,17-tetraphenyl-5,17:9,14- diepoxybenzo[5',6']cyclodeca[1',2'-3,4]cyclopenta[1,2-b] naphthalene-15,18-dione","","- C62 H45 Br O4 -","- C62 H45 Br O4 -","- C496 H360 Br8 O32 -","8","1","","Mori, Akira; Yan, Yong Zhe; Kato, Nobuo; Takeshita, Hitoshi; Nozoe, Tetsuo","Thermal cycloaddition reactions of azulene-1,5-quinones and azulene-1,7-quinones with cyclic dienes and cycloheptatriene","Journal of the Chemical Society, Perkin Transactions 1","1999","","15","2129","","10.1039/a902493j","","","1.54184","CuKα","","0.1307","0.0606","","","0.1464","0.182","","","","","","1.007","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213068","12.699","0.002","16.985","0.002","9.715","0.002","90","","101.75","0.01","90","","2051.5","0.6","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","(5_a,6_b,9a_a,10_a,15_a,16_b,17_a)-15a-Bromo- 5,6,9a,10,15,15a,16,17-octahydro-5,17:10,15-diepoxy- 6,16-methanobenzo[5',6']cyclodeca[2',1'-3,4]cyclopenta [1,2-b]naphthaleno-9,18-dione","","- C26 H17 Br O4 -","- C26 H17 Br O4 -","- C104 H68 Br4 O16 -","4","1","","Mori, Akira; Yan, Yong Zhe; Kato, Nobuo; Takeshita, Hitoshi; Nozoe, Tetsuo","Thermal cycloaddition reactions of azulene-1,5-quinones and azulene-1,7-quinones with cyclic dienes and cycloheptatriene","Journal of the Chemical Society, Perkin Transactions 1","1999","","15","2129","","10.1039/a902493j","","","1.54184","CuKα","","0.0398","0.0376","","","0.1015","0.1028","","","","","","1.161","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213069","8.114","0.011","26.501","0.011","13.45","0.006","90","","101.42","0.06","90","","2835","4","248","","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H17 Cl9 N3 S Sb -","- C18 H17 Cl9 N3 S Sb -","- C72 H68 Cl36 N12 S4 Sb4 -","4","1","","El-Gazzar, Abdel-Rahman B.A.; Scholten, Kirsten; Guo, Yiping; Weißenbach, Kerstin; Hitzler, Martin G.; Roth, Gerhard; Fischer, Helmut; Jochims, Johannes C.","Cycloadditions of 1-aza-2-azoniaallene cations to isothiocyanates","Journal of the Chemical Society, Perkin Transactions 1","1999","","14","1999","","10.1039/a902505g","","","0.71073","MoKα","","0.0475","0.038","","0.0973","0.0904","","","","1.048","1.067","1.067","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213070","6.0668","0.001","11.952","0.003","23.096","0.009","90","","90","","90","","1674.7","0.8","220","2","220","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H25 N O3 -","- C17 H25 N O3 -","- C68 H100 N4 O12 -","4","1","","Rae, Alastair; Aliev, Abil E.; Anderson, J. Edgar; Castro, José L.; Ker, James; Parsons, Simon; Stchedroff, Marc; Thomas, Steven; Tabor, Alethea B.","Preparation and structure of homochiral tetrahydro-2H-1,3-oxazines","Journal of the Chemical Society, Perkin Transactions 1","1999","","14","1933","","10.1039/a902667c","","","1.54184","CuKα","","0.2362","0.0997","","0.2847","0.2053","","","","1.012","1.335","1.335","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213071","10.4032","0.0012","14.172","0.002","18.893","0.002","90","","90","","90","","2785.5","0.6","293","2","293","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C19 H13 N O -","- C19 H13 N O -","- C152 H104 N8 O8 -","8","2","","Noh, Taehee; Jeon, Kyungmoon; Jeong, Youngmee; Jang, Shinho; Min, Kil Sik","Synthesis of 9-cyanophenanthrene–furan and –benzene cyclodimers and their reversion","Journal of the Chemical Society, Perkin Transactions 2","1999","","7","1299","","10.1039/a902714i","","","0.71069","MoKα","","0.1153","0.0529","","0.1757","0.1161","","","","0.887","1.119","1.119","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213072","6.372","0.0008","27.142","0.006","14.238","0.002","90","","92.29","0.02","90","","2460.5","0.7","180","2","180","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","EDT-TTF-CO2H","4-(4',5'-ethylenedithiotetrathiafulvalenyl)carboxylic acid","","- C9 H6 O2 S6 -","- C9 H5 O2 S6 -","- C72 H40 O16 S48 -","8","2","","Heuzé, Karine; Fourmigué, Marc; Batail, Patrick","The crystal chemistry of amide‐functionalized ethylenedithiotetrathiafulvalenes: EDT‐TTF‐CONRR′ (R, R′ = H, Me)","Journal of Materials Chemistry","1999","9","10","2373","","10.1039/a902852h","","","0.71073","MoKα","","0.2866","0.0819","","0.1902","0.1232","","","","0.712","1.04","1.04","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213073","6.3477","0.0006","30.765","0.003","16.438","0.002","90","","95.681","0.011","90","","3194.4","0.6","180","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","EDT-TTF-CONH2, 0.75 THF","3-amido-3',4'-ethylenedithiotetrathiafulvalene, THF solvate","","- C12 H13 N O1.75 S6 -","- C12 H9 N O1.75 S6 -","- C96 H72 N8 O14 S48 -","8","2","","Heuzé, Karine; Fourmigué, Marc; Batail, Patrick","The crystal chemistry of amide‐functionalized ethylenedithiotetrathiafulvalenes: EDT‐TTF‐CONRR′ (R, R′ = H, Me)","Journal of Materials Chemistry","1999","9","10","2373","","10.1039/a902852h","","","0.71073","MoKα","","0.1899","0.0689","","0.1512","0.1173","","","","0.827","1.074","1.074","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213074","7.6636","0.0015","17.584","0.004","21.553","0.004","90","","90","","90","","2904.4","1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","EDT-TTF(CONHMe)","3-methylamido-3',4'ethylenedithiotetrathiafulvalene","","- C10 H9 N O S6 -","- C10 H9 N O S6 -","- C80 H72 N8 O8 S48 -","8","2","","Heuzé, Karine; Fourmigué, Marc; Batail, Patrick","The crystal chemistry of amide‐functionalized ethylenedithiotetrathiafulvalenes: EDT‐TTF‐CONRR′ (R, R′ = H, Me)","Journal of Materials Chemistry","1999","9","10","2373","","10.1039/a902852h","","","0.71073","MoKα","","0.0617","0.036","","0.0705","0.0643","","","","0.91","1.017","1.017","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213075","6.299","0.0013","7.886","0.002","29.631","0.006","90","","90","","90","","1471.9","0.6","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","EDT-TTF-CONMe2","3-dimethylamido-3',4'-ethylenedithiotetrathiafulvalene","","- C11 H11 N O S6 -","- C11 H11 N O S6 -","- C44 H44 N4 O4 S24 -","4","1","","Heuzé, Karine; Fourmigué, Marc; Batail, Patrick","The crystal chemistry of amide‐functionalized ethylenedithiotetrathiafulvalenes: EDT‐TTF‐CONRR′ (R, R′ = H, Me)","Journal of Materials Chemistry","1999","9","10","2373","","10.1039/a902852h","","","0.71073","Mo-Kα","","0.1987","0.047","","0.1998","0.1092","","","","0.921","0.936","0.936","","","","","has coordinates","180461","2020-10-21","18:00:00",""
"7213076","17.537","0.002","16.113","0.007","23.487","0.005","90","","94.814","0.012","90","","6613","3","296","","296","","","","","","","","Synthesized","5","P 1 21/n 1","-P 2yn","14","","[(2-Cyanoethyl-C^1^)bis(dimethylglyoximato-N,N') (isonicotinic acid-N)cobalt(III)][dicyclohexylamine]","","- C29 H46 Co N7 O6 -","- C29 H46 Co N7 O6 -","- C232 H368 Co8 N56 O48 -","8","2","","Hashizume, Daisuke; Ohashi, Yuji","Photoisomerization of (2-cyanoethyl)(isonicotinic acid)cobaloxime complex in a series of isostructural host‒guest complex crystals","Journal of the Chemical Society, Perkin Transactions 2","1999","","8","1689","","10.1039/a902900a","","","0.71073","MoKα","","0.1423","0.0573","","0.1693","0.1367","","","","1.024","1.169","1.169","","","","","has coordinates,has disorder","180461","2020-10-21","18:00:00",""
"7213077","17.477","0.002","16.439","0.002","23.6056","0.0015","90","","95.74","0.007","90","","6748","1.2","296","","296","","","","","","","","Synthesized","5","P 1 21/n 1","-P 2yn","14","","[(2-Cyanoethyl-C^1^)bis(dimethylglyoximato-N,N') (isonicotinic acid-N)cobalt(III)] [cycloheptylcyclohexylamine]","","- C30 H48 Co N7 O6 -","- C30 H48 Co N7 O6 -","- C240 H384 Co8 N56 O48 -","8","2","","Hashizume, Daisuke; Ohashi, Yuji","Photoisomerization of (2-cyanoethyl)(isonicotinic acid)cobaloxime complex in a series of isostructural host‒guest complex crystals","Journal of the Chemical Society, Perkin Transactions 2","1999","","8","1689","","10.1039/a902900a","","","0.71073","MoKα","","0.1161","0.0573","","0.4121","0.1779","","","","1.101","1.19","1.19","","","","","has coordinates,has disorder","180461","2020-10-21","18:00:00",""
"7213078","17.556","0.003","16.604","0.003","24.058","0.003","90","","95.817","0.011","90","","6976.8","1.9","296","","296","","","","","","","","Synthesized","5","P 1 21/n 1","-P 2yn","14","","[(2-Cyanoethyl-C^1^)bis(dimethylglyoximato-N,N') (isonicotinic acid-N)cobalt(III)] [cyclohexylcyclooctylamine]","","- C31 H50 Co N7 O6 -","- C31 H50 Co N7 O6 -","- C248 H400 Co8 N56 O48 -","8","2","","Hashizume, Daisuke; Ohashi, Yuji","Photoisomerization of (2-cyanoethyl)(isonicotinic acid)cobaloxime complex in a series of isostructural host‒guest complex crystals","Journal of the Chemical Society, Perkin Transactions 2","1999","","8","1689","","10.1039/a902900a","","","0.71073","MoKα","","0.1586","0.0761","","0.2737","0.2215","","","","1.067","1.24","1.24","","","","","has coordinates,has disorder","180461","2020-10-21","18:00:00",""
"7213079","7.7023","0.0013","9.925","0.002","13.356","0.002","80.96","0.03","76.495","0.011","70.767","0.013","933.8","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H21 F2 N O3 -","- C20 H21 F2 N O3 -","- C40 H42 F4 N2 O6 -","2","1","","Balnaves, Andrew S.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Palmer, Michael J.; Percy, Jonathan M.","The generation of difluoroenolates from trifluoroethanol and reproducible syntheses of α,α-difluoro-β-hydroxy ketones","Journal of the Chemical Society, Perkin Transactions 1","1999","","17","2525","","10.1039/a902966d","","","0.71069","MoKα","","0.0783","0.0429","","0.1054","0.0975","","","","0.648","0.852","0.852","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213080","7.7241","0.0003","25.4363","0.0008","10.1058","0.0004","90","","103.075","0.0016","90","","1934.04","0.12","423","2","423","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H22 F2 N2 O6 -","- C17 H22 F2 N2 O6 -","- C68 H88 F8 N8 O24 -","4","1","","Balnaves, Andrew S.; Gelbrich, Thomas; Hursthouse, Michael B.; Light, Mark E.; Palmer, Michael J.; Percy, Jonathan M.","The generation of difluoroenolates from trifluoroethanol and reproducible syntheses of α,α-difluoro-β-hydroxy ketones","Journal of the Chemical Society, Perkin Transactions 1","1999","","17","2525","","10.1039/a902966d","","","0.71073","MoKα","","0.0763","0.057","","0.1512","0.1401","","","","1.021","1.082","1.082","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213081","13.055","0.003","16.915","0.003","10.772","0.002","95.66","0.01","105","0.01","99.65","0.01","2239.8","0.8","20","","20","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H10 N5 Ni S4 -","- C18.75 H10 N6.25 Ni1.125 S5 -","- C75 H40 N25 Ni4.5 S20 -","4","2","","Robertson, Neil; Bergemann, Christoph; Becker, Helmut; Agarwal, Prabhat; Julian, Stephen R.; Friend, Richard H.; Hatton, Nicholas J.; Underhill, Allan E.; Kobayashi, Akiko","Synthesis, structure and properties of [ethylpyridinium][Ni(mnt)2]: evidence for an unusual magnetically ordered ground state","Journal of Materials Chemistry","1999","9","8","1713","","10.1039/a903007g","","","0.7107","MoKα","","","0.0683","","","0.1067","","","","","0.094","0.094","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213082","13.311","0.002","17.093","0.001","11.016","0.001","95.095","0.008","105.2","0.01","101.189","0.01","2346.8","0.5","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C15 H10 N5 Ni S4 -","- C18.25 H10 N6 Ni1.125 S5 -","- C73 H40 N24 Ni4.5 S20 -","4","2","","Robertson, Neil; Bergemann, Christoph; Becker, Helmut; Agarwal, Prabhat; Julian, Stephen R.; Friend, Richard H.; Hatton, Nicholas J.; Underhill, Allan E.; Kobayashi, Akiko","Synthesis, structure and properties of [ethylpyridinium][Ni(mnt)2]: evidence for an unusual magnetically ordered ground state","Journal of Materials Chemistry","1999","9","8","1713","","10.1039/a903007g","","","0.7107","MoKα","","","0.0872","","","0.1611","","","","","0.144","0.144","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213083","13.33","0.002","8.404","0.002","15.1","0.002","90","","100.2","0.01","90","","1664.8","0.5","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H19 N3 O2 S -","- C17 H19 N3 O2 S -","- C68 H76 N12 O8 S4 -","4","1","","Manh, Gabriel T.; Purseigle, Franck; Dubreuil, Didier; Pradère, Jean Paul; Guingant, André; Danion-Bougot, Renée; Danion, Daniel; Toupet, Loic","N-Thio- and N-selenophenacylamidines: electrophilic activation as a route to some 1-hetero-3-aza-4-dimethylaminobuta-1,3-dienes","Journal of the Chemical Society, Perkin Transactions 1","1999","","19","2821","","10.1039/a903150b","","","0.71069","MoKα","","0.0771","0.0371","","","0.1002","0.1143","","","","","","1.029","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213084","8.032","0.003","13.044","0.002","17.604","0.004","90","","90","","90","","1844.4","0.9","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C18 H21 N3 O2 S -","- C18 H21 N3 O2 S -","- C72 H84 N12 O8 S4 -","4","1","","Manh, Gabriel T.; Purseigle, Franck; Dubreuil, Didier; Pradère, Jean Paul; Guingant, André; Danion-Bougot, Renée; Danion, Daniel; Toupet, Loic","N-Thio- and N-selenophenacylamidines: electrophilic activation as a route to some 1-hetero-3-aza-4-dimethylaminobuta-1,3-dienes","Journal of the Chemical Society, Perkin Transactions 1","1999","","19","2821","","10.1039/a903150b","","","0.71069","MoKα","","0.0328","0.0327","","","0.1069","0.107","","","","","","1.18","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213085","12.638","0.007","7.998","0.002","12.968","0.001","90","","93.15","0.02","90","","1308.8","0.8","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H18 N2 O3 -","- C13 H18 N2 O3 -","- C52 H72 N8 O12 -","4","1","","Manh, Gabriel T.; Purseigle, Franck; Dubreuil, Didier; Pradère, Jean Paul; Guingant, André; Danion-Bougot, Renée; Danion, Daniel; Toupet, Loic","N-Thio- and N-selenophenacylamidines: electrophilic activation as a route to some 1-hetero-3-aza-4-dimethylaminobuta-1,3-dienes","Journal of the Chemical Society, Perkin Transactions 1","1999","","19","2821","","10.1039/a903150b","","","0.71069","MoKα","","0.077","0.0611","","","0.1663","0.1789","","","","","","1.043","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213086","12.26","0.004","19.77","0.009","10.336","0.002","90","","94.688","0.002","90","","2496.9","1.5","296","2","296","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","11b","1-(1'-Naphthyl)-4,5:9,10-dibenzobicyclo[5,4,0,02,11]undeca-4,9-diene","","- C35 H30 -","- C35 H30 -","- C140 H120 -","4","1","","Isobe, Shin-ichiro; Taniguchi, Masahiko; Sawada, Tsuyoshi; Thiemann, Thies; Yonemitsu, Tadashi; Mataka, Shuntaro","Novel rearrangement of conformationally restrained [3.3]orthocyclophanes","Journal of the Chemical Society, Perkin Transactions 1","1999","","15","2101","","10.1039/a903156a","","","1.54184","CuKa","","0.1323","0.0569","","","0.1317","0.1869","","","1.108","","","1.087","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213087","18.639","0.004","10.296","0.002","9.869","0.002","90","","96.77","0.02","90","","1880.7","0.7","296","2","296","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","6a","5-Bromomethyl-5a-phenyl-5,5a,6,11,11a,12-hexahydronaphthacene","","- C25 H23 Br -","- C25 H23 Br -","- C100 H92 Br4 -","4","1","","Isobe, Shin-ichiro; Taniguchi, Masahiko; Sawada, Tsuyoshi; Thiemann, Thies; Yonemitsu, Tadashi; Mataka, Shuntaro","Novel rearrangement of conformationally restrained [3.3]orthocyclophanes","Journal of the Chemical Society, Perkin Transactions 1","1999","","15","2101","","10.1039/a903156a","","","1.54184","CuKα","","0.0586","0.0438","","","0.1437","0.183","","","","","","1.16","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213088","9.376","0.002","23.622","0.003","9.288","0.002","90","","112.03","0.02","90","","1906.9","0.7","296","2","296","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","5","12-Bromo-11a-phenyl-5a,6,11,11a,12,13-hexahydro-5H-benzo[4,5]cyclohepta[1,2 b]naphthalene","","- C25 H23 Br -","- C25 H23 Br -","- C100 H92 Br4 -","4","1","","Isobe, Shin-ichiro; Taniguchi, Masahiko; Sawada, Tsuyoshi; Thiemann, Thies; Yonemitsu, Tadashi; Mataka, Shuntaro","Novel rearrangement of conformationally restrained [3.3]orthocyclophanes","Journal of the Chemical Society, Perkin Transactions 1","1999","","15","2101","","10.1039/a903156a","","","1.54184","CuKa","","0.0542","0.0476","","","0.1328","0.1475","","","","","","1.099","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213089","10.945","0.008","25.07","0.011","16.53","0.01","90","","104.71","0.05","90","","4387","5","295","","295","","","","","","","","synthesis in laboratory","3","P 1 21/n 1","-P 2yn","14","","anti-(2-anisyl)di(1-adamantyl)methane","","- C28 H38 O -","- C28 H38 O -","- C224 H304 O8 -","8","2","","Lomas, John S.; Vaissermann, Jacqueline","Competing intermolecular and intramolecular hydride transfers in the ionic hydrogenation of (2-alkoxyphenyl)di(1-adamantyl)methanols †","Journal of the Chemical Society, Perkin Transactions 2","1999","","8","1639","","10.1039/a903303c","","","0.71069","MoKα","","","0.0527","","","0.0665","","","","","0.8625","0.8625","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213090","9.382","0.002","12.1345","0.0012","17.121","0.002","90","","97.215","0.013","90","","1933.7","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H30 N4 O3 -","- C18 H30 N4 O3 -","- C72 H120 N16 O12 -","4","1","","Long, Nicholas J.; Parker, David G.; Speyer, Paul R.; White, Andrew J. P.; Williams, David J.","Efficient syntheses of polymerisable pendant arm azamacrocycles and formation of poly(vinylbenzyltriazacyclododecane)","Journal of the Chemical Society, Perkin Transactions 1","1999","","12","1621","","10.1039/a903318a","","","0.71073","MoKα","","0.0902","0.052","","0.1463","0.1213","","","","1.009","1.097","1.097","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213091","28.1031","0.0012","28.1031","0.0012","7.1509","0.0004","90","","90","","120","","4891","0.4","298","2","298","2","","","","","","","","2","R -3 :H","-R 3","148","","","","- C32 H24 -","- C32 H24 -","- C288 H216 -","9","0.5","","Yu, Richeng; Yakimansky, Alexander; Voigt-Martin, Ingrid G.; Fetten, Michael; Schnorpfeil, C.; Schollmeyer, Dieter; Meier, Herbert","Tetrabenzo[ab, f, jk,o][18]annulene: synthesis, crystal structure analysis, ab initio quantum-chemical studies of intermolecular interactions in the gas phase and in crystalline states, photodimerization and photopolymerization","Journal of the Chemical Society, Perkin Transactions 2","1999","","9","1881","","10.1039/a903451j","","","1.54178","CuKα","","0.0886","0.0516","","","0.1236","0.1404","","","","","","1.024","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213092","8.195","0.001","9.437","0.002","9.663","0.002","98.89","0.003","105.927","0.003","106.06","0.003","668.7","0.2","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C12 H15 N O4 S -","- C12 H15 N O4 S -","- C24 H30 N2 O8 S2 -","2","1","","Juhl, Karsten; Hazell, Rita G.; Jørgensen, Karl Anker","Catalytic enantioselective formation of aziridines from α-imino esters","Journal of the Chemical Society, Perkin Transactions 1","1999","","16","2293","","10.1039/a903521d","","","0.71073","MoKα","","","0.033","","","0.042","","","","","1.36","1.36","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213093","9.758","0.002","17.425","0.001","19.072","0.001","90","","90","","90","","3242.9","0.7","150","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C36 H45 N3 O4 -","- C36 H45 N3 O4 -","- C144 H180 N12 O16 -","4","1","","Enders, Dieter; Shilvock, John P.; Raabe, Gerhard","Asymmetric nucleophilic α-amino-acylation with metalated chiral amino nitriles: enantioselective synthesis of 3-substituted 5-amino-4-oxo-esters via asymmetric Michael addition","Journal of the Chemical Society, Perkin Transactions 1","1999","","12","1617","","10.1039/a903536b","","","","CuKα","","0.092","0.072","","0.08","0.075","","","","1.457","1.472","1.472","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213094","27.653","0.007","8.13","0.002","9.857","0.004","90","","95.74","0.04","90","","2204.9","1.2","290.2","","290.2","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C22 H40 O4 -","- C22 H40 O4 -","- C88 H160 O16 -","4","1","","Ruddick, Clare L.; Hodge, Philip; Zhuo, Yang; Beddoes, Roy L.; Helliwell, Madeleine","Cyclo‐depolymerisation of polyundecanoate and related polyesters: characterisation of cyclic oligoundecanoates and related cyclic oligoesters","Journal of Materials Chemistry","1999","9","10","2399","","10.1039/a903767e","","","0.7107","MoKα","","","0.0497","","","0.0354","","","","","1.775","1.775","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213095","12.416","0.002","22.881","0.004","9.315","0.002","99.93","0.02","101.19","0.02","83.39","0.01","2548","0.8","296.2","","296.2","","","","","","","","","5","P -1","-P 1","2","","","","- C84 H156 N2 Pt S16 -","- C84 H146 N2 Pt S16 -","- C84 H146 N2 Pt S16 -","1","0.5","","Nakazono, Takeo; Nakano, Motohiro; Tamura, Hatsue; Matsubayashi, Gen‐etsu","Properties of Pt(ii) complexes with a sulfur‐rich dithiolate ligand having alkyl chains and of their oxidized species. The X‐ray crystal structure of [NBun4]2[Pt{C6S8(C10H21)2}]","Journal of Materials Chemistry","1999","9","10","2413","","10.1039/a903821c","","","0.7107","MoKα","","","0.039","","","0.043","0.043","","","","","","1.56","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7213096","6.998","0.001","18.07","0.002","11.031","0.002","90","","104.53","0.01","90","","1350.3","0.4","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","","Srikrishna, Adusumilli; Nagaraju, Sankuratri; Venkateswarlu, Somepalli; Hiremath, Uma S.; Reddy, T. Jagadeeswar; Venugopalan, Paloth","A formal total synthesis of (±)-homogynolide-B","Journal of the Chemical Society, Perkin Transactions 1","1999","","15","2069","","10.1039/a903866c","","","0.71073","MoKα","","0.0742","0.0511","","","0.1279","0.1425","","","","","","1.02","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213097","9.8331","0.001","10.3392","0.001","10.5216","0.0012","90","","99.957","0.012","90","","1053.58","0.19","200","2","200","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C24 H28 O3 -","- C24 H28 O3 -","- C48 H56 O6 -","2","1","","Dang, Hai-Shan; Elsegood, Mark R. J.; Kim, Kyoung-Mahn; Roberts, Brian P.","Radical-chain reductive alkylation of electron-rich alkenes mediated by silanes in the presence of thiols as polarity-reversal catalysts","Journal of the Chemical Society, Perkin Transactions 1","1999","","15","2061","","10.1039/a903961i","","","1.54184","CuKα","","0.0453","0.045","","","0.1266","0.1269","","","","","","1.055","","","","has coordinates,has disorder","301864","2025-08-22","15:14:31",""
"7213098","10.0392","0.0008","7.6254","0.0006","13.2278","0.0011","90","","107.559","0.007","90","","965.45","0.14","160","2","160","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C18 H28 O8 -","- C18 H28 O8 -","- C36 H56 O16 -","2","1","","Dang, Hai-Shan; Elsegood, Mark R. J.; Kim, Kyoung-Mahn; Roberts, Brian P.","Radical-chain reductive alkylation of electron-rich alkenes mediated by silanes in the presence of thiols as polarity-reversal catalysts","Journal of the Chemical Society, Perkin Transactions 1","1999","","15","2061","","10.1039/a903961i","","","1.54184","CuKα","","0.042","0.0409","","","0.1086","0.1101","","","","","","1.056","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213099","8.92","0.001","9.845","0.001","26.878","0.001","90","","92.23","0.02","90","","2358.6","0.4","293","2","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H28 N4 O4 S2 -","- C23 H28 N4 O4 S2 -","- C92 H112 N16 O16 S8 -","4","1","","Adamson, Jason; Coe, Benjamin J.; Grassam, Helen L.; Jeffery, John C.; Coles, Simon J.; Hursthouse, Michael B.","Reactions of 1,3-diethyl-2-thiobarbituric acid with aldehydes: formation of arylbis(1,3-diethyl-2-thiobarbitur-5-yl)methanes † and crystallographic evidence for ground state polarisation in 1,3-diethyl-5-[4-(dimethylamino)benzylidene]-2-thiobarbituric acid","Journal of the Chemical Society, Perkin Transactions 1","1999","","17","2483","","10.1039/a904015c","","","0.71073","MoKα","","","0.042","","","","0.1399","","","","","","1.111","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213100","5.928","0.0006","13.671","0.0015","18.592","0.002","86.079","0.005","80.87","0.006","77.481","0.005","1451.4","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Methyl 1-Acetamido-t-4-methanesulfonyloxycyclohexane-r-1-carboxylate","","- C11 H19 N O6 S -","- C11 H19 N O6 S -","- C44 H76 N4 O24 S4 -","4","2","","Avenoza, Alberto; Cativiela, Carlos; Fernández-Recio, Miguel A.; Peregrina, Jesús M.","Synthesis of 1-amino-4-hydroxycyclohexane-1-carboxylic acids","Journal of the Chemical Society, Perkin Transactions 1","1999","","22","3375","","10.1039/a904132j","","","0.7107","MoKα","","0.131","0.0765","","","0.1878","0.2281","","","","","","1.026","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213101","34.154","0.001","8.581","0.0002","9.984","0.0003","90","","92.511","0.0016","90","","2923.26","0.14","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","Methyl 1-Acetamido-c-4-methanesulfonyloxycyclohexane-r-1-carboxylate","","- C11 H19 N O6 S -","- C11 H19 N O6 S -","- C88 H152 N8 O48 S8 -","8","1","","Avenoza, Alberto; Cativiela, Carlos; Fernández-Recio, Miguel A.; Peregrina, Jesús M.","Synthesis of 1-amino-4-hydroxycyclohexane-1-carboxylic acids","Journal of the Chemical Society, Perkin Transactions 1","1999","","22","3375","","10.1039/a904132j","","","0.7107","MoKα","","0.0584","0.045","","","0.1252","0.1438","","","","","","1.062","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213102","21.055","0.013","14.453","0.008","5.099","0.002","90","","90","","90","","1551.7","1.4","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C18 H20 O5 -","- C18 H18.75 O5 -","- C72 H75 O20 -","4","0.5","","Olsher, Uriel; Shoham, Gil; Dalley, N. Kent; Weining, Jiang; Luboch, Elzbieta; Yu, Zong-Yuan; Knobeloch, John M.; Lee, Jong Chan; Talanov, Vladimir S.; Bartsch, Richard A.","Structural and conformational studies of alcohol, diol and methyl ether derivatives of dibenzo-14-crown-4. Implications for ligand and tecton design","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2557","","10.1039/a904180j","","","0.71073","MoKα","","0.1078","0.0586","","0.157","0.1362","","","","0.968","1.166","1.166","","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213103","9.621","0.01","9.499","0.011","10.262","0.007","90","","115.39","0.06","90","","847.3","1.5","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H22 O5 -","- C19 H22 O5 -","- C38 H44 O10 -","2","1","","Olsher, Uriel; Shoham, Gil; Dalley, N. Kent; Weining, Jiang; Luboch, Elzbieta; Yu, Zong-Yuan; Knobeloch, John M.; Lee, Jong Chan; Talanov, Vladimir S.; Bartsch, Richard A.","Structural and conformational studies of alcohol, diol and methyl ether derivatives of dibenzo-14-crown-4. Implications for ligand and tecton design","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2557","","10.1039/a904180j","","","0.71073","MoKα","","0.1071","0.0843","","0.2268","0.2071","","","","1.007","1.156","1.156","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213104","17.06","0.007","17.922","0.005","5.552","0.002","90","","90","","90","","1697.5","1","293","2","293","2","","","","","","","","3","C m c 21","C 2c -2","36","","","","- C19 H22 O5 -","- C19 H21 O5 -","- C76 H84 O20 -","4","0.5","","Olsher, Uriel; Shoham, Gil; Dalley, N. Kent; Weining, Jiang; Luboch, Elzbieta; Yu, Zong-Yuan; Knobeloch, John M.; Lee, Jong Chan; Talanov, Vladimir S.; Bartsch, Richard A.","Structural and conformational studies of alcohol, diol and methyl ether derivatives of dibenzo-14-crown-4. Implications for ligand and tecton design","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2557","","10.1039/a904180j","","","0.71073","MoKα","","0.0863","0.0494","","0.1252","0.1097","","","","0.916","1.116","1.116","","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213105","33.139","0.008","5.064","0.001","20.155","0.003","90","","108.3","0.02","90","","3211.3","1.2","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C18 H20 O6 -","- C18 H20 O6 -","- C144 H160 O48 -","8","1","","Olsher, Uriel; Shoham, Gil; Dalley, N. Kent; Weining, Jiang; Luboch, Elzbieta; Yu, Zong-Yuan; Knobeloch, John M.; Lee, Jong Chan; Talanov, Vladimir S.; Bartsch, Richard A.","Structural and conformational studies of alcohol, diol and methyl ether derivatives of dibenzo-14-crown-4. Implications for ligand and tecton design","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2557","","10.1039/a904180j","","","0.71073","MoKα","","0.0986","0.0492","","0.1168","0.1021","","","","0.981","1.185","1.185","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213106","17.16","0.003","4.877","0.001","21.453","0.004","90","","112.64","0.01","90","","1657","0.6","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H22 O5 -","- C19 H22 O5 -","- C76 H88 O20 -","4","1","","Olsher, Uriel; Shoham, Gil; Dalley, N. Kent; Weining, Jiang; Luboch, Elzbieta; Yu, Zong-Yuan; Knobeloch, John M.; Lee, Jong Chan; Talanov, Vladimir S.; Bartsch, Richard A.","Structural and conformational studies of alcohol, diol and methyl ether derivatives of dibenzo-14-crown-4. Implications for ligand and tecton design","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2557","","10.1039/a904180j","","","0.71073","MoKα","","0.1758","0.0669","","0.156","0.1127","","","","1.025","1.153","1.153","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213107","20.295","0.006","8.139","0.003","11.205","0.005","90","","101.19","0.02","90","","1815.7","1.2","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H24 O5 -","- C20 H24 O5 -","- C80 H96 O20 -","4","1","","Olsher, Uriel; Shoham, Gil; Dalley, N. Kent; Weining, Jiang; Luboch, Elzbieta; Yu, Zong-Yuan; Knobeloch, John M.; Lee, Jong Chan; Talanov, Vladimir S.; Bartsch, Richard A.","Structural and conformational studies of alcohol, diol and methyl ether derivatives of dibenzo-14-crown-4. Implications for ligand and tecton design","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2557","","10.1039/a904180j","","","0.71073","MoKα","","0.1595","0.0676","","0.1747","0.1264","","","","1.032","1.163","1.163","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213108","13.684","0.002","5.827","0.001","20.132","0.003","90","0.02","91.76","0.02","90","0.02","1604.5","0.4","293","2","293","2","","","","","","","synthesis","3","P 1 21/a 1","-P 2yab","14","","3,3'''''-bis(butylthio)-2,2':5,,2'':5'',2''':5''',2'''':5'''',2'''''- -sexithiophene","","- C32 H30 S8 -","- C32 H30 S8 -","- C64 H60 S16 -","2","0.5","","Antolini, Luciano; Borsari, Marco; Goldoni, Francesca; Iarossi, Dario; Mucci, Adele; Schenetti, Luisa","Synthesis, structural characterization and electronic properties of 3,3″″′-bis(butylsulfanyl)-2,2′∶5′,2″∶5″,2‴∶5‴,2″″∶5″″,2‴″-sexithiophene","Journal of the Chemical Society, Perkin Transactions 1","1999","","21","3207","","10.1039/a904313f","","","0.71069","MoKα","","0.1109","0.054","","0.1759","0.1482","","","","0.979","1.152","1.152","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213109","13.0933","0.0005","23.0093","0.0008","10.3128","0.001","90","","111.328","0.005","90","","2894.1","0.3","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15.5 H11.5 Cl1.5 N3 O -","- C15.5 H11.5 Cl1.5 N3 O -","- C124 H92 Cl12 N24 O8 -","8","2","","Murguly, Elisa; Norsten, Tyler B.; Branda, Neil","Tautomerism of 4-hydroxyterpyridine in the solid, solution and gas phases: an X-ray, FT-IR and NMR study","Journal of the Chemical Society, Perkin Transactions 2","1999","","12","2789","","10.1039/a904323c","","","1.54178","CuKa","","0.0875","0.0595","","0.1415","0.1241","","","","1.059","1.114","1.114","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213110","15.7087","0.0004","15.7087","0.0004","7.4783","0.0002","90","","90","","120","","1598.14","0.07","161","2","161","2","","","","","","","","5","P 3 1 c","P 3 -2c","159","crystal violet chloride","","","- C25 H48 Cl N3 O9 -","- C25 H48 Cl N3 O9 -","- C50 H96 Cl2 N6 O18 -","2","0.333333","","Lovell, Scott; Marquardt, Brian J.; Kahr, Bart","Crystal violet’s shoulder","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2241","","10.1039/a904367e","","","0.7107","MoKα","","0.0986","0.0792","","","0.2011","0.2278","","","","","","1.067","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213111","10.1887","0.0005","21.4842","0.0011","21.2594","0.0006","90","","94.374","0.003","90","","4640","0.4","161","2","161","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","crystal violet chloride","","","- C25 H32 Cl N3 O -","- C25 H32 Cl N3 O -","- C200 H256 Cl8 N24 O8 -","8","2","","Lovell, Scott; Marquardt, Brian J.; Kahr, Bart","Crystal violet’s shoulder","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2241","","10.1039/a904367e","","","0.7107","MoKα","","0.1462","0.0684","","","0.1574","0.1933","","","","","","1.019","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213112","8.883","0.002","12.104","0.002","13.479","0.003","88.19","0.03","84.38","0.03","85.53","0.03","1437.5","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","N-formyl-1,3beta,5,7alpha-tetramethylbicyclo[3.3.1]nonan-3alpha-amine ?","","- C14 H25 N O -","- C14 H25 N O -","- C56 H100 N4 O4 -","4","2","","Jirgensons, Aigars; Kauss, Valerjans; Mishnev, Anatolij F.; Kalvinsh, Ivars","The synthesis of 3-amino-3-methylbicyclo[3.3.1]nonanes: Endo-selectivity in the Ritter reaction of 1,3,5,7α-tetramethylbicyclo[3.3.1]nonan-3-ol","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3527","","10.1039/a904394b","","","0.71073","MoKα","","0.1156","0.0846","","0.215","0.1832","","","","1.114","1.164","1.164","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213113","10.1723","0.0008","10.502","0.0008","12.964","0.001","90","","90","","90","","1384.94","0.19","200","2","200","2","","","","","","","","3","C 2 2 21","C 2c 2","20","","1,1,2,2-Tetramethyl-1,2-disilacyclodeca-4,8-diyne (8)","","- C12 H20 Si2 -","- C12 H20 Si2 -","- C48 H80 Si8 -","4","0.5","","Haberhauer, Gebhard; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank","Cyclic diynes with tetramethyldisilyl groups in the bridges. Syntheses and properties","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2093","","10.1039/a904409d","","","0.71073","MoKα","","0.0235","0.0228","","0.0614","0.0607","","","","1.1","1.105","1.105","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213114","13.363","0.005","10.52","0.002","11.258","0.005","90","","111.82","0.03","90","","1469.2","0.9","223","2","223","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","1,1,2,2-Tetramethyl-1,2-disilacycloundeca-4,9-diyne (9)","","- C13 H22 Si2 -","- C13 H22 Si2 -","- C52 H88 Si8 -","4","0.5","","Haberhauer, Gebhard; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank","Cyclic diynes with tetramethyldisilyl groups in the bridges. Syntheses and properties","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2093","","10.1039/a904409d","","","0.71073","MoKα","","0.048","0.039","","","0.109","0.115","","","","","","1.05","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213115","10.426","0.0002","12.3151","0.0001","13.0649","0.0002","90","","110.448","0.001","90","","1571.8","0.04","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1,2,2-Tetramethyl-1,2-disilacyclododeca-4,10-diyne (10)","","- C14 H24 Si2 -","- C14 H24 Si2 -","- C56 H96 Si8 -","4","1","","Haberhauer, Gebhard; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank","Cyclic diynes with tetramethyldisilyl groups in the bridges. Syntheses and properties","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2093","","10.1039/a904409d","","","0.71073","MoKα","","0.036","0.0296","","0.0795","0.0755","","","","1.034","1.06","1.06","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213116","10.268","0.002","11.346","0.002","8.679","0.002","111.72","0.03","113.95","0.03","70.04","0.03","836.4","0.4","253","2","253","2","","","","","","","","3","P -1","-P 1","2","","1,1,2,2-Tetramethyl-1,2-disilacyclotrideca-4,11-diyne (11)","","- C15 H26 Si2 -","- C15 H26 Si2 -","- C30 H52 Si4 -","2","1","","Haberhauer, Gebhard; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank","Cyclic diynes with tetramethyldisilyl groups in the bridges. Syntheses and properties","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2093","","10.1039/a904409d","","","0.71073","MoKα","","0.05","0.037","","","0.1","0.107","","","","","","1.12","","","","has coordinates,has disorder","301864","2025-08-22","15:14:31",""
"7213117","11.139","0.002","14.468","0.001","12.472","0.002","90","","97.34","0.02","90","","1993.5","0.5","223","2","223","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1,2,2,6,6,7,7-Octamethyl-1,2,6,7-tetrasilacyclodeca- 3,9-diyne (12)","","- C14 H28 Si4 -","- C14 H28 Si4 -","- C56 H112 Si16 -","4","1","","Haberhauer, Gebhard; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank","Cyclic diynes with tetramethyldisilyl groups in the bridges. Syntheses and properties","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2093","","10.1039/a904409d","","","0.71073","MoKα","","0.051","0.032","","","0.086","0.099","","","","","","1.07","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213118","11.725","0.002","12.678","0.001","8.391","0.001","92.44","0.01","110.73","0.01","65.26","0.01","1051.3","0.3","223","2","223","2","","","","","","","","3","P -1","-P 1","2","","1,1,2,2,6,6,8,8-Octamethyl-1,2,6,8-tetrasilacycloundeca- 4,9-diyne (13)","","- C15 H30 Si4 -","- C15 H30 Si4 -","- C30 H60 Si8 -","2","1","","Haberhauer, Gebhard; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank","Cyclic diynes with tetramethyldisilyl groups in the bridges. Syntheses and properties","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2093","","10.1039/a904409d","","","0.71073","MoKα","","0.038","0.029","","","0.08","0.087","","","","","","1.06","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213119","8.331","0.001","21.336","0.005","12.51","0.002","90","","100.58","0.01","90","","2185.9","0.7","223","2","223","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","1,1,2,2,6,6,9,9-Octamethyl-1,2,6,9-tetrasila- cyclododeca-4,10-diyne (14)","","- C16 H32 Si4 -","- C16 H32 Si4 -","- C64 H128 Si16 -","4","1","","Haberhauer, Gebhard; Gleiter, Rolf; Irngartinger, Hermann; Oeser, Thomas; Rominger, Frank","Cyclic diynes with tetramethyldisilyl groups in the bridges. Syntheses and properties","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2093","","10.1039/a904409d","","","0.71073","MoKα","","0.044","0.029","","","0.074","0.084","","","","","","1.07","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213120","10.3148","0.0002","16.8937","0.0004","21.7803","0.0003","90","","103.515","0.003","90","","3690.23","0.13","293","2","293","2","","","","","","","synthesis","7","P 1 21/n 1","-P 2yn","14","","","","- C34 H20 Eu F9 N2 O6 S3 -","- C34 H20 Eu F9 N2 O6 S3 -","- C136 H80 Eu4 F36 N8 O24 S12 -","4","1","","Chen, Xiao­Feng; Zhu, Xu­Hui; Xu, Yao­Hua; Shanmuga Sundara Raj, S.; Öztürk, Sema; Fun, Hoong­Kun; Ma, Jing; You, Xiao­Zeng","Triboluminescence and crystal structures of non­ionic europium complexes","Journal of Materials Chemistry","1999","9","11","2919","","10.1039/a904411f","","","0.71073","MoKα","","0.1275","0.063","","0.1651","0.1348","","","","1.028","1.123","1.123","","","","","has coordinates,has disorder","180462","2020-10-21","18:00:00",""
"7213121","12.272","0.0002","23.5505","0.0004","16.8123","0.0003","90","","99.818","0.001","90","","4787.79","0.14","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C57 H47 Eu N2 O7 -","- C57 H47 Eu N2 O7 -","- C228 H188 Eu4 N8 O28 -","4","1","","Chen, Xiao­Feng; Zhu, Xu­Hui; Xu, Yao­Hua; Shanmuga Sundara Raj, S.; Öztürk, Sema; Fun, Hoong­Kun; Ma, Jing; You, Xiao­Zeng","Triboluminescence and crystal structures of non­ionic europium complexes","Journal of Materials Chemistry","1999","9","11","2919","","10.1039/a904411f","","","0.71073","MoKα","","0.1621","0.0671","","","0.0866","0.1095","","","","","","1.042","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213122","15.127","0.009","17.123","0.005","11.304","0.004","90","","90","","90","","2928","2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(±)-4a-Hydroxy-4,10a-bis(methoxycarbonyl)-2,11-dimethyl-12syn-(2-pyridyl)- 2,3,4,4at,10,10at-hexahydro-10c,4r-(iminomethano)-1H-pyrido[3,4-b]indolizinium perchlorate monohydroperchlorate","","- C23 H28 Cl2 N4 O14 -","- C23 H28 Cl2 N4 O14 -","- C92 H112 Cl8 N16 O56 -","4","1","","Kuhl, Ulrich; Cambareri, Antonella; Sauber, Christian; Sörgel, Fritz; Hartmann, Rudolf; Euler, Harald; Kirfel, Armin; Holzgrabe, Ulrike","Synthesis, X-ray analysis and spectroscopic characterization of the hemiaminal cyclization product from 2,4-dipyridine substituted 3,7-diazabicyclo[3.3.1]nonanone 1,5-diesters","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2083","","10.1039/a904472h","","","0.71069","MoKα","","0.2647","0.0955","","0.1568","0.1182","","","","1.026","1.2","1.2","","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213123","18.3529","0.0012","6.4184","0.0005","19.1454","0.0013","90","","93.695","0.003","90","","2250.6","0.3","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H32 O6 -","- C23 H23 O6 -","- C92 H92 O24 -","4","1","","Thuéry, Pierre; Nierlich, Martine; Baldwin, Bruce W.; Aoki, Yoshio; Hirose, Takuji","Conformation of cis,trans-1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid derivatives: crystal structures and semiempirical molecular orbital calculations","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2077","","10.1039/a904475b","","","0.71073","MoKα","","0.1682","0.0783","","0.3331","0.1995","","","","1.182","1.214","1.214","","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213124","12.6745","0.0007","18.0319","0.0011","19.994","0.0011","84.929","0.003","72.592","0.003","89.799","0.003","4341.9","0.4","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","","","- C23 H32 O6 -","- C23 H29.75 O6 -","- C184 H238 O48 -","8","4","","Thuéry, Pierre; Nierlich, Martine; Baldwin, Bruce W.; Aoki, Yoshio; Hirose, Takuji","Conformation of cis,trans-1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid derivatives: crystal structures and semiempirical molecular orbital calculations","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2077","","10.1039/a904475b","","","0.71073","MoKα","","0.1559","0.1134","","0.3113","0.259","","","","1.091","1.162","1.162","","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213125","12.3657","0.0007","13.0496","0.0005","13.4977","0.0007","61.992","0.003","76.774","0.002","88.767","0.003","1862.61","0.17","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H26 O6 -","- C20 H26 O6 -","- C80 H104 O24 -","4","2","","Thuéry, Pierre; Nierlich, Martine; Baldwin, Bruce W.; Aoki, Yoshio; Hirose, Takuji","Conformation of cis,trans-1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid derivatives: crystal structures and semiempirical molecular orbital calculations","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2077","","10.1039/a904475b","","","0.71073","MoKα","","0.0551","0.0456","","0.1299","0.1183","","","","0.917","0.918","0.918","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213126","24.3829","0.0015","9.896","0.0006","15.7266","0.0005","90","","90","","90","","3794.7","0.3","123","2","123","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","","","- C20 H27 N O5 -","- C20 H27 N O5 -","- C160 H216 N8 O40 -","8","1","","Thuéry, Pierre; Nierlich, Martine; Baldwin, Bruce W.; Aoki, Yoshio; Hirose, Takuji","Conformation of cis,trans-1,3,5-trimethylcyclohexane-1,3,5-tricarboxylic acid derivatives: crystal structures and semiempirical molecular orbital calculations","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2077","","10.1039/a904475b","","","0.71073","MoKα","","0.0821","0.0632","","0.1887","0.1581","","","","1.037","1.068","1.068","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213127","15.048","0.004","11.327","0.003","16.988","0.004","90","0.02","97.02","0.02","90","0.02","2873.9","1.3","286.2","","286.2","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C27 H42 O4 S Si -","- C27 H42 O4 S Si -","- C108 H168 O16 S4 Si4 -","4","1","","Fujishima, Hiroshi; Takeshita, Hiroshi; Suzuki, Shuichi; Toyota, Masahiro; Ihara, Masataka","Hexamethyldisilazanes mediated one-pot intramolecular Michael addition–olefination reactions leading to exo-olefinated bicyclo[6.4.0]dodecanes","Journal of the Chemical Society, Perkin Transactions 1","1999","","18","2609","","10.1039/a904484a","","","1.5418","CuKα","","","0.0631","","","0.0634","","","","","3.008","3.008","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213128","8.1227","0.0005","10.188","0.001","22.116","0.002","90","","91.45","0.006","90","","1829.6","0.3","193.2","","193.2","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","N,N'-di-(p-chlorobenzoyl)-N,N'-diethoxyhydrazine","","- C18 H18 Cl2 N2 O4 -","- C18 H18 Cl2 N2 O4 -","- C72 H72 Cl8 N8 O16 -","4","1","","Glover, Stephen A.; Mo, Guoning; Rauk, Arvi; Tucker, David J.; Turner, Peter","Structure, conformation, anomeric effects and rotational barriers in the HERON amides, N,N ′-diacyl-N,N ′-dialkoxyhydrazines","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2053","","10.1039/a904575i","","","1.54178","CuKα","","0.0591","0.0567","","","0.1513","0.154","","","","","","1.053","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213129","7.814","0.002","8.2112","0.0006","10.115","0.002","86.496","0.012","88.77","0.02","85.463","0.012","645.7","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C8 H5 Cl2 N O2 S4 -","- C8 H5 Cl2 N O2 S4 -","- C16 H10 Cl4 N2 O4 S8 -","2","1","","Barriga, Susana; Konstantinova, Lidia S.; Marcos, Carlos F.; Rakitin, Oleg A.; Rees, Charles W.; Torroba, Tomás; White, Andrew J. P.; Williams, David J.","Conversion of N-alkyldiisopropylamines into N,N-bis(5-chloro-3-oxo[1,2]dithiol-4-yl)amines","Journal of the Chemical Society, Perkin Transactions 1","1999","","16","2237","","10.1039/a904680a","","","1.54178","CuKα","","0.0543","0.0469","","0.141","0.1279","","","","1.088","1.125","1.125","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213130","10.061","0.003","9.145","0.003","11.597","0.005","90","","114.76","0.03","90","","968.9","0.6","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 B N -","- C10 H16 B N -","- C40 H64 B4 N4 -","4","1","","Ariffin, Azhar; Blake, Alexander J.; Ebden, Mark R.; Li, Wan-Sheung; Simpkins, Nigel S.; Fox, David N. A.","The diastereoselective and enantioselective substitution reactions of an isoindoline–borane complex","Journal of the Chemical Society, Perkin Transactions 1","1999","","17","2439","","10.1039/a904788c","","","0.71073","MoKα","","0.0549","0.0427","","","0.0935","0.1045","","","","","","1.134","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213131","8.201","0.002","9.792","0.003","16.905","0.006","90","","90","","90","","1357.5","0.7","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H22 B N Si -","- C12 H22 B N Si -","- C48 H88 B4 N4 Si4 -","4","1","","Ariffin, Azhar; Blake, Alexander J.; Ebden, Mark R.; Li, Wan-Sheung; Simpkins, Nigel S.; Fox, David N. A.","The diastereoselective and enantioselective substitution reactions of an isoindoline–borane complex","Journal of the Chemical Society, Perkin Transactions 1","1999","","17","2439","","10.1039/a904788c","","","0.71073","MoKα","","0.041","0.0361","","","0.0822","0.086","","","","","","1.13","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213132","9.877","0.004","10.076","0.005","13.669","0.009","90","","90","","90","","1360.3","1.2","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H22 B N Si -","- C12 H22 B N Si -","- C48 H88 B4 N4 Si4 -","4","1","","Ariffin, Azhar; Blake, Alexander J.; Ebden, Mark R.; Li, Wan-Sheung; Simpkins, Nigel S.; Fox, David N. A.","The diastereoselective and enantioselective substitution reactions of an isoindoline–borane complex","Journal of the Chemical Society, Perkin Transactions 1","1999","","17","2439","","10.1039/a904788c","","","0.71073","MoKα","","0.0643","0.0563","","","0.134","0.143","","","","","","1.03","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213133","8.639","0.003","7.619","0.004","9.731","0.004","90","","97.22","0.03","90","","635.4","0.5","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H18 I N -","- C12 H18 I N -","- C24 H36 I2 N2 -","2","1","","Ariffin, Azhar; Blake, Alexander J.; Ebden, Mark R.; Li, Wan-Sheung; Simpkins, Nigel S.; Fox, David N. A.","The diastereoselective and enantioselective substitution reactions of an isoindoline–borane complex","Journal of the Chemical Society, Perkin Transactions 1","1999","","17","2439","","10.1039/a904788c","","","0.71073","MoKα","","0.0127","0.0125","","","0.0317","0.0318","","","","","","1.085","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213134","5.3646","0.0005","13.6245","0.0014","22.377","0.002","90","","90","","90","","1635.5","0.3","220","2","220","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C11 H7 N O -","- C11 H7 N O -","- C88 H56 N8 O8 -","8","1","","McNab, Hamish; Parsons, Simon; Stevenson, Elizabeth","Pyrolytic cascades: a convenient entry to 5H-pyrrolo[2,1-a]isoindol-5-ones and related heterocyclic systems","Journal of the Chemical Society, Perkin Transactions 1","1999","","15","2047","","10.1039/a904885e","","","1.54178","CuKα","","0.0442","0.0357","","0.0964","0.0906","","","","1.026","1.063","1.063","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213135","13.055","0.004","5.5116","0.0014","21.84","0.005","90","","90","","90","","1571.5","0.7","220","2","220","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C10 H6 N2 O -","- C10 H6 N2 O -","- C80 H48 N16 O8 -","8","2","","McNab, Hamish; Parsons, Simon; Stevenson, Elizabeth","Pyrolytic cascades: a convenient entry to 5H-pyrrolo[2,1-a]isoindol-5-ones and related heterocyclic systems","Journal of the Chemical Society, Perkin Transactions 1","1999","","15","2047","","10.1039/a904885e","","","1.54178","CuKα","","0.0411","0.0343","","","0.0866","0.0909","","","","","","1.059","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213136","9.497","0.001","8.421","0.001","10.087","0.001","90","","95.91","0.01","90","","802.41","0.15","294","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H18 O4 -","- C20 H18 O4 -","- C40 H36 O8 -","2","0.5","","Lindemann, Ute; Neuburger, Markus; Neuburger-Zehnder, Margareta; Wulff-Molder, Dirk; Wessig, Pablo","Photoinduced diastereoselective pinacolisation of 4-oxo-4-phenylbutanamides to 4,5-dihydroxy-4,5-diphenyloctanediamides","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2029","","10.1039/a905040j","","","0.71069","MoKα","","0.0371","0.0324","","0.0818","0.0792","","","","1.123","1.153","1.153","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213137","10.118","0.001","10.114","0.002","11.853","0.001","90","","104.2","0.3","90","","1175.9","1.6","298","","298","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H32 N2 O4 -","- C26 H32 N2 O4 -","- C52 H64 N4 O8 -","2","1","","Lindemann, Ute; Neuburger, Markus; Neuburger-Zehnder, Margareta; Wulff-Molder, Dirk; Wessig, Pablo","Photoinduced diastereoselective pinacolisation of 4-oxo-4-phenylbutanamides to 4,5-dihydroxy-4,5-diphenyloctanediamides","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2029","","10.1039/a905040j","","","1.54178","CuKα","","","0.04","","","0.0482","","","","","0.9783","0.9783","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213138","31.695","0.002","31.695","0.002","7.7985","0.0007","90","","90","","120","","6784.6","0.9","296.7","","293","","","","","","","","","3","R -3 :H","-R 3","148","","","","- C20 H16 N2 -","- C20 H16 N2 -","- C360 H288 N36 -","18","1","","Tsue, Hirohito; Fujinami, Hideyuki; Itakura, Takeshi; Tsuchiya, Ryuta; Kobayashi, Kimiko; Takahashi, Hiroki; Hirao, Ken-ichi","8,8′-Dialkyl-1,1′-biisoquinolines: preparation, absolute configuration and unexpected racemization behaviour †","Journal of the Chemical Society, Perkin Transactions 1","1999","","24","3677","","10.1039/a905161i","","","0.7107","MoKα","","0.044","0.044","","","0.041","0.041","","","2.1","","","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213139","21.343","0.003","20.316","0.002","7.5398","0.0007","90","","90","","90","","3269.3","0.6","296.7","","296.7","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C22 H20 N2 -","- C22 H20 N2 -","- C176 H160 N16 -","8","1","","Tsue, Hirohito; Fujinami, Hideyuki; Itakura, Takeshi; Tsuchiya, Ryuta; Kobayashi, Kimiko; Takahashi, Hiroki; Hirao, Ken-ichi","8,8′-Dialkyl-1,1′-biisoquinolines: preparation, absolute configuration and unexpected racemization behaviour †","Journal of the Chemical Society, Perkin Transactions 1","1999","","24","3677","","10.1039/a905161i","","","0.7107","MoKα","","0.0367","0.0367","","0.0596","0.0466","0.0466","","","1.165","","","1.226","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213140","12.291","0.004","11.696","0.002","13.693","0.003","90","0.013","96.95","0.02","90","0.02","1954","0.8","293","2","293","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C20 H21 Cl O4 S -","- C20 H21 Cl O4 S -","- C80 H84 Cl4 O16 S4 -","4","1","","McCarthy, Daniel G.; Collins, Cornelius C.; O’Driscoll, Joan P.; Lawrence, Simon E.","Lewis acid mediated elimination and rearrangement reactions of α-chlorosulfides derived from phenylthio-substituted 4,5-dihydrofuran-3(2H )-ones.","Journal of the Chemical Society, Perkin Transactions 1","1999","","24","3667","","10.1039/a905169d","","","0.71069","MoKα","","0.0603","0.0355","","0.0968","0.0888","","","","1.034","1.164","1.164","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213141","5.9199","0.0019","16.419","0.005","18.436","0.005","90","","93.33","0.03","90","","1788.9","0.9","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 O4 S -","- C20 H20 O4 S -","- C80 H80 O16 S4 -","4","1","","McCarthy, Daniel G.; Collins, Cornelius C.; O’Driscoll, Joan P.; Lawrence, Simon E.","Lewis acid mediated elimination and rearrangement reactions of α-chlorosulfides derived from phenylthio-substituted 4,5-dihydrofuran-3(2H )-ones.","Journal of the Chemical Society, Perkin Transactions 1","1999","","24","3667","","10.1039/a905169d","","","0.71069","MoKα","","0.1625","0.0605","","","0.1038","0.1221","","","","","","0.892","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213142","7.265","0.0006","12.408","0.002","14.529","0.002","90","","96.35","0.013","90","","1301.7","0.3","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C8 H14 N8 O4 -","- C8 H14 N8 O4 -","- C32 H56 N32 O16 -","4","1","","Bethel, Paul A.; Hill, Michael S.; Mahon, Mary F.; Molloy, Kieran C.","Reactions of organotin tetrazoles: synthesis of functionalised poly-tetrazoles","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3507","","10.1039/a905336k","","","0.7093","","","0.0615","0.0404","","0.1836","0.1489","","","","1.244","1.391","1.391","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213143","24.513","0.002","24.513","0.002","7.035","0.001","90","","90","","90","","4227.2","0.8","293","2","293","2","","","","","","","","3","I 41 c d","I 4bw -2c","110","","","","- C10 H8 N8 -","- C10 H8 N8 -","- C160 H128 N128 -","16","1","","Bethel, Paul A.; Hill, Michael S.; Mahon, Mary F.; Molloy, Kieran C.","Reactions of organotin tetrazoles: synthesis of functionalised poly-tetrazoles","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3507","","10.1039/a905336k","","","0.71069","MoKα","","0.0664","0.0427","","0.1024","0.0907","","","","1.092","1.142","1.142","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213144","15.959","0.003","11.37","0.002","8.974","0.001","90","","102.82","0.01","90","","1587.8","0.4","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H12 Br2 N8 -","- C12 H12 Br2 N8 -","- C48 H48 Br8 N32 -","4","0.5","","Bethel, Paul A.; Hill, Michael S.; Mahon, Mary F.; Molloy, Kieran C.","Reactions of organotin tetrazoles: synthesis of functionalised poly-tetrazoles","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3507","","10.1039/a905336k","","","0.71069","MoKα","","0.1044","0.0674","","0.1678","0.1566","","","","1.231","1.452","1.452","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213145","7.112","0.001","10.489","0.001","10.681","0.001","65.4","0.01","76.58","0.01","73.05","0.01","687.35","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H22 N8 S6 -","- C23 H14 N8 S6 -","- C23 H14 N8 S6 -","1","0.5","","Ranganathan, Anupama; Pedireddi, V. R.; Chatterjee, Swati; Rao, C. N. R.","An organic channel structure formed by the supramolecular assembly of trithiocyanuric acid and 4,4′‐bipyridyl","Journal of Materials Chemistry","1999","9","10","2407","","10.1039/a905344a","","","0.71073","MoKα","","0.0885","0.0626","","0.2136","0.1828","","","","1.446","1.453","1.453","","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213146","7.282","0.001","10.621","0.001","10.648","0.001","66.3","0.01","76.53","0.01","70.42","0.01","705.86","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H24 N8 S6 -","- C24 H14 N8 S6 -","- C24 H14 N8 S6 -","1","0.5","","Ranganathan, Anupama; Pedireddi, V. R.; Chatterjee, Swati; Rao, C. N. R.","An organic channel structure formed by the supramolecular assembly of trithiocyanuric acid and 4,4′‐bipyridyl","Journal of Materials Chemistry","1999","9","10","2407","","10.1039/a905344a","","","0.71073","MoKα","","0.0771","0.0669","","0.2018","0.1843","","","","1.031","1.027","1.027","","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213147","10.324","0.001","11.615","0.001","12.319","0.001","102.16","0.01","93.46","0.01","90.68","0.01","1441","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C24 H24 N8 S6 -","- C24 H14 N8 S6 -","- C48 H28 N16 S12 -","2","1","","Ranganathan, Anupama; Pedireddi, V. R.; Chatterjee, Swati; Rao, C. N. R.","An organic channel structure formed by the supramolecular assembly of trithiocyanuric acid and 4,4′‐bipyridyl","Journal of Materials Chemistry","1999","9","10","2407","","10.1039/a905344a","","","0.71073","MoKα","","0.157","0.0818","","0.2548","0.2189","","","","1.125","1.432","1.432","","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213148","13.656","0.005","20.254","0.004","12.638","0.004","104.75","0.02","116.18","0.03","81.57","0.02","3031.2","1.8","173.5","","","","","","","","","","","6","P -1","-P 1","2","","","","- C36 H42 Br2 Cl3 I S24 -","- C36 Br2 Cl3 I S24 -","- C72 Br4 Cl6 I2 S48 -","2","1","","Akutagawa, Tomoyuki; Abe, Yukako; Hasegawa, Tatsuo; Nakamura, Takayoshi; Inabe, Tamotsu; Sugiura, Ken­ich; Sakata, Yoshiteru; Christensen, Christian A.; Lau, Jesper; Becher, Jan","Crystal structures and optical properties of cation radical salts of a tetrathiafulvalene trisannulated macrocycle","Journal of Materials Chemistry","1999","9","11","2737","","10.1039/a905362j","","","0.7107","MoKα","","","0.079","","","0.0878","","","","3.506","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213149","13.653","0.002","20.303","0.003","12.677","0.001","104.622","0.01","116.501","0.007","81.65","0.01","3040.8","0.7","196.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C39 H42 Cl3 I3 S24 -","- C36 Cl3 I3 S24 -","- C72 Cl6 I6 S48 -","2","1","","Akutagawa, Tomoyuki; Abe, Yukako; Hasegawa, Tatsuo; Nakamura, Takayoshi; Inabe, Tamotsu; Sugiura, Ken­ich; Sakata, Yoshiteru; Christensen, Christian A.; Lau, Jesper; Becher, Jan","Crystal structures and optical properties of cation radical salts of a tetrathiafulvalene trisannulated macrocycle","Journal of Materials Chemistry","1999","9","11","2737","","10.1039/a905362j","","","0.7107","MoKα","","","0.0073","","","0.0793","","","","1.69","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213150","6.663","0.004","11.047","0.003","15.062","0.008","68.89","0.04","87.16","0.05","80.26","0.03","1019.3","0.9","295","","295","","","","","","","","direct synthesis by lithiation of 3-methylfuran followed by reaction with diadamantyl ketone and separation from the 4-methylfuranyl derivative by chromatography and crystallization","3","P -1","-P 1","2","","anti[2-(3-methylfuranyl)]di(1-adamantyl)methanol","","- C26 H36 O2 -","- C26 H36 O2 -","- C52 H72 O4 -","2","1","","Lomas, John S.; Lacroix, Jean-Christophe; Vaissermann, Jacqueline","Rotation barriers in aryl- and heteroaryldi(1-adamantyl)methyl systems; the ionic hydrogenation of heteroaryldi(1-adamantyl)methanols","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2001","","10.1039/a905455c","","","0.71069","MoKα","","","0.0734","","","0.0846","","","","","1.1759","1.1759","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213151","13.0923","0.0002","14.2717","0.0002","14.2197","0.0001","90","","90.308","0.001","90","","2656.9","0.06","298","2","293","2","","","","","","","","6","P 1 n 1","P -2yac","7","","","","- C12 H52 N8 O43 P10 Zn12 -","- C12 H24 N8 O42.378 P10 Zn12 -","- C24 H48 N16 O84.756 P20 Zn24 -","2","1","","Vaidhyanathan, R.; Natarajan, Srinivasan; Rao, C. N. R.","Unusual dual role of the organic amine in an open­framework structure","Journal of Materials Chemistry","1999","9","11","2789","","10.1039/a905506a","","","0.71073","MoKα","","0.0397","0.0372","","0.1115","0.1023","","","","1.165","1.095","1.095","","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213152","12.0573","0.0014","14.6746","0.0017","34.231","0.004","90","","90","","90","","6056.7","1.2","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C64 H76 Cl N14 Na O5 -","- C64 H71 Cl N14 Na O5 -","- C256 H284 Cl4 N56 Na4 O20 -","4","1","","Govenlock, Linda J.; Howard, Judith A. K.; Moloney, Janet M.; Parker, David; Peacock, Robert D.; Siligardi, Giuliano","Chiroptical features and luminescence behaviour of macrocyclic tetra(4-quinolyl)-complexes: surprising absence of exciton coupling","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2415","","10.1039/a905512f","","","0.6875","synchrotronradiationatDaresburyLaboratory","","0.1243","0.1044","","","0.2813","0.2916","","","","","","1.092","","","","has coordinates,has disorder","180462","2020-10-21","18:00:00",""
"7213153","12.69","0.02","12.69","0.02","29.55","0.05","90","","90","","90","","4759","13","150","2","150","2","","","","","","","","6","P 41 21 2","P 4abw 2nw","92","","","","- C24 H23 Cr O4 P Si -","- C24 H23 Cr O4 P Si -","- C192 H184 Cr8 O32 P8 Si8 -","8","1","","Ariffin, Azhar; Blake, Alexander J.; Ewin, Richard A.; Li, Wan-Sheung; Simpkins, Nigel S.","The asymmetric synthesis of phosphorus- and sulfur-containing tricarbonyl(η6-arene)chromium complexes using the chiral base approach","Journal of the Chemical Society, Perkin Transactions 1","1999","","21","3177","","10.1039/a905610f","","","0.71073","MoKα","","0.0877","0.0536","","","0.095","0.1081","","","","","","1.16","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213154","10.82","0.002","11.206","0.002","14.618","0.002","75.33","0.02","86.12","0.02","78.6","0.02","1680.5","0.5","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H21 Cr O4 P -","- C28 H21 Cr O4 P -","- C56 H42 Cr2 O8 P2 -","2","1","","Ariffin, Azhar; Blake, Alexander J.; Ewin, Richard A.; Li, Wan-Sheung; Simpkins, Nigel S.","The asymmetric synthesis of phosphorus- and sulfur-containing tricarbonyl(η6-arene)chromium complexes using the chiral base approach","Journal of the Chemical Society, Perkin Transactions 1","1999","","21","3177","","10.1039/a905610f","","","0.71073","MoKα","","0.0568","0.0468","","","0.109","0.115","","","","","","1.12","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7213155","6.581","0.006","8.758","0.009","10.333","0.008","90","","93.88","0.08","90","","594.2","0.9","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H10 Cr O3 S -","- C12 H10 Cr O3 S -","- C24 H20 Cr2 O6 S2 -","2","1","","Ariffin, Azhar; Blake, Alexander J.; Ewin, Richard A.; Li, Wan-Sheung; Simpkins, Nigel S.","The asymmetric synthesis of phosphorus- and sulfur-containing tricarbonyl(η6-arene)chromium complexes using the chiral base approach","Journal of the Chemical Society, Perkin Transactions 1","1999","","21","3177","","10.1039/a905610f","","","0.71073","MoKα","","0.0287","0.0283","","","0.0777","0.0785","","","","","","1.127","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213156","7.19","0.008","8.08","0.004","12.279","0.012","90","","102.4","0.09","90","","696.7","1.1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H10 N2 O2 -","- C7 H10 N2 O2 -","- C28 H40 N8 O8 -","4","1","","Bellouard, Frédéric; Chuburu, Françoise; Kervarec, Nelly; Toupet, Loïc; Triki, Smaïl; Le Mest, Yves; Handel, Henri","cis-Diprotected cyclams and cyclens: a new route to symmetrically or asymmetrically 1,4-disubstituted tetraazamacrocycles and to asymmetrically tetrasubstituted derivatives","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3499","","10.1039/a905701c","","","0.71069","MoKα","","0.2322","0.0775","","","0.181","0.2392","","","","","","0.973","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213157","13.465","0.003","12.608","0.004","14.504","0.003","90","","116.85","0.03","90","","2196.8","1.1","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C24 H32 N4 O3 -","- C24 H30 N4 O2.5 -","- C96 H120 N16 O10 -","4","1","","Bellouard, Frédéric; Chuburu, Françoise; Kervarec, Nelly; Toupet, Loïc; Triki, Smaïl; Le Mest, Yves; Handel, Henri","cis-Diprotected cyclams and cyclens: a new route to symmetrically or asymmetrically 1,4-disubstituted tetraazamacrocycles and to asymmetrically tetrasubstituted derivatives","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3499","","10.1039/a905701c","","","0.71069","MoKα","","0.1005","0.0494","","","0.1304","0.1505","","","","","","1.035","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7213158","9.785","0.001","27.604","0.003","10.306","0.001","90","0.02","91.55","0.02","90","0.02","2782.7","0.5","294","","294","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C24 H36 Cl2 N4 Ni O8 -","- C24 H36 Cl2 N4 Ni O8 -","- C96 H144 Cl8 N16 Ni4 O32 -","4","1","","Bellouard, Frédéric; Chuburu, Françoise; Kervarec, Nelly; Toupet, Loïc; Triki, Smaïl; Le Mest, Yves; Handel, Henri","cis-Diprotected cyclams and cyclens: a new route to symmetrically or asymmetrically 1,4-disubstituted tetraazamacrocycles and to asymmetrically tetrasubstituted derivatives","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3499","","10.1039/a905701c","","","0.71073","Mo-Kα","","0.246","0.054","","0.396","","0.061","","","8.999","","","1.083","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213159","18.4545","0.0001","10.9939","0.0001","23.0803","0.0003","90","","112.43","","90","","4328.43","0.07","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H21 Ge N O12 S16 -","- C33 H21 Ge N O12 S16 -","- C132 H84 Ge4 N4 O48 S64 -","4","1","","Martin, Lee; Turner, Scott S.; Day, Peter; Guionneau, Philippe; Howard, Judith A. K.; Uruichi, Mikio; Yakushi, Kyuya","Synthesis, crystal structure and properties of the semiconducting molecular charge‐transfer salt (bedt‐ttf)2Ge(C2O4)3ṡPhCN [bedt-ttf=bis(ethylenedithio)tetrathiafulvalene]","Journal of Materials Chemistry","1999","9","11","2731","","10.1039/a905723d","","","0.71073","MoKα","","0.1376","0.077","","","0.1879","0.2282","","","","","","0.928","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213160","18.7332","0.0006","11.0665","0.0003","23.0587","0.0007","90","","112.504","0.001","90","","4416.3","0.2","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C33 H21 Ge N O12 S16 -","- C33 H21 Ge N O12 S16 -","- C132 H84 Ge4 N4 O48 S64 -","4","1","","Martin, Lee; Turner, Scott S.; Day, Peter; Guionneau, Philippe; Howard, Judith A. K.; Uruichi, Mikio; Yakushi, Kyuya","Synthesis, crystal structure and properties of the semiconducting molecular charge‐transfer salt (bedt‐ttf)2Ge(C2O4)3ṡPhCN [bedt-ttf=bis(ethylenedithio)tetrathiafulvalene]","Journal of Materials Chemistry","1999","9","11","2731","","10.1039/a905723d","","","0.71073","MoKα","","0.2701","0.1071","","0.2985","0.2345","","","","1.179","1.661","1.661","","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213161","8.5328","0.0012","8.5328","0.0012","33.241","0.007","90","","90","","120","","2096","0.6","120","2","120","2","","","","","","","","5","P 3 c 1","P 3 -2""c","158","","","","- C15 H39 Br N4 O4 -","- C15 H39.01 Br N4 O4 -","- C60 H156.04 Br4 N16 O16 -","4","0.666667","","Springborg, Johan; Nielsen, Bente; Olsen, Carl Erik; Søtofte, Inger","Synthesis and crystal structure of the bromide salt of the inside protonated form of the cage amine [(2.3)3]adamanzane, 1,4,8,12-tetraazatricyclo[6.6.3.24,12]nonadecane and synthesis of the bowl amine [(2.3)2.21]adamanzane, 1,5,9,12-tetraazabicyclo[7.5.2]hexadecane","Journal of the Chemical Society, Perkin Transactions 2","1999","","12","2701","","10.1039/a906244k","","","0.71073","MoKα","","0.1178","0.0695","","0.1622","0.1333","","","","1.096","1.153","1.153","","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213162","14.95","0.009","8.946","0.002","17.391","0.004","90","","90.49","0.03","90","","2325.8","1.6","570","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H24 N2 O3 S -","- C26 H24 N2 O3 S -","- C104 H96 N8 O12 S4 -","4","1","","Bennett, Simon M. W.; Brown, Stephen M.; Conole, Gráinne; Dennis, Michael R.; Fraser, Paul K.; Radojevic, Sanja; McPartlin, Mary; Topping, Chris M.; Woodward, Simon","Catalytic conjugate addition promoted by the copper(I)-monothiobinaphthol system. Part 3. Comparison of three thiolate-based catalytic systems","Journal of the Chemical Society, Perkin Transactions 1","1999","","21","3127","","10.1039/a906373k","","","0.71073","MoKα","","0.1885","0.0747","","","0.1387","0.1749","","","","","","0.939","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213163","10.237","0.002","10.977","0.002","13.598","0.003","100.67","0.03","109.1","0.03","90.4","0.03","1415.2","0.6","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H41 F3 O2 Si5 -","- C20 H41 F3 O2 Si5 -","- C40 H82 F6 O4 Si10 -","2","1","","Berry, Malcolm B.; Griffiths, Russell J.; Howard, Judith A. K.; Leech, Michael A.; Steel, Patrick G.; Yufit, Dmitrii S.","Reactions of acylpolysilanes with silyl Lewis acids","Journal of the Chemical Society, Perkin Transactions 1","1999","","24","3645","","10.1039/a906377c","","","0.71073","MoKα","","0.0378","0.0316","","","0.0847","0.0903","","","","","","1.042","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213164","11.4859","0.0008","9.025","0.001","16.407","0.001","90","","96.647","0.006","90","","1689.3","0.2","123","","123","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H18 N2 O2 S2 -","- C18 H18 N2 O2 S2 -","- C72 H72 N8 O8 S8 -","4","1","","Koizumi, Toshio; Bashir, Nadeem; Kennedy, Alan R.; Murphy, John A.","Diazadithiafulvalenes as electron donor reagents","Journal of the Chemical Society, Perkin Transactions 1","1999","","24","3637","","10.1039/a906684e","","","0.71069","MoKalpha","","0.1221","0.0471","","0.0653","0.057","","","","","1.57","1.57","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213165","11.639","0.004","6.617","0.004","13.03","0.008","90","","92.439","0.004","90","","1002.6","0.9","298","","298","","","","","","","","see paper","5","P 1 21 1","P 2yb","4","","","","- C21 H24 I N O2 -","- C21 H24 I N O2 -","- C42 H48 I2 N2 O4 -","2","1","","Davies, Stephen G.; Smyth, G. Darren; Chippindale, Ann M.","Syntheses of derivatives of L-daunosamine and its C-3 epimer employing as the key step the asymmetric conjugate addition of a homochiral lithium amide to tert-butyl (E,E )-hexa-2,4-dienoate","Journal of the Chemical Society, Perkin Transactions 1","1999","","21","3089","","10.1039/a907017f","","","0.71073","MoKα","","","0.0266","","","0.0293","","","","","1.0983","1.0983","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213166","8.886","0.004","13.659","0.006","10.369","0.006","90","","98.05","0.04","90","","1246.1","1.1","295","2","295","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Alboatrin","","","- C14 H18 O3 -","- C14 H18 O3 -","- C56 H72 O12 -","4","1","","Graham, Stephen R.; Murphy, John A.; Kennedy, Alan R.","Hypophosphite mediated carbon–carbon bond formation: total synthesis of epialboatrin and structural revision of alboatrin","Journal of the Chemical Society, Perkin Transactions 1","1999","","21","3071","","10.1039/a907032j","","","0.71069","MoKα","","0.0868","0.0528","","","0.1335","0.1495","","","","","","1.034","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213167","6.341","0.001","11.558","0.001","21.415","0.004","90","","90","","90","","1569.5","0.4","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","2-(tropan-3-yl)-1-para-methoxyphenyl-1-ethanone hydrochloride","","- C17 H24 Cl N O2 -","- C17 H24 Cl N O2 -","- C68 H96 Cl4 N4 O8 -","4","1","","Tavasli, Mustafa; O’Hagan, David; Batsanov, Andrei S.; Foxon, Graham R.; Halliwell, Robert F.; Howard, Judith A. K.","The synthesis, conformation and antimuscarinic properties of ketone analogues of tropane esters","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3455","","10.1039/a907130j","","","0.71073","MoKα","","0.0481","0.037","","","0.0806","0.0855","","","","","","1.056","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213168","18.514","0.002","7.606","0.002","12.166","0.001","90","","105.58","0.01","90","","1650.2","0.5","293.2","","293.2","","","","","","","","-","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H21 N O -","- C21 H21 N O -","- C84 H84 N4 O4 -","4","1","","Hunt, James C. A.; Lloyd, Cephas; Moody, Christopher J.; Slawin, Alexandra M. Z.; Takle, Andrew K.","Chiral oxime ethers in asymmetric synthesis. Part 4. Asymmetric synthesis of N-protected amines and β-amino acids by the addition of organometallic reagents to ROPHy/SOPHy-derived aldoximes","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3443","","10.1039/a907186e","","","1.5418","CuKα","","0.0465","0.0465","","0.0352","","0.0352","","","4.502","","","4.502","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213169","9.087","0.003","7.841","0.004","10.648","0.003","90","","111.95","0.02","90","","703.7","0.5","293.2","","293.2","","","","","","","","-","5","P 1 21 1","P 2yb","4","","","","- C14 H16 N2 O S -","- C14 H16 N2 O S -","- C28 H32 N4 O2 S2 -","2","1","","Hunt, James C. A.; Lloyd, Cephas; Moody, Christopher J.; Slawin, Alexandra M. Z.; Takle, Andrew K.","Chiral oxime ethers in asymmetric synthesis. Part 4. Asymmetric synthesis of N-protected amines and β-amino acids by the addition of organometallic reagents to ROPHy/SOPHy-derived aldoximes","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3443","","10.1039/a907186e","","","1.5418","CuKα","","0.0386","0.0386","","0.0254","","0.0254","","","2.836","","","2.836","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213170","11.761","0.002","19.813","0.003","23.024","0.003","90","","90","","90","","5365.1","1.4","295","2","295","2","","","","","","","See manuscript","5","P b c a","-P 2ac 2ab","61","","","","- C29 H35 O3 P Si -","- C29 H35 O3 P Si -","- C232 H280 O24 P8 Si8 -","8","1","","Feeder, Neil; Hutton, Gordon; Nelson, Adam; Warren, Stuart","Stereoselective intramolecular acylation of γ′-benzoyloxyphosphine oxides with an internal chlorotrimethylsilane trap: isolation of silylated tetrahedral intermediates","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3413","","10.1039/a907320e","","","0.71073","MoKα","","0.1928","0.0558","","0.1692","0.1123","","","","0.967","1.084","1.084","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213171","18.753","0.004","8.349","0.002","18.019","0.004","90","","111.75","0.03","90","","2620.4","1.2","295","2","295","2","","","","","","","See manuscript","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H33 O3 P Si -","- C27 H33 O3 P Si -","- C108 H132 O12 P4 Si4 -","4","1","","Feeder, Neil; Hutton, Gordon; Nelson, Adam; Warren, Stuart","Stereoselective intramolecular acylation of γ′-benzoyloxyphosphine oxides with an internal chlorotrimethylsilane trap: isolation of silylated tetrahedral intermediates","Journal of the Chemical Society, Perkin Transactions 1","1999","","23","3413","","10.1039/a907320e","","","0.71073","MoKα","","0.0947","0.0449","","0.1305","0.1102","","","","1.032","1.133","1.133","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213172","9.366","0.001","16.003","0.002","7.598","0.001","90","","90","","90","","1138.8","0.2","120","2","120","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","N-fluoroacetyl-(S)-phenylalanine","","- C11 H12 F N O3 -","- C11 H12 F N O3 -","- C44 H48 F4 N4 O12 -","4","1","","Banks, John W.; Batsanov, Andrei S.; Howard, Judith A. K.; O’Hagan, David; Rzepa, Henry S.; Martin-Santamaria, Sonsoles","The preferred conformation of α-fluoroamides","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2409","","10.1039/a907452j","","","0.71073","MoKα","","0.0335","0.0317","","0.0803","0.0784","","","","1.097","1.099","1.099","","","","","has coordinates,has disorder","301864","2025-08-22","15:14:31",""
"7213173","5.754","0.002","8.139","0.002","24.873","0.002","90","","90","","90","","1164.8","0.5","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-propionyl-(S)-phenylalanine","","- C12 H15 N O3 -","- C12 H15 N O3 -","- C48 H60 N4 O12 -","4","1","","Banks, John W.; Batsanov, Andrei S.; Howard, Judith A. K.; O’Hagan, David; Rzepa, Henry S.; Martin-Santamaria, Sonsoles","The preferred conformation of α-fluoroamides","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2409","","10.1039/a907452j","","","1.54184","CuKα","","0.0467","0.0358","","0.1189","0.0786","","","","1.065","1.071","1.071","","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213174","5.367","0.001","8.821","0.004","9.893","0.003","106.65","0.02","101.84","0.02","105.13","0.02","412.8","0.3","150","2","150","2","","","","","","","","5","P 1","P 1","1","","N-phenyl-2-(S)-fluoropropionamide with ca. 10% of N-phenyl-2-(R)-fluoropropionamide","","- C9 H10 F N O -","- C9 H10 F N O -","- C18 H20 F2 N2 O2 -","2","2","","Banks, John W.; Batsanov, Andrei S.; Howard, Judith A. K.; O’Hagan, David; Rzepa, Henry S.; Martin-Santamaria, Sonsoles","The preferred conformation of α-fluoroamides","Journal of the Chemical Society, Perkin Transactions 2","1999","","11","2409","","10.1039/a907452j","","","1.54184","CuKα","","0.0492","0.0431","","0.1536","0.1122","","","","1.092","1.098","1.098","","","","","has coordinates,has disorder","301864","2025-08-22","15:14:31",""
"7213175","37.76","0.04","5.74","0.006","10.91","0.012","90","","98.24","0.01","90","","2340","4","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C21 H26 N2 O8 -","- C21 H26 N2 O8 -","- C84 H104 N8 O32 -","4","1","","Hodgson, David M.; Gibbs, Andrew R.; Drew, Michael G. B.","Mechanism and applications of lithium amide-induced asymmetric rearrangements of 4-substituted and 4,4-disubstituted cyclopentene oxides to cyclopentenols","Journal of the Chemical Society, Perkin Transactions 1","1999","","24","3579","","10.1039/a907522d","","","0.71073","MoKα","","0.0923","0.0737","","","0.1831","0.2048","","","","","","1.012","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213178","7.5589","0.0008","9.3566","0.0015","9.4213","0.0009","90","","96.521","0.008","90","","662.02","0.14","293","2","294","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H16 Cl N O2 -","- C14 H16 Cl N O2 -","- C28 H32 Cl2 N2 O4 -","2","1","","Tähtinen, Petri; Sillanpää, Reijo; Stájer, Géza; Szabó, Angela E.; Pihlaja, Kalevi","NMR and X-ray structural study of saturated ( p-chlorophenyl)pyrrolo[1,2-a][3,1]benzoxazin-1-ones prepared from aroylisobutyric acid and cyclic amino alcohols. High energy barriers for hindered rotation of bridgehead phenyl groups","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2011","","10.1039/a905445f","","","0.71069","MoKα","","0.0355","0.027","","","0.0611","0.0643","","","","","","1.072","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213179","26.623","0.002","11.443","0.003","10.698","0.002","90","","90","","90","","3259.1","1.1","294","2","294","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C18 H22 Cl N O2 -","- C18 H22 Cl N O2 -","- C144 H176 Cl8 N8 O16 -","8","1","","Tähtinen, Petri; Sillanpää, Reijo; Stájer, Géza; Szabó, Angela E.; Pihlaja, Kalevi","NMR and X-ray structural study of saturated ( p-chlorophenyl)pyrrolo[1,2-a][3,1]benzoxazin-1-ones prepared from aroylisobutyric acid and cyclic amino alcohols. High energy barriers for hindered rotation of bridgehead phenyl groups","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2011","","10.1039/a905445f","","","0.71069","MoKα","","0.1465","0.0526","","","0.0968","0.1184","","","","","","1.024","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213180","8.941","0.004","12.749","0.004","15.113","0.003","90","","105.06","0.02","90","","1663.5","1","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H20 Cl N O2 -","- C18 H20 Cl N O2 -","- C72 H80 Cl4 N4 O8 -","4","1","","Tähtinen, Petri; Sillanpää, Reijo; Stájer, Géza; Szabó, Angela E.; Pihlaja, Kalevi","NMR and X-ray structural study of saturated ( p-chlorophenyl)pyrrolo[1,2-a][3,1]benzoxazin-1-ones prepared from aroylisobutyric acid and cyclic amino alcohols. High energy barriers for hindered rotation of bridgehead phenyl groups","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2011","","10.1039/a905445f","","","0.71069","MoKα","","0.1232","0.0534","","","0.1221","0.1483","","","","","","1.015","","","","has coordinates","180462","2020-10-21","18:00:00",""
"7213181","8.754","0.009","16.647","0.004","11.575","0.002","90","","103.47","0.03","90","","1640.4","1.8","293","2","294","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H20 Cl N O2 -","- C19 H20 Cl N O2 -","- C76 H80 Cl4 N4 O8 -","4","1","","Tähtinen, Petri; Sillanpää, Reijo; Stájer, Géza; Szabó, Angela E.; Pihlaja, Kalevi","NMR and X-ray structural study of saturated ( p-chlorophenyl)pyrrolo[1,2-a][3,1]benzoxazin-1-ones prepared from aroylisobutyric acid and cyclic amino alcohols. High energy barriers for hindered rotation of bridgehead phenyl groups","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2011","","10.1039/a905445f","","","0.71069","MoKα","","0.1049","0.0455","","","0.0995","0.1202","","","","","","1.021","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7213182","8.64","0.004","10.747","0.002","17.657","0.0016","90","","90.853","0.017","90","","1639.3","0.8","294","2","294","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 Cl N O2 -","- C19 H20 Cl N O2 -","- C76 H80 Cl4 N4 O8 -","4","1","","Tähtinen, Petri; Sillanpää, Reijo; Stájer, Géza; Szabó, Angela E.; Pihlaja, Kalevi","NMR and X-ray structural study of saturated ( p-chlorophenyl)pyrrolo[1,2-a][3,1]benzoxazin-1-ones prepared from aroylisobutyric acid and cyclic amino alcohols. High energy barriers for hindered rotation of bridgehead phenyl groups","Journal of the Chemical Society, Perkin Transactions 2","1999","","10","2011","","10.1039/a905445f","","","0.71069","MoKα","","0.085","0.0392","","","0.0827","0.0964","","","","","","1.02","","","","has coordinates","301864","2025-08-22","15:14:31",""
"7214216","8.1784","0.0006","8.1784","0.0006","8.1784","0.0006","90","","90","","90","","547.02","0.07","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","Lithium Manganese Oxide (1.14/1.86/4)","","- Li1.14 Mn1.86 O4 -","- Li1.14 Mn1.86 O4 -","- Li9.12 Mn14.88 O32 -","8","0.0416667","","Berg, H.; Kelder, E. M.; Thomas, J. O.","Neutron diffraction study of stoichiometric spinel Li1+x Mn2-x O4 showing octahedral 16c-site Li-occupation","Journal of Materials Chemistry","1999","9","","427","429","10.1039/a804851g","","","","","","0.054","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"7217098","6.377","0.009","6.3842","0.0001","25.357","0.009","90","","90","","90","","1032.3","1.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- O56 P8 Pb4 V8 -","- O56 P8 Pb4 V8 -","- O56 P8 Pb4 V8 -","1","0.25","","Le Fur, E.; Pivan, J. Y.","Synthesis, crystal structure and magnetic properties of the novel stacking variant lamellar lead oxovanadium phosphate hydrate β‐Pb(VOPO4)2ṡ4H2O. Crystal chemical relationships with related intercalated M(VOPO4)2ṡyH2O compounds","Journal of Materials Chemistry","1999","9","10","2589","","10.1039/a901048c","","","0.71073","MoKα","","0.0424","0.0307","","","0.0813","0.0877","","","","","","1.063","","","","has coordinates","180501","2020-10-21","18:00:00",""
"7217099","17.479","0.002","6.758","0.001","8.019","0.001","90","","102.01","0.01","90","","926.5","0.2","293","","293","","","","","","","","Solid state chemistry","4","C 1 2/c 1","-C 2yc","15","","","","- K O12 P3 U2 -","- K1.002 O12 P3 U2 -","- K4.008 O48 P12 U8 -","4","0.5","","Guesdon, Anne; Provost, Jackie; Raveau, Bernard","New thorium and uranium monophosphates in the KTh2(PO4)3 family: structure and cationic non‐stoichiometry","Journal of Materials Chemistry","1999","9","10","2583","","10.1039/a904121d","","","0.71073","Mo-Kα","","0.038","0.038","","0.036","0.036","","","","1.849","1.849","1.849","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7217100","16.134","0.003","8.2407","0.0016","22.86","0.005","90","","104.05","0.03","90","","2948.4","1.1","150","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C8 H28 N4 O26 P6 Zn7 -","- C8 H24 N4 O26 P6 Zn7 -","- C32 H96 N16 O104 P24 Zn28 -","4","0.5","","Kongshaug, Kjell Ove; Fjellvåg, Helmer; Lillerud, Karl Petter","The synthesis and crystal structure of a new open-framework zincophosphate UiO‐17","Journal of Materials Chemistry","1999","9","12","3119","","10.1039/a905886i","","","0.71073","MoKα","","0.0394","0.0344","","","0.0909","0.0932","","","","","","1.034","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217101","14.061","0.004","10.546","0.003","18.891","0.006","90","","99.29","0.02","90","","2764.6","1.4","295","","295","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H80 O16 Ti4 -","- C40 O16 Ti4 -","- C80 O32 Ti8 -","2","0.5","","Miele‐Pajot, Nathalie; Hubert-Pfalzgraf, Liliane G.; Papiernik, Renée; Vaissermann, Jacqueline; Collier, Rémy","Synthesis and molecular structure of [Ti4(OPri)8(μ,η2­OCH2CHCHCH2O)2(μ3,η2­OCH2CHCHCH2O)2]. Application to the elaboration of low density, microcellular, doped organic materials","Journal of Materials Chemistry","1999","9","12","3027","","10.1039/a904491d","","","0.71069","MoKα","","","0.084","","","0.0777","","","","","1.1032","1.1032","","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7217102","35.437","0.005","10.079","0.003","17.512","0.003","90","","106.65","0.01","90","","5993","2","293.2","","293.2","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C44 H72 N Ni S12 Se4 -","- C44 H72 N Ni S12 Se4 -","- C176 H288 N4 Ni4 S48 Se16 -","4","0.5","","Ueda, Kazumasa; Kamata, Yutaka; Iwamatsu, Masaki; Sugimoto, Toyonari; Fujita, Hideo","A neutral bis(diethylthiotetrathiafulvalenyldiselenolato)nickel complex: a superior organic conductor to the corresponding dithiolato derivative","Journal of Materials Chemistry","1999","9","12","2979","","10.1039/a905769b","","","1.5418","CuKα","","0.0647","0.0647","","","0.0976","0.0975","","","","","","1.979","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217103","7.686","0.003","11.454","0.004","11.617","0.005","76.59","0.02","80.25","0.02","84.48","0.03","978.7","0.7","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","4-ethoxycarbonyl-4',5,5'-trimethyltetrathiafulvalene 7,7,8,8-tetracyanoquinodimethane, 2:1 complex","","- C36 H32 N4 O4 S8 -","- C36 H32 N4 O4 S8 -","- C36 H32 N4 O4 S8 -","1","0.5","","Bryce, Martin R.; Moore, Adrian J.; Batsanov, Andrei S.; Howard, Judith A. K.; Petty, Michael C.; Williams, Geoffrey; Rotello, Vincent; Cuello, Alejandro","4-Ethoxycarbonyl-4′,5,5′-trimethyltetrathiafulvalene and its radical cation: Langmuir–Blodgett film studies, EPR spectra and the X-ray crystal structure of (Me3TTF-CO2Et)2·TCNQ complex","Journal of Materials Chemistry","1999","9","12","2973","","10.1039/a905364f","","","0.71073","MoKα","","0.0395","0.0364","","0.0989","0.0952","","","","1.078","1.084","1.084","","","","","has coordinates","301864","2025-08-22","15:14:36",""
"7217104","7.814","0.003","15.498","0.005","7.815","0.003","90","","92.911","0.015","90","","945.2","0.6","298","","298","","","","","","","","hydrothermal reaction","6","P 1 21 1","P 2yb","4","","","","- C3 H6 As3 N3 O13 Zn4 -","- C3 As3 N3 O13 Zn4 -","- C6 As6 N6 O26 Zn8 -","2","1","","Harrison, William T. A.; Phillips, Mark L. F.; Chavez, Alejandra V.; Nenoff, Tina M.","Syntheses and structures of the open­framework phases (CH3NH3)3·Zn4O(AsO4)3 and (CH3NH3)3·Zn4O(PO4)3 related to the M3Zn4O(XO4)3·nH2O family","Journal of Materials Chemistry","1999","9","12","3087","","10.1039/a906009j","","","0.71073","MoKα","","","0.0301","","","0.0398","","","","","0.2861","0.2861","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7217105","7.6569","0.0005","15.241","0.001","7.6589","0.0005","90","","92.74","0.001","90","","892.76","0.1","298","","298","","","","","","","","?","5","P 1 21 1","P 2yb","4","","","","- C3 N3 O13 P3 Zn4 -","- C3 N3 O13 P3 Zn4 -","- C6 N6 O26 P6 Zn8 -","2","1","","Harrison, William T. A.; Phillips, Mark L. F.; Chavez, Alejandra V.; Nenoff, Tina M.","Syntheses and structures of the open­framework phases (CH3NH3)3·Zn4O(AsO4)3 and (CH3NH3)3·Zn4O(PO4)3 related to the M3Zn4O(XO4)3·nH2O family","Journal of Materials Chemistry","1999","9","12","3087","","10.1039/a906009j","","","0.71073","MoKα","","","0.0807","","","0.096","","","","","2.0548","2.0548","","","","","has coordinates","189826","2020-10-21","18:00:00",""
"7217106","10.8294","0.0009","12.7465","0.0011","12.3971","0.0011","90","","95.115","0.002","90","","1704.4","0.3","298","2","298","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C7 H17 Fe2 N2 O16 P3 -","- C7 H17 Fe2 N2 O16 P3 -","- C28 H68 Fe8 N8 O64 P12 -","4","1","","Choudhury, Amitava; Natarajan, Srinivasan","A hybrid open‐framework structure: synthesis and structure of an iron phosphate oxalate, [C10N4H28][Fe2(HPO4)3(C2O4)]2","Journal of Materials Chemistry","1999","9","12","3113","","10.1039/a906663b","","","0.71073","MoKα","","0.0563","0.036","","0.0911","0.0825","","","","1.037","1.104","1.104","","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217107","9.648","0.005","20.874","0.005","17.8","0.003","90","","94.32","0.03","90","","3575","2","296","","296","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","2-(4H'-1'-benzothiopyran-4'-one-3'-ethenyl)-1,3,6-trimethylindolinum tetraphenylborate","","","- C46 H40 B N O S -","- C46 H40 B N O S -","- C184 H160 B4 N4 O4 S4 -","4","1","","Yagi, Shigeyuki; Maeda, Katsumi; Nakazumi, Hiroyuki","Photochromic properties of cationic merocyanine dyes. Thermal stability of the spiropyran form produced by irradiation with visible light","Journal of Materials Chemistry","1999","9","12","2991","","10.1039/a905098a","","","0.7107","MoKalpha","","0.078","0.078","","0.075","0.075","","","","","2.94","2.94","","","","","has coordinates","301864","2025-08-22","15:14:36",""
"7217108","19.431","0.013","10.867","0.006","27.55","0.02","90","","99.15","0.06","90","","5743","7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H101 O11 Y3 -","- C44 H99 O11 Y3 -","- C176 H396 O44 Y12 -","4","1","","Veith, Michael; Mathur, Sanjay; Kareiva, Aivaras; Jilavi, Mohammad; Zimmer, Michael; Huch, Volker","Low temperature synthesis of nanocrystalline Y3Al5O12 (YAG) and Ce-doped Y3Al5O12 via different sol‒gel methods","Journal of Materials Chemistry","1999","9","12","3069","","10.1039/a903664d","","","0.71073","MoKα","","0.2186","0.0965","","","0.14","0.1872","","","","","","1.181","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217109","10.468","0.007","13.484","0.003","5.7549","0.0011","90","","90","","90","","812.3","0.6","100","","100","","","","","","","","","3","P c c n","-P 2ab 2ac","56","N-aminopyrazole","1-aminopyrazole","","- C3 H5 N3 -","- C3 H5 N3 -","- C24 H40 N24 -","8","1","","Antonio Jime´nez, Jose´; María Claramunt, Rosa; Mó, Otilia; Yáñez, Manuel; Wehrmann, Frank; Buntkowsky, Gerd; Limbach, Hans-Heinrich; Goddard, Richard; Elguero, Jose´","The structure of N-aminopyrazole in the solid state and in solution: an experimental and computational study","Physical Chemistry Chemical Physics","1999","1","22","5113","","10.1039/a906187h","","","0.71069","MoKα","","0.0662","0.0575","","","0.1327","0.1438","","","","","","1.144","","","","has coordinates","301864","2025-08-22","15:14:36",""
"7217110","21.791","0.002","21.791","0.002","26.958","0.003","90","","90","","90","","12801","2","293","2","293","2","","","","","","","","6","P 4 c c","P 4 -2c","103","","sodium p-tert-butyl[25,26,27-28-tetrakis(2-pyridylmethyl)oxy] calix(4)arene monoacetonitrile perchlorate","","- C70 H79 Cl N5 Na O8 -","- C70 H40 Cl N5 Na O8 -","- C560 H320 Cl8 N40 Na8 O64 -","8","1","","Danil de Namor, Angela F.; Castellano, Eduardo E.; Pulcha Salazar, Lupe E.; Piro, Oscar E.; Jafou, Olga","Thermodynamics of cation (alkali-metal) complexation by 5,11,17,23-tetra-tert-butyl[25,26,27,28-tetrakis(2-pyridylmethyl)oxy]- calix(4)arene and the crystal structure‒superstructure of its 1:1 complex with sodium and acetonitrile","Physical Chemistry Chemical Physics","1999","1","2","285","","10.1039/a806902f","","","1.54184","CuKα","","0.137","0.1029","","0.3382","0.294","","","","1.067","1.214","1.214","","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217111","8.0254","0.0011","7.4851","0.0014","17.7967","0.0033","90","","90.98","0.02","90","","1068.9","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,3-bis(dimethylamino)-2,4-dihydroxy-cyclobutendiylium dihydroxide, bis(inner salt), dihydrate","","- C8 H16 N2 O4 -","- C8 H16 N2 O4 -","- C32 H64 N8 O16 -","4","1","","Lunelli, Bruno; Soave, Raffaella; Destro, Riccardo","Structure and stability of bis(dimethylamino)squaraine and its hydrates: A study using XRD, IR spectroscopy, and thermodynamic measurements","Physical Chemistry Chemical Physics","1999","1","7","1469","","10.1039/a808403c","","","0.71073","MoKa","","0.0706","0.0359","","0.097","0.0879","","","","0.877","1.084","1.084","","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217112","21.6397","0.0033","8.3029","0.001","7.1004","0.0007","90","","90","","90","","1275.7","0.3","293","2","293","2","","","","","","","","4","P b c n","-P 2n 2ab","60","","1,3-bis(dimethylamino)-2,4-dihydroxy-cyclobutendiylium dihydroxide, bis(inner salt), tetrahydrate.","","- C4 H10 N O3 -","- C4 H10 N O3 -","- C32 H80 N8 O24 -","8","1","","Lunelli, Bruno; Soave, Raffaella; Destro, Riccardo","Structure and stability of bis(dimethylamino)squaraine and its hydrates: A study using XRD, IR spectroscopy, and thermodynamic measurements","Physical Chemistry Chemical Physics","1999","1","7","1469","","10.1039/a808403c","","","0.71073","MoKa","","0.046","0.0372","","0.1052","0.0971","","","","1.072","1.103","1.103","","","","","has coordinates","180502","2020-10-21","18:00:00",""
"7217113","12.8581","0.0002","12.8581","0.0002","13.2833","0.0003","90","","90","","90","","2196.14","0.07","293","2","293","2","","","","","","","","4","P 4/n :2","-P 4a","85","","","","- C50 H61 F O4 -","- C50 H61 F O4 -","- C100 H122 F2 O8 -","2","0.25","","Brouwer, Eric B.; Gougeon, Regis D. M.; Hirschinger, Je´rôme; Udachin, Kostantin A.; Harris, Robin K.; Ripmeester, John A.","Intermolecular distance measurements in supramolecular solids: 13C‒19F REDOR NMR spectroscopy of p-tert-butylcalix[4]arene‒fluorobenzene","Physical Chemistry Chemical Physics","1999","1","17","4043","","10.1039/a904189c","","","0.71073","MoKα","","0.0625","0.0477","","","0.1308","0.1464","","","","","","1.021","","","","has coordinates,has disorder","180502","2020-10-21","18:00:00",""
"7221012","5.5939","","5.6013","","18.011","","90","","90","","90","","564.341","","","","","","","","","","","","","4","F m m m","-F 2 2","69","","Li2 Sr (Nb2 O7)","","- Li2 Nb2 O7 Sr -","- Li2 Nb2 O7 Sr -","- Li8 Nb8 O28 Sr4 -","4","0.125","","Bhuvanesh, N.S.P.; Duroy, H.; Crosnier-Lopez, M.P.; Fourquet, J.L.","Synthesis and structure of novel layered perovskite oxides: Li2 La1.78 Nb0.66 Ti2.34 O10, and a new family, Li2 (A0.5n Bn O3n+1)","Journal of Materials Chemistry","1999","9","","3093","3100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221013","3.9499","","3.9499","","18.2","","90","","90","","90","","283.951","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Li2 Sr (Ta2 O7)","","- Li2 O7 Sr Ta2 -","- Li2 O7 Sr Ta2 -","- Li4 O14 Sr2 Ta4 -","2","0.0625","","Bhuvanesh, N.S.P.; Crosnier-Lopez, M.P.; Fourquet, J.L.; Duroy, H.","Synthesis and structure of novel layered perovskite oxides: Li2 La1.78 Nb0.66 Ti2.34 O10, and a new family, Li2 (A0.5n Bn O3n+1)","Journal of Materials Chemistry","1999","9","","3093","3100","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221014","5.473","","5.473","","26.331","","90","","90","","90","","788.712","","","","","","","","","","","","","5","P 42/n c m :2","-P 4ac 2ac","138","","Li2 La1.72 ((Nb0.66 Ti2.34) O10)","","- La1.72 Li2 Nb0.66 O10 Ti2.34 -","- La1.72 Li2 Nb0.66 O10 Ti2.34 -","- La6.88 Li8 Nb2.64 O40 Ti9.36 -","4","0.25","","Bhuvanesh, N.S.P.; Fourquet, J.L.; Duroy, H.; Crosnier-Lopez, M.P.","Synthesis and structure of novel layered perovskite oxides: Li2 La1.78 Nb0.66 Ti2.34 O10, and a new family, Li2 (A0.5n Bn O3n+1)","Journal of Materials Chemistry","1999","9","","3093","3100","","","","","","","","","","","","","","","","","","","","","","has coordinates","140415","2020-10-21","18:00:00",""
"7221015","3.952","","3.952","","33.746","","90","","90","","90","","527.055","","","","","","","","","","","","","5","I 4/m m m","-I 4 2","139","","Li2 Sr2.07 ((Nb3.96 Fe0.04) O13)","","- Fe0.04 Li2 Nb3.96 O13 Sr2.07 -","- Fe0.04 Li2 Nb3.96 O13 Sr2.07 -","- Fe0.08 Li4 Nb7.92 O26 Sr4.14 -","2","0.0625","","Bhuvanesh, N.S.P.; Crosnier-Lopez, M.P.; Duroy, H.; Fourquet, J.L.","Synthesis and structure of novel layered perovskite oxides: Li2 La1.78 Nb0.66 Ti2.34 O10, and a new family, Li2 (A0.5n Bn O3n+1)","Journal of Materials Chemistry","1999","9","","3093","3100","","","","","","","","","","","","","","","","","","","","","","has coordinates","140416","2020-10-21","18:00:00",""
"7221016","9.429","","9.592","","9.897","","90","","90","","90","","895.114","","","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(N H4)2 (Co0.046 Al0.954)2 (P O4)2 ((O H)0.954 (H2 O)0.046)2","","- Al1.908 Co0.092 H10.092 N2 O10 P2 -","- Al1.908 Co0.092 N2 O10 P2 -","- Al7.632 Co0.368 N8 O40 P8 -","4","1","","Bontchev, R.P.; Sevov, S.C.","Hydrothermal synthesis and characterization of two ammonium-templated cobalt aluminophosphates","Journal of Materials Chemistry","1999","9","","2679","2682","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221017","3.8664","","3.8664","","20.7794","","90","","90","","90","","310.632","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Sr3 Fe2 O6 F0.8","","- F0.8 Fe2 O6 Sr3 -","- F0.801 Fe2 O5.999 Sr3 -","- F1.602 Fe4 O11.998 Sr6 -","2","0.0625","","Case, G.S.; Hector, A.L.; Weller, M.T.; Levason, W.; Needs, R.L.; Thomas, M.F.","Syntheses, powder neutron diffraction structures and Mossbauer studies of some complex iron oxyfluorides: Sr3 Fe2 O6 F0.87, Sr2 Fe O3 F and Ba2 In Fe O5 F0.68","Journal of Materials Chemistry","1999","9","","2821","2827","","","","","","","","","","","","","","","","","","","","","","has coordinates","140502","2020-10-21","18:00:00",""
"7221018","4.1644","","4.1644","","4.1644","","90","","90","","90","","72.22","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Ba (In Fe)0.5 O2.5 F0.318","","- Ba F0.318 Fe0.5 In0.5 O2.5 -","- Ba F0.318 Fe0.5 In0.5 O2.499 -","- Ba F0.318 Fe0.5 In0.5 O2.499 -","1","0.0208333","","Case, G.S.; Hector, A.L.; Levason, W.; Needs, R.L.; Thomas, M.F.; Weller, M.T.","Syntheses, powder neutron diffraction structures and Mossbauer studies of some complex iron oxyfluorides: Sr3 Fe2 O6 F0.87, Sr2 Fe O3 F and Ba2 In Fe O5 F0.68","Journal of Materials Chemistry","1999","9","","2821","2827","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221024","5.4979","","5.4979","","13.3584","","90","","90","","120","","349.686","","","","","","","","","","","","","5","R -3 c :H","-R 3 2""c","167","","(La0.85 Na0.09 K0.06) Mn O3","","- K0.06 La0.85 Mn Na0.09 O3 -","- K0.06 La0.85 Mn Na0.09 O3 -","- K0.36 La5.1 Mn6 Na0.54 O18 -","6","0.166667","","El-Fadli, Z.; Coret, E.; Sapina, F.; Martinez, E.; Beltran, A.; Lloret, F.; Beltran, D.","Low temperature synthesis, structure and magnetic properties of La0.85 (Na1-x Kx)0.15 Mn O3 perovskites: the role of A cation size disparity in the electronic properties of mixed-valence manganates","Journal of Materials Chemistry","1999","9","","1793","1799","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221025","5.5036","","5.5036","","13.3945","","90","","90","","120","","351.359","","","","","","","","","","","","","4","R -3 c :H","-R 3 2""c","167","","(La0.85 K0.15) Mn O3","","- K0.15 La0.85 Mn O3 -","- K0.15 La0.85 Mn O3 -","- K0.9 La5.1 Mn6 O18 -","6","0.166667","","El-Fadli, Z.; Sapina, F.; Coret, E.; Martinez, E.; Beltran, A.; Beltran, D.; Lloret, F.","Low temperature synthesis, structure and magnetic properties of La0.85 (Na1-x Kx)0.15 Mn O3 perovskites: the role of A cation size disparity in the electronic properties of mixed-valence manganates","Journal of Materials Chemistry","1999","9","","1793","1799","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221037","9.457","","4.984","","8.346","","90","","92.07","","90","","393.121","","","","","","","","","","","","","5","C 1 2 1","C 2y","5","","Ba (Mn P O4)2 (H2 O)","","- Ba H2 Mn2 O9 P2 -","- Ba Mn2 O9 P2 -","- Ba2 Mn4 O18 P4 -","2","0.5","","Escobal, J.; Mesa, J.L.; Pizarro, J.L.; Lezama, L.; Olazcuaga, R.; Rojo, T.","Hydrothermal synthesis, structural, spectroscopic and magnetic studies of a lamellar phosphate: Ba (Mn P O4)2 . (H2 O)","Journal of Materials Chemistry","1999","9","","2691","2695","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221039","18.0071","","5.5979","","5.592","","90","","90","","90","","563.684","","","","","","","","","","","","","4","C m c m","-C 2c 2","63","","Li2 Sr (Nb2 O7)","","- Li2 Nb2 O7 Sr -","- Li2 Nb2 O7 Sr -","- Li8 Nb8 O28 Sr4 -","4","0.25","","Floros, N.; Raveau, B.; Hervieu, M.; Michel, C.","New n=2 members of the Li2 Srn-1 Mn O3n+1 family, closely related to the Ruddlesden-Popper phases: structure and non-stoichiometry","Journal of Materials Chemistry","1999","9","","3101","3106","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221040","17.027","","14.237","","10.104","","90","","96.701","","90","","2432.61","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Cs6 (Ge2 Te6)","","- Cs6 Ge2 Te6 -","- Cs6 Ge2 Te6 -","- Cs24 Ge8 Te24 -","4","0.5","","Friede, B.; Jansen, M.","Darstellung und Kristallstruktur von Hexacaesium-hexatellurido-digermanat(III) (Cs6 Ge2 Te6)","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1999","54","","1095","1097","","","","","","","","","","","","","","","","","","","","","","has coordinates","140679","2020-10-21","18:00:00",""
"7221048","5.5172","","5.5149","","25.08069","","90","","90","","90","","763.125","","","","","","","","","","","","","4","A 21 a m","A -2 2a","36","","Sr Bi2 (Nb2 O9)","","- Bi2 Nb2 O9 Sr -","- Bi1.99 Nb2 O9 Sr1.01 -","- Bi7.96 Nb8 O36 Sr4.04 -","4","0.5","","Ismunandar; Kennedy, B.J.","Effect of temperature on cation disorder in A Bi2 Nb2 O9 (A = Sr, Ba)","Journal of Materials Chemistry","1999","9","","541","544","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221049","3.939","","3.939","","25.6364","","90","","90","","90","","397.767","","","","","","","","","","","","","4","I 4/m m m","-I 4 2","139","","Ba Bi2 (Nb2 O9)","","- Ba Bi2 Nb2 O9 -","- Ba Bi2 Nb2 O9 -","- Ba2 Bi4 Nb4 O18 -","2","0.0625","","Ismunandar; Kennedy, B.J.","Effect of temperature on cation disorder in A Bi2 Nb2 O9 (A = Sr, Ba)","Journal of Materials Chemistry","1999","9","","541","544","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221065","5.87766","","7.66068","","5.41051","","90","","90","","90","","243.618","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Nd Mn0.96 O2.886","","- Mn0.96 Nd O2.886 -","- Mn0.96 Nd O2.886 -","- Mn3.84 Nd4 O11.544 -","4","0.5","","Maguire, E.T.; Coats, A.M.; West, A.R.; Skakle, J.M.S.","Stoichiometry and defect structure of 'Nd Mn O3'","Journal of Materials Chemistry","1999","9","","1337","1346","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221066","5.78808","","7.5564","","5.41013","","90","","90","","90","","236.623","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Nd0.984 Mn O2.915","","- Mn Nd0.984 O2.915 -","- Mn Nd0.984 O2.915 -","- Mn4 Nd3.936 O11.66 -","4","0.5","","Maguire, E.T.; Coats, A.M.; Skakle, J.M.S.; West, A.R.","Stoichiometry and defect structure of 'Nd Mn O3'","Journal of Materials Chemistry","1999","9","","1337","1346","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221072","18.25969","","18.25969","","18.25969","","90","","90","","90","","6088.08","","","","","","","","","","","","","4","I m -3 m","-I 4 2 3","229","","(Ba Cu1.0623 O2.059) (C O2)0.1364","","- C0.1364 Ba Cu1.0623 O2.3318 -","- C0.136364 Ba Cu1.06227 O2.33182 -","- C12 Ba88 Cu93.48 O205.2 -","88","0.916667","","Peitola, K.; Karppinen, M.; Rundloef, H.; Tellgren, R.; Yamauchi, H.; Niinisto, L.","Structural changes related to changes in oxygen stoichiometry in the Ba1-y Cu O2+d (C O2)x system as determined by powder X-ray and neutron diffraction","Journal of Materials Chemistry","1999","9","","2599","2603","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221073","18.2334","","18.2334","","18.2334","","90","","90","","90","","6061.82","","","","","","","","","","","","","4","I m -3 m","-I 4 2 3","229","","(Ba Cu1.0623 O1.98) (C O2)0.1282","","- C0.1282 Ba Cu1.0623 O2.2364 -","- C0.128182 Ba Cu1.06227 O2.23636 -","- C11.28 Ba88 Cu93.48 O196.8 -","88","0.916667","","Peitola, K.; Karppinen, M.; Niinisto, L.; Tellgren, R.; Rundloef, H.; Yamauchi, H.","Structural changes related to changes in oxygen stoichiometry in the Ba1-y Cu O2+d (C O2)x system as determined by powder X-ray and neutron diffraction","Journal of Materials Chemistry","1999","9","","2599","2603","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221074","6.6736","","5.3543","","11.9005","","90","","92.615","","90","","424.791","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","K1.012 P2 W6 O22","","- K1.012 O22 P2 W6 -","- K1.012 O22 P2 W6 -","- K1.012 O22 P2 W6 -","1","0.25","","Roussel, P.; Drouard, S.; Groult, D.; Labbe, P.H.; Schlenker, C.; Dumas, J.","Crystal structure and electrical properties of K2 P4 W12 O44, the m=6 member of the series of low-dimensional conductors Kx (P O2)4 (W O3)2m","Journal of Materials Chemistry","1999","9","","973","978","","","","","","","","","","","","","","","","","","","","","","has coordinates","141108","2020-10-21","18:00:00",""
"7221075","3.3534","","3.3534","","42.51","","90","","90","","120","","413.992","","","","","","","","","","","","","3","R -3 m :H","-R 3 2""","166","","Zn3 In2 O6","","- In2 O6 Zn3 -","- In2 O6 Zn3 -","- In6 O18 Zn9 -","3","0.0833333","","Schinzer, C.; Matar, S.F.; Heyd, F.","Zn3 In2 O6 - crystallographic and electronic structure","Journal of Materials Chemistry","1999","9","","1569","1573","","","","","","","","","","","","","","","","","","","","","","has coordinates","141114","2020-10-21","18:00:00",""
"7221076","8.2788","","9.5757","","4.9158","","90","","90","","90","","389.702","","","","","","","","","","","","","5","I m m 2","I 2 -2","44","","Sr2 (Al2 Si10 N14 O4)","","- Al2 N14 O4 Si10 Sr2 -","- Al2 N14 O4 Si10 Sr2 -","- Al2 N14 O4 Si10 Sr2 -","1","0.125","","Shen, Z.-J.; Esmaeilzadeh, S.; Grins, J.; Ehrenberg, H.","Preparation and crystal structure of a new Sr containing sialon phase Sr2 Alx Si12-x N16-x O2+x (x=2)","Journal of Materials Chemistry","1999","9","","1019","1022","","","","","","","","","","","","","","","","","","","","","","has coordinates","141118","2020-10-21","18:00:00",""
"7221077","5.73116","","5.73116","","13.99109","","90","","90","","120","","397.985","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Ba Ti O2.916","","- Ba O2.916 Ti -","- Ba O2.916 Ti -","- Ba6 O17.496 Ti6 -","6","0.25","","Sinclair, D.C.; Skakle, J.M.S.; Morrison, F.D.; Beales, T.P.; Smith, R.I.","Structure and electrical properties of oxygen-deficient hexagonal Ba Ti O3","Journal of Materials Chemistry","1999","9","","1327","1331","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221078","5.73658","","5.73658","","14.01046","","90","","90","","120","","399.291","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Ba Ti O2.88","","- Ba O2.88 Ti -","- Ba O2.879 Ti -","- Ba6 O17.274 Ti6 -","6","0.25","","Sinclair, D.C.; Skakle, J.M.S.; Beales, T.P.; Morrison, F.D.; Smith, R.I.","Structure and electrical properties of oxygen-deficient hexagonal Ba Ti O3","Journal of Materials Chemistry","1999","9","","1327","1331","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221079","7.0613","","7.2086","","5.5343","","113.328","","84.479","","112.249","","238.94","","","","","","","","","","","","","4","P 1","P 1","1","","Na Bi3 V2 O10","","- Bi3 Na O10 V2 -","- Bi3 Na O10 V2 -","- Bi3 Na O10 V2 -","1","1","","Sinclair, D.C.; Skakle, J.M.S.; Marinou, E.","The crystal structure of a new oxide ion conductor Na Bi3 V2 O10 and oxide ion conductivity in Pb2 Bi2 V2 O10","Journal of Materials Chemistry","1999","9","","2617","2621","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221086","6.8782","","4.0057","","9.6939","","90","","90.11","","90","","267.086","","","","","","","","","","","","","3","C 1 2 1","C 2y","5","","Bi2 (U O5.94)","","- Bi2 O5.94 U -","- Bi2 O5.94 U -","- Bi4 O11.88 U2 -","2","0.5","","Vannier, R.N.; Thery, O.; Kinowski, C.; Huve, M.; van Tendeloo, G.; Abraham, F.; Suard, E.","Zr substituted bismuth uranate","Journal of Materials Chemistry","1999","9","","435","443","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221087","6.8949","","4.0051","","9.691","","90","","90.08","","90","","267.614","","","","","","","","","","","","","4","C 1 2 1","C 2y","5","","Bi2 ((U0.9 Zr0.1) O5.82)","","- Bi2 O5.82 U0.9 Zr0.1 -","- Bi2 O5.82 U0.9 Zr0.1 -","- Bi4 O11.64 U1.8 Zr0.2 -","2","0.5","","Vannier, R.N.; Huve, M.; Thery, O.; Kinowski, C.; van Tendeloo, G.; Suard, E.; Abraham, F.","Zr substituted bismuth uranate","Journal of Materials Chemistry","1999","9","","435","443","","","","","","","","","","","","","","","","","","","","","","has coordinates","141149","2020-10-21","18:00:00",""
"7221088","4.0136","","4.0136","","9.6474","","90","","90","","120","","134.589","","","","","","","","","","","","","4","P -3","-P 3","147","","Bi2 ((U0.65 Zr0.35) O5.72)","","- Bi2 O5.72 U0.65 Zr0.35 -","- Bi2 O5.72 U0.65 Zr0.35 -","- Bi2 O5.72 U0.65 Zr0.35 -","1","0.166667","","Vannier, R.N.; Thery, O.; van Tendeloo, G.; Kinowski, C.; Huve, M.; Suard, E.; Abraham, F.","Zr substituted bismuth uranate","Journal of Materials Chemistry","1999","9","","435","443","","","","","","","","","","","","","","","","","","","","","","has coordinates","141150","2020-10-21","18:00:00",""
"7221089","13.0582","","8.6526","","8.7247","","90","","115.443","","90","","890.173","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Li2 V2 (S O4)3","","- Li2 O12 S3 V2 -","- Li2 O12 S3 V2 -","- Li8 O48 S12 V8 -","4","0.5","","Vaughan, G.M.B.; Quarton, M.; Gaubicher, J.; le Mercier, T.; Angenault, J.; Chabre, Y.","Crystal structure of the end product of electrochemical lithium intercalation in V2 (S O4)3","Journal of Materials Chemistry","1999","9","","2809","2812","","","","","","","","","","","","","","","","","","","","","","has coordinates","141172","2020-10-21","18:00:00",""
"7221102","13.2293","","13.2293","","5.25472","","90","","90","","120","","796.442","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Mn6.867 (O H)3 (V O4)3.602 (V2 O7)0.199","","- H3 Mn6.867 O18.801 V4 -","- Mn6.868 O18.801 V4 -","- Mn13.736 O37.602 V8 -","2","0.166667","","Zhang, F.; Zavalii, P.Yu.; Whittingham, M.S.","Synthesis and characterisation of a pipe-structure manganese vanadium oxide by hydrothermal reaction","Journal of Materials Chemistry","1999","9","","3137","3140","","","","","","","","","","","","","","","","","","","","","","has coordinates","141209","2020-10-21","18:00:00",""
"7221305","13.89","","7.286","","5.172","","90","","90","","90","","523.42","","","","","","","","","","","","","5","P c a 21","P 2c -2ac","29","","Cl (C O) S N S O","","- C Cl N O2 S2 -","- C Cl N O2 S2 -","- C4 Cl4 N4 O8 S8 -","4","1","","Romano, R.M.; Della Vedova, C.O.; Boese, R.; Hildebrandt, P.","Structural and spectroscopic characterization of Cl C (O) S N S O. A theoretical and experimental study","Physical Chemistry Chemical Physics","1999","1","","2551","2557","","","","","","","","","","","","","","","","","","","","","","has coordinates","301865","2025-08-22","16:16:42",""
"7223830","4.481","","4.481","","10.26","","90","","90","","90","","206.014","","","","","","","","","","","","","3","P 4/n m m :2","-P 4a 2a","129","","","","- Cu0.66 Eu Te2 -","- Cu0.66 Eu Te2 -","- Cu1.32 Eu2 Te4 -","2","0.125","","Patschke, R.; Kanatzidis, M.G.; Brazis, P.; Kannewurf, C.R.","Cu0.66 Eu Te2, K Cu2 Eu Te4 and Na0.2 Ag2.8 Eu Te4: compounds with modulated square Te nets","Journal of Materials Chemistry","1999","9","","2293","2296","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7702340","12.406","0.016","16.065","0.009","21.851","0.008","90","","90","","90","","4355","6","295","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C29 H57 Mo6 N O19 -","- C29 Mo6 N O19 -","- C116 Mo24 N4 O76 -","4","1","","Proust, Anna; Thouvenot, René; Herson, Patrick","Revisiting the synthesis of [Mo6(η5-C5Me5)O18]−. X-Ray structural analysis, UV-visible, electrochemical and multinuclear NMR characterization","Journal of the Chemical Society, Dalton Transactions","1999","","1","51","","10.1039/a805832f","","","0.71069","MoKα","","","0.0541","","","0.0599","","","","","3.4048","3.4048","","","","","has coordinates","255782","2020-10-21","18:00:00",""
"7702344","4.4626","0.0005","6.3014","0.0007","10.0629","0.0011","90","","96.1","0.002","90","","281.37","0.05","203","2","203","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","ethylisonitrile gold chloride","Chloro(ethylisonitrile)gold(I)","","- C3 H5 Au Cl N -","- C3 H5 Au Cl N -","- C6 H10 Au2 Cl2 N2 -","2","0.5","","Mathieson, Trevor J.; Langdon, Alan G.; Milestone, Neil B.; Nicholson, Brian K.","Preparation and structural characterisation of isocyanide gold(I) nitrates, [Au(NO3)(CNR)] (R = Et, But or C6H3Me2-2,6); new auriophilic motifs †","Journal of the Chemical Society, Dalton Transactions","1999","","2","201","","10.1039/a806399k","","","0.71073","MoKα","","0.0562","0.0549","","","0.1377","0.1385","","","","","","1.055","","","","has coordinates","243834","2020-10-21","18:00:00",""
"7702345","10.6513","0.0003","17.3099","0.0004","11.0902","0.0002","90","","97.846","0.001","90","","2025.59","0.08","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","xyxlylisonitrile gold chloride","Chloro(2,6-dimethylphenylisonitrile)gold(I)","","- C9 H9 Au Cl N -","- C9 H9 Au Cl N -","- C72 H72 Au8 Cl8 N8 -","8","2","","Mathieson, Trevor J.; Langdon, Alan G.; Milestone, Neil B.; Nicholson, Brian K.","Preparation and structural characterisation of isocyanide gold(I) nitrates, [Au(NO3)(CNR)] (R = Et, But or C6H3Me2-2,6); new auriophilic motifs †","Journal of the Chemical Society, Dalton Transactions","1999","","2","201","","10.1039/a806399k","","","0.71073","MoKα","","0.061","0.0402","","","0.0884","0.097","","","","","","1.013","","","","has coordinates","243834","2020-10-21","18:00:00",""
"7702346","8.1005","0.0001","7.8684","0.0001","20.3639","0.0002","90","","96.987","0.001","90","","1288.31","0.03","203","2","203","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","ethylisonitrile gold nitrate","nitrato(ethylisonitrile)gold(I)","","- C3 H5 Au N2 O3 -","- C3 H5 Au N2 O3 -","- C24 H40 Au8 N16 O24 -","8","2","","Mathieson, Trevor J.; Langdon, Alan G.; Milestone, Neil B.; Nicholson, Brian K.","Preparation and structural characterisation of isocyanide gold(I) nitrates, [Au(NO3)(CNR)] (R = Et, But or C6H3Me2-2,6); new auriophilic motifs †","Journal of the Chemical Society, Dalton Transactions","1999","","2","201","","10.1039/a806399k","","","0.71073","MoKα","","0.0544","0.047","","","0.1323","0.137","","","","","","1.036","","","","has coordinates","243834","2020-10-21","18:00:00",""
"7702347","6.2642","0.0001","13.5595","0.0003","10.6118","0.0001","90","","102.18","","90","","881.07","0.03","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","Tert-butylisonitrile gold nitrate","nitrato(tert-butylisonitrile)gold(I)","","- C5 H9 Au N2 O3 -","- C5 H9 Au N2 O3 -","- C20 H36 Au4 N8 O12 -","4","1","","Mathieson, Trevor J.; Langdon, Alan G.; Milestone, Neil B.; Nicholson, Brian K.","Preparation and structural characterisation of isocyanide gold(I) nitrates, [Au(NO3)(CNR)] (R = Et, But or C6H3Me2-2,6); new auriophilic motifs †","Journal of the Chemical Society, Dalton Transactions","1999","","2","201","","10.1039/a806399k","","","0.71073","MoKα","","0.0638","0.0536","","","0.1589","0.1443","","","","","","1.002","","","","has coordinates","243834","2020-10-21","18:00:00",""
"7702348","15.1075","0.0006","3.7802","0.0002","18.0762","0.0006","90","","103.761","0.001","90","","1002.69","0.07","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","xylylisonitrile gold nitrate","nitrato(2,6-dimethylphenylisonitrile)gold(I)","","- C9 H9 Au N2 O3 -","- C9 H9 Au N2 O3 -","- C36 H36 Au4 N8 O12 -","4","1","","Mathieson, Trevor J.; Langdon, Alan G.; Milestone, Neil B.; Nicholson, Brian K.","Preparation and structural characterisation of isocyanide gold(I) nitrates, [Au(NO3)(CNR)] (R = Et, But or C6H3Me2-2,6); new auriophilic motifs †","Journal of the Chemical Society, Dalton Transactions","1999","","2","201","","10.1039/a806399k","","","0.71073","MoKα","","0.0762","0.0649","","","0.1592","0.1652","","","","","","1.005","","","","has coordinates","243834","2020-10-21","18:00:00",""
"7702349","20.7234","0.0007","6.7276","0.0001","8.3385","0.0003","90","","107.925","0.002","90","","1106.11","0.06","203","2","203","2","","","","","","","","6","C 1 2/m 1","-C 2y","12","Bis(xylylisonitrile)gold nitrate","Bis(2,6-dimethylisonitrile)gold(I) nitrate. dichloromethane methanol solvate","","- C19.5 H22.5 Au Cl N3 O4 -","- C20.5 Au Cl N3 O3 -","- C41 Au2 Cl2 N6 O6 -","2","0.25","","Mathieson, Trevor J.; Langdon, Alan G.; Milestone, Neil B.; Nicholson, Brian K.","Preparation and structural characterisation of isocyanide gold(I) nitrates, [Au(NO3)(CNR)] (R = Et, But or C6H3Me2-2,6); new auriophilic motifs †","Journal of the Chemical Society, Dalton Transactions","1999","","2","201","","10.1039/a806399k","","","0.71073","MoKα","","0.0499","0.042","","","0.1076","0.1165","","","","","","1.035","","","","has coordinates","243834","2020-10-21","18:00:00",""
"7702353","11.531","0.003","12.642","0.003","21.607","0.005","90","","96.26","0.02","90","","3131","1.3","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H21 F12 N9 Ni O P2 -","- C24 H21 F12 N9 Ni O P2 -","- C96 H84 F48 N36 Ni4 O4 P8 -","4","1","","Mann, Karen L. V.; Psillakis, Elefteria; Jeffery, John C.; Rees, Leigh H.; Harden, Nicholas M.; McCleverty, Jon A.; Ward, Michael D.; Gatteschi, Dante; Totti, Federico; Mabbs,, Frank E.; McInnes, Eric J. L.; Riedi, Peter C.; Smith, Graham M.","Tetranuclear grid-like copper(II) complexes with pyrazolate bridges: syntheses, structures, magnetic and EPR spectroscopic properties","Journal of the Chemical Society, Dalton Transactions","1999","","3","339","","10.1039/a807599i","","","0.71073","MoKα","","0.1255","0.0615","","0.1646","0.1341","","","","1.01","1.102","1.102","","","","","has coordinates","243836","2020-10-21","18:00:00",""
"7702354","11.5877","0.0014","12.651","0.002","21.63","0.004","90","","96.208","0.013","90","","3152.3","0.9","171","2","171","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H23 F12 N9 O P2 Zn -","- C24 H23 F12 N9 O P2 Zn -","- C96 H92 F48 N36 O4 P8 Zn4 -","4","1","","Mann, Karen L. V.; Psillakis, Elefteria; Jeffery, John C.; Rees, Leigh H.; Harden, Nicholas M.; McCleverty, Jon A.; Ward, Michael D.; Gatteschi, Dante; Totti, Federico; Mabbs,, Frank E.; McInnes, Eric J. L.; Riedi, Peter C.; Smith, Graham M.","Tetranuclear grid-like copper(II) complexes with pyrazolate bridges: syntheses, structures, magnetic and EPR spectroscopic properties","Journal of the Chemical Society, Dalton Transactions","1999","","3","339","","10.1039/a807599i","","","0.71073","MoKα","","0.0735","0.0603","","0.1699","0.1549","","","","1.068","1.081","1.081","","","","","has coordinates","301878","2025-08-22","23:10:56",""
"7702355","10.41","0.002","13.282","0.003","14.17","0.002","85.254","0.01","70.087","0.012","68.15","0.02","1707.6","0.6","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C60 H64 Cu4 F12 N22 O4 P2 -","- C60 H64 Cu4 F12 N22 O4 P2 -","- C60 H64 Cu4 F12 N22 O4 P2 -","1","0.5","","Mann, Karen L. V.; Psillakis, Elefteria; Jeffery, John C.; Rees, Leigh H.; Harden, Nicholas M.; McCleverty, Jon A.; Ward, Michael D.; Gatteschi, Dante; Totti, Federico; Mabbs,, Frank E.; McInnes, Eric J. L.; Riedi, Peter C.; Smith, Graham M.","Tetranuclear grid-like copper(II) complexes with pyrazolate bridges: syntheses, structures, magnetic and EPR spectroscopic properties","Journal of the Chemical Society, Dalton Transactions","1999","","3","339","","10.1039/a807599i","","","0.71073","MoKα","","0.0392","0.036","","0.1056","0.0989","","","","0.934","0.91","0.91","","","","","has coordinates","301878","2025-08-22","23:10:56",""
"7702356","10.888","0.002","12.739","0.002","13.05","0.002","116.745","0.008","101.313","0.011","102.246","0.013","1488.8","0.5","173","2","173","2","","","","","","","","7","P -1","-P 1","2","","","","- C52 H52 Cu4 F12 N18 O4 P2 -","- C52 H52 Cu4 F12 N18 O4 P2 -","- C52 H52 Cu4 F12 N18 O4 P2 -","1","0.5","","Mann, Karen L. V.; Psillakis, Elefteria; Jeffery, John C.; Rees, Leigh H.; Harden, Nicholas M.; McCleverty, Jon A.; Ward, Michael D.; Gatteschi, Dante; Totti, Federico; Mabbs,, Frank E.; McInnes, Eric J. L.; Riedi, Peter C.; Smith, Graham M.","Tetranuclear grid-like copper(II) complexes with pyrazolate bridges: syntheses, structures, magnetic and EPR spectroscopic properties","Journal of the Chemical Society, Dalton Transactions","1999","","3","339","","10.1039/a807599i","","","0.71073","MoKα","","0.0555","0.038","","0.0943","0.0903","","","","0.903","1.058","1.058","","","","","has coordinates","243836","2020-10-21","18:00:00",""
"7702357","19.567","0.002","26.313","0.003","20.033","0.003","90","","91.441","0.01","90","","10311","2","173","2","173","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C82 H106 Cu4 F24 N26 O10 P4 -","- C82 H106 Cu4 F24 N26 O10 P4 -","- C328 H424 Cu16 F96 N104 O40 P16 -","4","1","","Mann, Karen L. V.; Psillakis, Elefteria; Jeffery, John C.; Rees, Leigh H.; Harden, Nicholas M.; McCleverty, Jon A.; Ward, Michael D.; Gatteschi, Dante; Totti, Federico; Mabbs,, Frank E.; McInnes, Eric J. L.; Riedi, Peter C.; Smith, Graham M.","Tetranuclear grid-like copper(II) complexes with pyrazolate bridges: syntheses, structures, magnetic and EPR spectroscopic properties","Journal of the Chemical Society, Dalton Transactions","1999","","3","339","","10.1039/a807599i","","","0.71073","MoKα","","0.1739","0.0792","","0.2","0.1606","","","","1.04","1.214","1.214","","","","","has coordinates","243836","2020-10-21","18:00:00",""
"7702361","12.9094","0.0002","20.842","0.0006","15.118","0.0002","90","","100.302","0.002","90","","4002.04","0.14","133","2","133","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C28 H114 N7 O55 V W12 -","- C28 H114 N7 O55 V W12 -","- C56 H228 N14 O110 V2 W24 -","2","0.5","","Khan, M. Ishaque; Cevik, Sabri; Hayashi, Randy","First 12-tungstovanadate Keggin compound: synthesis and crystal structure of [Me4N]7[VW12O40]·15H2O","Journal of the Chemical Society, Dalton Transactions","1999","","10","1651","","10.1039/a808760a","","","0.71073","MoKα","","0.0591","0.0439","","0.1271","0.1157","","","","1.066","1.103","1.103","","","","","has coordinates","243839","2020-10-21","18:00:00",""
"7702362","16.217","0.003","9.1007","0.0012","16.28","0.003","90","","112.084","0.013","90","","2226.4","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[Mn2(mu-PPh2)(mu-C4H3S)(CO)6] (COMPOUND 3 IN DALTON PAPER 8/09845J)","","- C22 H13 Mn2 O6 P S -","- C22 H13 Mn2 O6 P S -","- C88 H52 Mn8 O24 P4 S4 -","4","1","","Deeming, Antony J.; Shinhmar, Mukesh K.; Arce, Alejandro J.; De Sanctis, Ysaura","Two different types of 2-thienyl bridge in dinuclear manganese and rhenium compounds","Journal of the Chemical Society, Dalton Transactions","1999","","7","1153","","10.1039/a809845j","","","0.71073","MoKα","","0.0397","0.0311","","0.085","0.0766","","","","1.039","1.053","1.053","","","","","has coordinates","243840","2020-10-21","18:00:00",""
"7702363","14.781","0.005","16.863","0.005","20.407","0.007","90","","90","","90","","5086","3","293","2","293","2","","","","","","","","6","P c a b","-P 2bc 2ac","61","","[Re2(mu-Ph2PC4H3S)(CO)8] (COMPOUND 4 IN DALTON PAPER 8/09845J)","","- C24 H13 O8 P Re2 S -","- C24 H13 O8 P Re2 S -","- C192 H104 O64 P8 Re16 S8 -","8","1","","Deeming, Antony J.; Shinhmar, Mukesh K.; Arce, Alejandro J.; De Sanctis, Ysaura","Two different types of 2-thienyl bridge in dinuclear manganese and rhenium compounds","Journal of the Chemical Society, Dalton Transactions","1999","","7","1153","","10.1039/a809845j","","","0.71073","MoKα","","0.0568","0.0407","","0.1146","0.0995","","","","1.034","1.047","1.047","","","","","has coordinates","243840","2020-10-21","18:00:00",""
"7702364","9.367","0.002","30.236","0.013","9.481","0.003","90","","105.37","0.02","90","","2589.2","1.5","293","2","293","2","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","[Re2(mu-PPh2)(mu-C4H3S)(CO)8] (COMPOUND 5 IN DALTON PAPER 8/09845J)","","- C24 H13 O8 P Re2 S -","- C24 H13 O8 P Re2 S -","- C96 H52 O32 P4 Re8 S4 -","4","1","","Deeming, Antony J.; Shinhmar, Mukesh K.; Arce, Alejandro J.; De Sanctis, Ysaura","Two different types of 2-thienyl bridge in dinuclear manganese and rhenium compounds","Journal of the Chemical Society, Dalton Transactions","1999","","7","1153","","10.1039/a809845j","","","0.71073","MoKα","","0.0594","0.0491","","0.1352","0.1257","","","","1.03","1.06","1.06","","","","","has coordinates","243840","2020-10-21","18:00:00",""
"7702365","16.628","0.003","29.937","0.006","19.847","0.004","90","","101.79","0.03","90","","9671","3","203","2","203","2","","","","","","","Diethylether","5","P 1 21/n 1","-P 2yn","14","Copper-selenato-selenido-cluster","The CIF file for the structure of 2","","- C126 H288 Cu32 P6 Se25 -","- C126 H270 Cu32 P6 Se25 -","- C252 H540 Cu64 P12 Se50 -","2","0.5","","Zhu, Nianyong; Fenske, Dieter","Novel Cu‒Se clusters with Se‒layer structures: [Cu32Se7(SenBu)18(PiPr3)6], [Cu50Se20(SetBu)10(PiPr3)10], [Cu73Se35(SePh)3(PiPr3)21], [Cu140Se70(PEt3)34] and [Cu140Se70(PEt3)36]","Journal of the Chemical Society, Dalton Transactions","1999","","7","1067","","10.1039/a900021f","","","0.71073","MoKa","","0.0915","0.0745","","0.233","0.2017","","","","1.055","1.055","1.055","","","","","has coordinates","243841","2020-10-21","18:00:00",""
"7702366","33.998","0.007","20.16","0.004","19.923","0.004","90","","119.44","0.03","90","","11892","5","203","2","203","2","","","","","","","Diethylether","6","C 1 2/m 1","-C 2y","12","Copper-selenato-selenido-cluster","The CIF file for the structure of 3","","- C138 H320 Cu50 O2 P10 Se30 -","- C138 Cu50 O2 P10 Se30 -","- C276 Cu100 O4 P20 Se60 -","2","0.25","","Zhu, Nianyong; Fenske, Dieter","Novel Cu‒Se clusters with Se‒layer structures: [Cu32Se7(SenBu)18(PiPr3)6], [Cu50Se20(SetBu)10(PiPr3)10], [Cu73Se35(SePh)3(PiPr3)21], [Cu140Se70(PEt3)34] and [Cu140Se70(PEt3)36]","Journal of the Chemical Society, Dalton Transactions","1999","","7","1067","","10.1039/a900021f","","","0.71073","MoKa","","0.0827","0.0682","","0.206","0.1892","","","","1.009","1.034","1.034","","","","","has coordinates","243841","2020-10-21","18:00:00",""
"7702367","38.46","0.008","25.72","0.005","36.31","0.007","90","","99.61","0.03","90","","35413","13","190","2","203","2","","","","","","","Diethylether","5","P 1 21/c 1","-P 2ybc","14","Copper-seleno-phenylselenolato-cluster","The CIF file for the structure of 4","","- C207 H456 Cu73 P21 Se38 -","- C180 Cu73.01 P21 Se38 -","- C720 Cu292.04 P84 Se152 -","4","1","","Zhu, Nianyong; Fenske, Dieter","Novel Cu‒Se clusters with Se‒layer structures: [Cu32Se7(SenBu)18(PiPr3)6], [Cu50Se20(SetBu)10(PiPr3)10], [Cu73Se35(SePh)3(PiPr3)21], [Cu140Se70(PEt3)34] and [Cu140Se70(PEt3)36]","Journal of the Chemical Society, Dalton Transactions","1999","","7","1067","","10.1039/a900021f","","","0.71073","MoKa","","0.2806","0.0953","","0.368","0.2189","","","","0.91","1.166","1.166","","","","","has coordinates","243841","2020-10-21","18:00:00",""
"7702368","34.116","0.007","48.433","0.01","30.942","0.006","90","","110.47","0.03","90","","47898","19","203","2","203","2","","","","","","","Diethylether","5","C 1 2/c 1","-C 2yc","15","Copper-selenide-nanocluster","The CIF file for the structure of 5","","- C204 H510 Cu140 P34 Se70 -","- C136 Cu140.02 P34 Se70 -","- C544 Cu560.08 P136 Se280 -","4","0.5","","Zhu, Nianyong; Fenske, Dieter","Novel Cu‒Se clusters with Se‒layer structures: [Cu32Se7(SenBu)18(PiPr3)6], [Cu50Se20(SetBu)10(PiPr3)10], [Cu73Se35(SePh)3(PiPr3)21], [Cu140Se70(PEt3)34] and [Cu140Se70(PEt3)36]","Journal of the Chemical Society, Dalton Transactions","1999","","7","1067","","10.1039/a900021f","","","0.71073","MoKa","","0.281","0.1093","","0.3912","0.2692","","","","1.385","1.903","1.903","","","","","has coordinates","243841","2020-10-21","18:00:00",""
"7702369","31.65","0.006","22.55","0.005","37.84","0.008","90","","97.92","0.03","90","","26749","10","203","2","203","2","","","","","","","pentane solution","5","P 1 21/m 1","-P 2yb","11","Copper-selenide-nanocluster","The CIF file for the structure of Nr. 6","","- C216 H540 Cu140 P36 Se70 -","- C137 Cu140.02 P36 Se70 -","- C274 Cu280.04 P72 Se140 -","2","0.5","","Zhu, Nianyong; Fenske, Dieter","Novel Cu‒Se clusters with Se‒layer structures: [Cu32Se7(SenBu)18(PiPr3)6], [Cu50Se20(SetBu)10(PiPr3)10], [Cu73Se35(SePh)3(PiPr3)21], [Cu140Se70(PEt3)34] and [Cu140Se70(PEt3)36]","Journal of the Chemical Society, Dalton Transactions","1999","","7","1067","","10.1039/a900021f","","","0.71073","MoKa","","0.2611","0.0867","","0.3236","0.2196","","","","1.092","1.44","1.44","","","","","has coordinates","243841","2020-10-21","18:00:00",""
"7702370","12.6301","0.0004","12.6301","0.0004","12.6301","0.0004","90","","90","","90","","2014.75","0.11","120","","120","","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","tripicolinium nitrate sulphate","tris-2-methylpiridinium nitrate sulphate","","- C18 H21 N5 O7 S -","- C18 H21 N3.6666 O6.3333 S0.3333 -","- C72 H84 N14.6664 O25.3332 S1.3332 -","4","0.333333","","Hazell, Alan; McGinley, John; Toftlund, Hans","Synthesis and structural characterisation of Group I and II metal complexes involving the ligand tris(2-pyridylmethyl)amine","Journal of the Chemical Society, Dalton Transactions","1999","","8","1271","","10.1039/a900359b","","","0.71073","MoKα","","","0.035","","","0.05","","","","","3.64","3.64","","","","","has coordinates","288320","2023-12-14","18:11:57",""
"7702371","9.7069","0.0005","10.8978","0.0005","18.3622","0.0009","90","","103.411","0.001","90","","1889.46","0.16","120","","120","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","bis-tripicolylaminecalcium perchlorate","bis-tri(2-pyridylmethyl)aminecalcium diperchlorate","","- C36 H36 Ca Cl2 N8 O8 -","- C36 H36 Ca0.5 Cl2 N8 O8 -","- C72 H72 Ca Cl4 N16 O16 -","2","0.5","","Hazell, Alan; McGinley, John; Toftlund, Hans","Synthesis and structural characterisation of Group I and II metal complexes involving the ligand tris(2-pyridylmethyl)amine","Journal of the Chemical Society, Dalton Transactions","1999","","8","1271","","10.1039/a900359b","","","0.71073","MoKα","","","0.029","","","0.051","","","","","1.757","1.757","","","","","has coordinates","243842","2020-10-21","18:00:00",""
"7702372","10.382","0.004","13.482","0.007","14.038","0.004","90","","91.71","0.03","90","","1964.9","1.4","295","","295","","","","","","","","chemical synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 Mn N4 O2 S2 -","- C16 H18 Mn N4 O2 S2 -","- C64 H72 Mn4 N16 O8 S8 -","4","1","","De Munno, Giovanni; Armentano, Donatella; Poerio, Teresa; Julve, Miguel; Real, José Antonio","Novel sheet-like manganese(II) networks. Synthesis and structure of [Mn(bpe)(NCS)2(CH3OH)2] and [Mn(bpe)(NCS)2(CH3OH)2]·bpe [bpe = trans-1,2-bis(4-pyridyl)ethene]","Journal of the Chemical Society, Dalton Transactions","1999","","11","1813","","10.1039/a900569b","","","0.71073","MoKα","","24.8","8.61","","17.57","10.33","","","","","2.04","2.04","","","","","has coordinates","287898","2023-11-30","16:58:00",""
"7702373","7.356","0.004","17.096","0.006","12.31","0.005","90","","93.66","0.04","90","","1548.1","1.2","295","","295","","","","","","","","chemical synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28 Mn N6 O2 S2 -","- C28 H28 Mn N6 O2 S2 -","- C56 H56 Mn2 N12 O4 S4 -","2","0.5","","De Munno, Giovanni; Armentano, Donatella; Poerio, Teresa; Julve, Miguel; Real, José Antonio","Novel sheet-like manganese(II) networks. Synthesis and structure of [Mn(bpe)(NCS)2(CH3OH)2] and [Mn(bpe)(NCS)2(CH3OH)2]·bpe [bpe = trans-1,2-bis(4-pyridyl)ethene]","Journal of the Chemical Society, Dalton Transactions","1999","","11","1813","","10.1039/a900569b","","","0.71073","MoKα","","12.09","7.01","","13.09","9.91","","","","","1.19","1.19","","","","","has coordinates","287898","2023-11-30","16:58:04",""
"7702374","10.386","0.001","13.115","0.001","26.556","0.002","90","","90","","90","","3617.3","0.5","293","2","293","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C28 H52 B I2 N4 O3 U -","- C28 H52 B I2 N4 O3 U -","- C112 H208 B4 I8 N16 O12 U4 -","4","1","","Maria, Leonor; Campello, Maria Paula; Domingos, Ângela; Santos, Isabel; Andersen, Richard","Synthesis and structure of uranium(III) complexes with dihydrobis(pyrazolyl)borates","Journal of the Chemical Society, Dalton Transactions","1999","","12","2015","","10.1039/a900744j","","","0.71073","MoKα","","0.1689","0.0724","","0.1997","0.1003","","","","1.067","1.128","1.128","","","","","has coordinates","243844","2020-10-21","18:00:00",""
"7702375","17.95","0.003","19.866","0.003","18.793","0.002","90","","96.894","0.012","90","","6653","1.7","293","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C66 H74 B I2 N4 O2 P2 U -","- C66 H58 B I2 N4 O2 P2 U -","- C264 H232 B4 I8 N16 O8 P8 U4 -","4","1","","Maria, Leonor; Campello, Maria Paula; Domingos, Ângela; Santos, Isabel; Andersen, Richard","Synthesis and structure of uranium(III) complexes with dihydrobis(pyrazolyl)borates","Journal of the Chemical Society, Dalton Transactions","1999","","12","2015","","10.1039/a900744j","","","0.71073","MoKα","","0.2191","0.1004","","0.2977","0.1902","","","","1.05","1.143","1.143","","","","","has coordinates","243844","2020-10-21","18:00:00",""
"7702376","13.565","0.001","15.715","0.002","15.929","0.002","118.957","0.009","92.65","0.011","97.356","0.015","2923.7","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C64.5 H60 B3 N12 U -","- C64.5 H48 B3 N12 U -","- C129 H96 B6 N24 U2 -","2","1","","Maria, Leonor; Campello, Maria Paula; Domingos, Ângela; Santos, Isabel; Andersen, Richard","Synthesis and structure of uranium(III) complexes with dihydrobis(pyrazolyl)borates","Journal of the Chemical Society, Dalton Transactions","1999","","12","2015","","10.1039/a900744j","","","0.71073","MoKα","","0.0726","0.0501","","0.1401","0.1161","","","","1.087","1.102","1.102","","","","","has coordinates","243844","2020-10-21","18:00:00",""
"7702377","7.803","0.003","7.855","0.004","9.867","0.004","73.85","0.05","85.71","0.03","83.18","0.03","576.2","0.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","7,7,8,8-Tetracyano-p-quinodimethane - bis(Benzene-1,2-dithiolato) -diborane adduct, form A","","- C24 H12 B2 N4 S4 -","- C24 H12 B2 N4 S4 -","- C24 H12 B2 N4 S4 -","1","0.5","","Marder, Todd B.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Rice, Craig R.","Crystalline TCNQ and TCNE adducts of the diborane(4) compounds B2(1,2-E2C6H4)2 (E = O or S)","Journal of the Chemical Society, Dalton Transactions","1999","","13","2127","","10.1039/a901169b","","","0.71073","MoKα","","0.0844","0.047","","0.1125","0.0979","","","","0.982","1.064","1.064","","","","","has coordinates","301878","2025-08-22","23:10:56",""
"7702378","7.862","0.002","8.386","0.002","9.745","0.002","71.97","0.03","72.71","0.02","88.28","0.02","582","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","7,7,8,8-Tetracyano-p-quinodimethane - bis(Benzene-1,2-dithiolato) -diborane adduct, form B","","- C24 H12 B2 N4 S4 -","- C24 H12 B2 N4 S4 -","- C24 H12 B2 N4 S4 -","1","0.5","","Marder, Todd B.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Rice, Craig R.","Crystalline TCNQ and TCNE adducts of the diborane(4) compounds B2(1,2-E2C6H4)2 (E = O or S)","Journal of the Chemical Society, Dalton Transactions","1999","","13","2127","","10.1039/a901169b","","","0.71073","MoKα","","0.0609","0.0365","","0.0822","0.0761","","","","0.914","1.019","1.019","","","","","has coordinates","301878","2025-08-22","23:10:56",""
"7702379","6.861","0.003","7.172","0.003","10.862","0.003","80.8","0.02","79.61","0.03","64","0.02","470.5","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","tetracyanoethene - bis(Benzene-1,2-dithiolato) -diborane adduct","","- C18 H8 B2 N4 S4 -","- C18 H8 B2 N4 S4 -","- C18 H8 B2 N4 S4 -","1","0.5","","Marder, Todd B.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Rice, Craig R.","Crystalline TCNQ and TCNE adducts of the diborane(4) compounds B2(1,2-E2C6H4)2 (E = O or S)","Journal of the Chemical Society, Dalton Transactions","1999","","13","2127","","10.1039/a901169b","","","0.71073","MoKα","","0.0669","0.047","","0.1211","0.1156","","","","0.967","1.101","1.101","","","","","has coordinates","301878","2025-08-22","23:10:56",""
"7702380","7.1996","0.0011","8.56","0.003","9.414","0.003","67","0.02","83.16","0.02","75.47","0.02","516.8","0.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","7,7,8,8-Tetracyano-p-quinodimethane - bis(Benzene-1,2-diolato) -diborane adduct","","- C24 H12 B2 N4 O4 -","- C24 H12 B2 N4 O4 -","- C24 H12 B2 N4 O4 -","1","0.5","","Marder, Todd B.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Rice, Craig R.","Crystalline TCNQ and TCNE adducts of the diborane(4) compounds B2(1,2-E2C6H4)2 (E = O or S)","Journal of the Chemical Society, Dalton Transactions","1999","","13","2127","","10.1039/a901169b","","","0.71073","MoKα","","0.0745","0.0547","","0.1375","0.1322","","","","0.907","1.093","1.093","","","","","has coordinates","301878","2025-08-22","23:10:56",""
"7702381","5.962","0.003","6.024","0.004","12.686","0.006","97.88","0.02","97.66","0.03","108.91","0.03","419.2","0.4","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","Tetracyanoethene - bis(Benzene-1,2-diolato) -diborane adduct","","- C18 H8 B2 N4 O4 -","- C18 H8 B2 N4 O4 -","- C18 H8 B2 N4 O4 -","1","0.5","","Marder, Todd B.; Norman, Nicholas C.; Orpen, A. Guy; Quayle, Michael J.; Rice, Craig R.","Crystalline TCNQ and TCNE adducts of the diborane(4) compounds B2(1,2-E2C6H4)2 (E = O or S)","Journal of the Chemical Society, Dalton Transactions","1999","","13","2127","","10.1039/a901169b","","","0.71073","MoKα","","0.0758","0.0576","","0.1516","0.1298","","","","1.184","1.13","1.13","","","","","has coordinates","301878","2025-08-22","23:10:56",""
"7702382","15.41","0.002","15.148","0.001","17.324","0.001","90","","110.72","0.01","90","","3782.4","0.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C23 H57 Cl2 Co2 N9 O9 S2 -","- C23 H57 Cl2 Co2 N9 O9 S2 -","- C92 H228 Cl8 Co8 N36 O36 S8 -","4","1","","Pleus, Rainer J.; Waden, Harald; Saak, Wolfgang; Haase, Detlev; Pohl, Siegfried","Preparation of the first sulfur-containing cobalt and nickel complexes stabilised by the macrocyclic cyclam ligand; observation of S–H bond activation","Journal of the Chemical Society, Dalton Transactions","1999","","15","2601","","10.1039/a902015b","","","0.71073","MoKα","","0.1093","0.0635","","0.1774","0.1296","","","","1.224","1.16","1.16","","","","","has coordinates,has disorder","301878","2025-08-22","23:10:56",""
"7702383","9.4965","0.0011","10.995","0.001","9.9785","0.0015","90","","111.222","0.017","90","","971.2","0.2","293","2","293","2","","","","","","","","7","P 1 21/m 1","-P 2yb","11","","","","- C11 H29 Cl Co N4 O5 S -","- C11 H29 Cl Co N4 O5 S -","- C22 H58 Cl2 Co2 N8 O10 S2 -","2","0.5","","Pleus, Rainer J.; Waden, Harald; Saak, Wolfgang; Haase, Detlev; Pohl, Siegfried","Preparation of the first sulfur-containing cobalt and nickel complexes stabilised by the macrocyclic cyclam ligand; observation of S‒H bond activation","Journal of the Chemical Society, Dalton Transactions","1999","","15","2601","","10.1039/a902015b","","","0.71073","MoKα","","0.0899","0.0564","","0.1606","0.1239","","","","1.24","1.202","1.202","","","","","has coordinates","243846","2020-10-21","18:00:00",""
"7702384","15.031","0.002","14.924","0.001","17.683","0.002","90","","109.74","0.01","90","","3733.6","0.7","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H55 Cl4 Co2 N9 O9 -","- C23 H55 Cl4 Co2 N9 O9 -","- C92 H220 Cl16 Co8 N36 O36 -","4","1","","Pleus, Rainer J.; Waden, Harald; Saak, Wolfgang; Haase, Detlev; Pohl, Siegfried","Preparation of the first sulfur-containing cobalt and nickel complexes stabilised by the macrocyclic cyclam ligand; observation of S‒H bond activation","Journal of the Chemical Society, Dalton Transactions","1999","","15","2601","","10.1039/a902015b","","","0.71073","MoKα","","0.1142","0.0784","","0.2837","0.188","","","","1.17","1.144","1.144","","","","","has coordinates,has disorder","243846","2020-10-21","18:00:00",""
"7702385","13.941","0.002","20.212","0.002","9.263","0.001","90","","109.87","0.01","90","","2454.7","0.5","296","2","296","2","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","","- C30 H76 Cl2 N12 Ni3 O8 S4 -","- C30 H76 Cl2 N12 Ni3 O8 S4 -","- C60 H152 Cl4 N24 Ni6 O16 S8 -","2","0.25","","Pleus, Rainer J.; Waden, Harald; Saak, Wolfgang; Haase, Detlev; Pohl, Siegfried","Preparation of the first sulfur-containing cobalt and nickel complexes stabilised by the macrocyclic cyclam ligand; observation of S‒H bond activation","Journal of the Chemical Society, Dalton Transactions","1999","","15","2601","","10.1039/a902015b","","","0.71073","MoKα","","0.0828","0.0473","","0.109","0.0958","","","","1.103","1.182","1.182","","","","","has coordinates","243846","2020-10-21","18:00:00",""
"7702386","12.482","0.006","14.699","0.007","16.045","0.006","90","","90","","90","","2944","2","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H52 Co2 N8 S4 -","- C20 H52 Co2 N8 S4 -","- C80 H208 Co8 N32 S16 -","4","0.5","","Pleus, Rainer J.; Waden, Harald; Saak, Wolfgang; Haase, Detlev; Pohl, Siegfried","Preparation of the first sulfur-containing cobalt and nickel complexes stabilised by the macrocyclic cyclam ligand; observation of S‒H bond activation","Journal of the Chemical Society, Dalton Transactions","1999","","15","2601","","10.1039/a902015b","","","0.71073","MoKα","","0.086","0.0553","","0.1403","0.1114","","","","1.262","1.208","1.208","","","","","has coordinates","243846","2020-10-21","18:00:00",""
"7702387","12.625","0.001","14.891","0.001","16.202","0.001","90","","90","","90","","3046","0.4","296","2","296","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H52 N8 Ni2 S4 -","- C20 H52 N8 Ni2 S4 -","- C80 H208 N32 Ni8 S16 -","4","0.5","","Pleus, Rainer J.; Waden, Harald; Saak, Wolfgang; Haase, Detlev; Pohl, Siegfried","Preparation of the first sulfur-containing cobalt and nickel complexes stabilised by the macrocyclic cyclam ligand; observation of S‒H bond activation","Journal of the Chemical Society, Dalton Transactions","1999","","15","2601","","10.1039/a902015b","","","0.71073","MoKα","","0.0954","0.0461","","0.09","0.0753","","","","1.034","1.029","1.029","","","","","has coordinates","243846","2020-10-21","18:00:00",""
"7702388","8.593","0.001","12.705","0.002","18.122","0.002","90","","99.26","0.01","90","","1952.7","0.4","296","2","296","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C24 H54 Cl2 N10 Ni2 O8 S2 -","- C24 H54 Cl2 N10 Ni2 O8 S2 -","- C48 H108 Cl4 N20 Ni4 O16 S4 -","2","0.5","","Pleus, Rainer J.; Waden, Harald; Saak, Wolfgang; Haase, Detlev; Pohl, Siegfried","Preparation of the first sulfur-containing cobalt and nickel complexes stabilised by the macrocyclic cyclam ligand; observation of S‒H bond activation","Journal of the Chemical Society, Dalton Transactions","1999","","15","2601","","10.1039/a902015b","","","0.71073","MoKα","","0.0925","0.0511","","0.1264","0.1078","","","","1.045","1.11","1.11","","","","","has coordinates","243846","2020-10-21","18:00:00",""
"7702389","12.899","0.003","13.879","0.003","21.201","0.004","90","","90","","90","","3795.5","1.4","293","2","293","2","","","","","","","","7","F 2 2 2","F 2 2","22","","","","- C24 H54 Cl2 Co2 N10 O4 S2 -","- C24 H54 Cl2 Co2 N10 O8 S2 -","- C96 H216 Cl8 Co8 N40 O32 S8 -","4","0.25","","Pleus, Rainer J.; Waden, Harald; Saak, Wolfgang; Haase, Detlev; Pohl, Siegfried","Preparation of the first sulfur-containing cobalt and nickel complexes stabilised by the macrocyclic cyclam ligand; observation of S‒H bond activation","Journal of the Chemical Society, Dalton Transactions","1999","","15","2601","","10.1039/a902015b","","","0.71073","MoKα","","0.088","0.0563","","0.1736","0.1331","","","","1.213","1.089","1.089","","","","","has coordinates,has disorder","243846","2020-10-21","18:00:00",""
"7702390","15.3391","0.0009","16.9204","0.001","20.6738","0.0014","72.963","0.005","70.719","0.005","74.467","0.004","4754.8","0.5","210","2","210","2","","","","","","","","6","P -1","-P 1","2","","","","- C61 H136 I10 N5 O1.5 Pb3 -","- C61 H136 I10 N5 O1.5 Pb3 -","- C122 H272 I20 N10 O3 Pb6 -","2","1","","Krautscheid, Harald; Vielsack, Frieder","Discrete and polymeric iodoplumbates with Pb3I10 building blocks: [Pb3I10]4−, [Pb7I22]8−, [Pb10I28]8−, 1\ιnfty [Pb3I10]4− and 2∞[Pb7I18]4−","Journal of the Chemical Society, Dalton Transactions","1999","","16","2731","","10.1039/a902640a","","","0.71069","MoKa","","0.0723","0.0474","","","0.1071","0.1246","","","","","","1.096","","","","has coordinates,has disorder","243847","2020-10-21","18:00:00",""
"7702391","16.73","0.002","26.823","0.003","20.496","0.002","90","","105.87","0.01","90","","8847","1.7","203","2","203","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C112 H248 I22 N8 Pb7 -","- C109.6 H241.6 I22 N8 Pb7 -","- C219.2 H483.2 I44 N16 Pb14 -","2","0.5","","Krautscheid, Harald; Vielsack, Frieder","Discrete and polymeric iodoplumbates with Pb3I10 building blocks: [Pb3I10]4−, [Pb7I22]8−, [Pb10I28]8−, 1\ιnfty [Pb3I10]4− and 2∞[Pb7I18]4−","Journal of the Chemical Society, Dalton Transactions","1999","","16","2731","","10.1039/a902640a","","","0.71069","MoKα","","0.0597","0.0397","","","0.0961","0.1022","","","","","","0.924","","","","has coordinates","243847","2020-10-21","18:00:00",""
"7702392","22.9116","0.0009","22.9116","0.0009","18.5203","0.0007","90","","90","","90","","9722.1","0.7","190","2","190","2","","","","","","","","5","P -4 2 c","P -4 2c","112","","","","- C112 H248 I28 N8 Pb10 -","- C112 H248 I28 N8 Pb10 -","- C224 H496 I56 N16 Pb20 -","2","0.25","","Krautscheid, Harald; Vielsack, Frieder","Discrete and polymeric iodoplumbates with Pb3I10 building blocks: [Pb3I10]4−, [Pb7I22]8−, [Pb10I28]8−, 1\ιnfty [Pb3I10]4− and 2∞[Pb7I18]4−","Journal of the Chemical Society, Dalton Transactions","1999","","16","2731","","10.1039/a902640a","","","0.71069","MoKa","","0.0325","0.0278","","0.063","0.0605","","","","1.033","1.042","1.042","","","","","has coordinates,has disorder","243847","2020-10-21","18:00:00",""
"7702393","20.889","0.002","13.2764","0.001","18.4226","0.0017","90","","101.245","0.01","90","","5011.1","0.8","193","2","193","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C22 H56 I10 N4 Pb3 -","- C22 H56 I10 N4 Pb3 -","- C88 H224 I40 N16 Pb12 -","4","0.5","","Krautscheid, Harald; Vielsack, Frieder","Discrete and polymeric iodoplumbates with Pb3I10 building blocks: [Pb3I10]4−, [Pb7I22]8−, [Pb10I28]8−, 1\ιnfty [Pb3I10]4− and 2∞[Pb7I18]4−","Journal of the Chemical Society, Dalton Transactions","1999","","16","2731","","10.1039/a902640a","","","0.71069","MoKα","","0.0626","0.0559","","","0.1334","0.1378","","","","","","1.064","","","","has coordinates","243847","2020-10-21","18:00:00",""
"7702394","11.914","0.001","28.112","0.004","15.368","0.002","90","","110.248","0.009","90","","4829.1","1.1","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H104 I18 N4 Pb7 -","- C46 H104 I18 N4 Pb7 -","- C92 H208 I36 N8 Pb14 -","2","0.5","","Krautscheid, Harald; Vielsack, Frieder","Discrete and polymeric iodoplumbates with Pb3I10 building blocks: [Pb3I10]4−, [Pb7I22]8−, [Pb10I28]8−, 1\ιnfty [Pb3I10]4− and 2∞[Pb7I18]4−","Journal of the Chemical Society, Dalton Transactions","1999","","16","2731","","10.1039/a902640a","","","0.71069","MoKα","","0.0562","0.0322","","","0.0586","0.0677","","","","","","1.096","","","","has coordinates","243847","2020-10-21","18:00:00",""
"7702395","12.584","0.001","15.216","0.001","12.4563","0.0008","99.144","0.007","98.605","0.006","101.545","0.007","2266.2","0.3","571.2","","571.2","","","","","","","","CH2Cl2/pet ether","7","P -1","-P 1","2","","","","- C12 H18 F3 O6 Re S Se3 -","- C12 H18 F4.5 O7.5 Re S Se3 -","- C48 H72 F18 O30 Re4 S4 Se12 -","4","2","","Connolly, Julie; Genge, Anthony R. J.; Levason, William; Orchard, Simon D.; Pope, Simon J. A.; Reid, Gillian","Cationic manganese(I) tricarbonyl complexes with group 15 and 16 donor ligands: synthesis, multinuclear NMR spectroscopy and crystal structures","Journal of the Chemical Society, Dalton Transactions","1999","","14","2343","","10.1039/a902820j","","","0.71073","MoKalpha","","","0.0475","","","0.0547","","","","","2.28","2.28","","","","","has coordinates","243849","2020-10-21","18:00:00",""
"7702396","9.403","0.003","12.139","0.005","9.124","0.004","100.15","0.03","94.76","0.04","80.92","0.03","1010.7","0.7","150","","150","","","","","","","","diffusion of pet ether into CHCl~3~ soln","7","P -1","-P 1","2","","","","- C12 H18 F3 Mn O6 S Se3 -","- C12 H18 F3 Mn O6 S Se3 -","- C24 H36 F6 Mn2 O12 S2 Se6 -","2","1","","Connolly, Julie; Genge, Anthony R. J.; Levason, William; Orchard, Simon D.; Pope, Simon J. A.; Reid, Gillian","Cationic manganese(I) tricarbonyl complexes with group 15 and 16 donor ligands: synthesis, multinuclear NMR spectroscopy and crystal structures","Journal of the Chemical Society, Dalton Transactions","1999","","14","2343","","10.1039/a902820j","","","0.71073","MoKalpha","","","0.0384","","","0.0417","","","","","1.715","1.715","","","","","has coordinates","243849","2020-10-21","18:00:00",""
"7702397","7.43","0.005","28.273","0.003","16.075","0.005","90","","95.79","0.04","90","","3360","3","150.1","","150.1","","","","","","","","CH2Cl2/Et2O","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H28 Br4 Mn3 O6 S6 -","- C20 H28 Br4 Mn3 O6 S6 -","- C80 H112 Br16 Mn12 O24 S24 -","4","1","","Connolly, Julie; Genge, Anthony R. J.; Levason, William; Orchard, Simon D.; Pope, Simon J. A.; Reid, Gillian","Cationic manganese(I) tricarbonyl complexes with group 15 and 16 donor ligands: synthesis, multinuclear NMR spectroscopy and crystal structures","Journal of the Chemical Society, Dalton Transactions","1999","","14","2343","","10.1039/a902820j","","","0.71073","MoKalpha","","","0.0619","","","0.0682","","","","","1.85","1.85","","","","","has coordinates","243849","2020-10-21","18:00:00",""
"7702398","11.72","0.01","12.75","0.02","5.95","0.006","99.04","0.09","90.2","0.1","97.3","0.1","870.7","1.8","150","0.1","150","0.1","","","","","","","CH2Cl2/pet ether","6","P -1","-P 1","2","","","","- C10 H14 F3 Mn O6 S4 -","- C10 H14 F3 Mn O6 S4 -","- C20 H28 F6 Mn2 O12 S8 -","2","1","","Connolly, Julie; Genge, Anthony R. J.; Levason, William; Orchard, Simon D.; Pope, Simon J. A.; Reid, Gillian","Cationic manganese(I) tricarbonyl complexes with group 15 and 16 donor ligands: synthesis, multinuclear NMR spectroscopy and crystal structures","Journal of the Chemical Society, Dalton Transactions","1999","","14","2343","","10.1039/a902820j","","","0.71073","MoKalpha","","","0.0705","","","0.0991","","","","","5.644","5.644","","","","","has coordinates","243849","2020-10-21","18:00:00",""
"7702399","13.216","0.003","15.662","0.002","16.05","0.004","90","","106.73","0.02","90","","3181.6","1.2","150","0.1","423.2","","","","","","","","CH2Cl2/pet ether","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H24 F3 Mn O6 S Te3 -","- C27 H24 F3 Mn O6 S Te3 -","- C108 H96 F12 Mn4 O24 S4 Te12 -","4","1","","Connolly, Julie; Genge, Anthony R. J.; Levason, William; Orchard, Simon D.; Pope, Simon J. A.; Reid, Gillian","Cationic manganese(I) tricarbonyl complexes with group 15 and 16 donor ligands: synthesis, multinuclear NMR spectroscopy and crystal structures","Journal of the Chemical Society, Dalton Transactions","1999","","14","2343","","10.1039/a902820j","","","0.71073","MoKalpha","","","0.0439","","","0.0457","","","","","1.359","1.359","","","","","has coordinates","243849","2020-10-21","18:00:00",""
"7702400","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","","Lau, Sophia S.; Fanwick, Phillip E.; Walton, Richard A.","The first symmetrical tetrarheniumcyclodiyne type cluster containing phosphine ligands: Re4(μ-O)4Cl4[P(C6H4OMe-p)3]4","Journal of the Chemical Society, Dalton Transactions","1999","","14","2273","","10.1039/a903367j","","","0.71073","MO-Kα","","","0.062","","","","0.104","","","","","","1.138","","","","has coordinates","243851","2020-10-21","18:00:00",""
"7702401","13.4333","0.0007","20.8362","0.0011","18.5916","0.001","90","","99.729","0.001","90","","5128.9","0.5","203.15","","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","[Ag(bisimpy)2](PF6)","","","- C38 H54 Ag2 F12 N10 O2 P2 -","- C38 H54 Ag2 F12 N10 O4 P2 -","- C152 H216 Ag8 F48 N40 O16 P8 -","4","1","","Oshio, Hiroki; Yamamoto, Masashi; Ito, Tasuku","Double helical assembly of imino nitroxyl diradicals by silver(I) ions","Journal of the Chemical Society, Dalton Transactions","1999","","15","2641","","10.1039/a903499d","","","0.71073","MoK?a","","0.0733","0.053","","","0.1471","0.1621","","","","","","1.031","","","","has coordinates","243852","2020-10-21","18:00:00",""
"7702402","13.506","0.003","7.6665","0.001","15.374","0.003","90","","100.69","0.02","90","","1564.3","0.5","200","3","200","3","","","","","","","crystal provided by C. Janiak, Uni FR","6","P 1 21/n 1","-P 2yn","14","[(dmbp)(H2O)NiCl2] . CH3NO2","Aqua-dichloro(2,2'-dimethyl-4,4'-bipyrimidine)nickel(II) nitromethane (1:1)","","- C11 H15 Cl2 N5 Ni O3 -","- C11 H15 Cl2 N5 Ni O3 -","- C44 H60 Cl8 N20 Ni4 O12 -","4","1","","Janiak, Christoph; Uehlin, Lars; Wu, He-Ping; Klüfers, Peter; Piotrowski, Holger; Scharmann, Tobias G.","Co-ordination engineering: when can one speak of an “understanding”? Case study of the multidentate ligand 2,2′-dimethyl-4,4′-bipyrimidine †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3121","","10.1039/a904829d","","","0.71073","MoKα","","0.0552","0.0409","","","0.0985","0.1043","","","","","","0.942","","","","has coordinates","243856","2020-10-21","18:00:00",""
"7702403","6.111","0.008","7.445","0.008","9.335","0.008","82.29","0.08","83.07","0.08","67.23","0.08","387","0.8","294","2","294","2","","","","","","","","5","P -1","-P 1","2","[Cu (N O3)2 (C10 H10 N4)]","(μ-2,2'-dimethyl-4,4'-bipyrimidine)-dinitrato-copper(II) ?","","- C5 H5 Cu0.5 N3 O3 -","- C5 H5 Cu0.5 N3 O3 -","- C10 H10 Cu N6 O6 -","2","1","","Janiak, Christoph; Uehlin, Lars; Wu, He-Ping; Klüfers, Peter; Piotrowski, Holger; Scharmann, Tobias G.","Co-ordination engineering: when can one speak of an “understanding”? Case study of the multidentate ligand 2,2′-dimethyl-4,4′-bipyrimidine †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3121","","10.1039/a904829d","","","0.71069","MoKα","","0.0899","0.0726","","0.2087","0.1784","","","","1.078","1.033","1.033","","","","","has coordinates","243856","2020-10-21","18:00:00",""
"7702404","7.7509","0.0012","10.5927","0.0018","4.2001","0.0007","91.81","0.02","101.993","0.018","88.544","0.019","337.08","0.1","200","3","200","3","","","","","","","crystal provided by J. Janiak, Uni FR","5","P -1","-P 1","2","[(dmbp)Cu2I2]","(μ-2,2'-dimethyl-4,4'-bipyrimidine)-di(μ3-iodo)-dicopper(I)","","- C10 H10 Cu2 I2 N4 -","- C10 H10 Cu2 I2 N4 -","- C10 H10 Cu2 I2 N4 -","1","0.5","","Janiak, Christoph; Uehlin, Lars; Wu, He-Ping; Klüfers, Peter; Piotrowski, Holger; Scharmann, Tobias G.","Co-ordination engineering: when can one speak of an “understanding”? Case study of the multidentate ligand 2,2′-dimethyl-4,4′-bipyrimidine †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3121","","10.1039/a904829d","","","0.71073","MoKα","","0.0265","0.0231","","","0.0544","0.0553","","","","","","0.999","","","","has coordinates","243856","2020-10-21","18:00:00",""
"7702405","33.463","0.002","35.0765","0.0018","4.0449","0.0002","90","","90","","90","","4747.8","0.4","200","3","200","3","","","","","","","crystal provided by C. Janiak (Uni FR)","5","F d d 2","F 2 -2d","43","2,2'-dimethyl-4,4'-bipyrimidine.CuI","catena-(2,2'-dimethyl-4,4'-bipyrimidine)-μ-iodo-copper(I)","","- C10 H10 Cu I N4 -","- C10 H10 Cu I N4 -","- C160 H160 Cu16 I16 N64 -","16","1","","Janiak, Christoph; Uehlin, Lars; Wu, He-Ping; Klüfers, Peter; Piotrowski, Holger; Scharmann, Tobias G.","Co-ordination engineering: when can one speak of an “understanding”? Case study of the multidentate ligand 2,2′-dimethyl-4,4′-bipyrimidine †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3121","","10.1039/a904829d","","","0.71073","MoKα","","0.0239","0.0215","","","0.0494","0.0501","","","","","","1.057","","","","has coordinates","243856","2020-10-21","18:00:00",""
"7702406","3.822","0.005","15.405","0.005","19.739","0.005","90","","90","","90","","1162.2","1.6","200","3","200","3","","","","","","","crstal provided by C. Janiak, Uni FR","5","P b c n","-P 2n 2ab","60","[Ag(dmbp)(NO3)]","μ-(2,2'-dimethyl-4,4'-bipyrimidine)-μ-nitrato-silver(I)","","- C10 H10 Ag N5 O3 -","- C10 H10 Ag N5 O3 -","- C40 H40 Ag4 N20 O12 -","4","0.5","","Janiak, Christoph; Uehlin, Lars; Wu, He-Ping; Klüfers, Peter; Piotrowski, Holger; Scharmann, Tobias G.","Co-ordination engineering: when can one speak of an “understanding”? Case study of the multidentate ligand 2,2′-dimethyl-4,4′-bipyrimidine †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3121","","10.1039/a904829d","","","0.71073","MoKα","","0.0345","0.0236","","","0.0559","0.0586","","","","","","0.988","","","","has coordinates","243856","2020-10-21","18:00:00",""
"7702407","7.068","0.008","21.811","0.015","19.408","0.015","90","","90","","90","","2992","5","293","2","293","2","","","","","","","C. Janiak, Uni Freiburg","5","P c n a :2","-P 2a 2c","50","[Ag3 (N O3)3 (C10 H10 N4)2]","bis(μ3-2,2'-dimethyl-4,4'-bipyrimidine)-tris(μ3-nitrato)-trisilver(I)","","- C10 H10 Ag1.5 N5.5 O4.5 -","- C10 H10 Ag1.5 N5.5 O4.75 -","- C80 H80 Ag12 N44 O38 -","8","1","","Janiak, Christoph; Uehlin, Lars; Wu, He-Ping; Klüfers, Peter; Piotrowski, Holger; Scharmann, Tobias G.","Co-ordination engineering: when can one speak of an “understanding”? Case study of the multidentate ligand 2,2′-dimethyl-4,4′-bipyrimidine †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3121","","10.1039/a904829d","","","0.71069","MoKα","","0.2154","0.0973","","0.3477","0.2336","","","","1.454","2.002","2.002","","","","","has coordinates,has disorder","243856","2020-10-21","18:00:00",""
"7702408","17.1706","0.0011","10.8107","0.0007","21.3415","0.0013","90","","109.697","0.007","90","","3729.7","0.4","200","3","200","3","","","","","","","crystal provided by C. Janiak, Uni FR","6","I 1 2/a 1","-I 2ya","15","[(C10 H10 N4)2 Ag3](BF4)3 . 3 CH3CN","tris(acetonitrile)-bis(μ-2,2'-dimethyl-4,4'-bipyrimidine)-trisilver(I) tetrafluoroborate","","- C26 H29 Ag3 B3 F12 N11 -","- C26 H29 Ag3 B3 F12 N11 -","- C104 H116 Ag12 B12 F48 N44 -","4","0.5","","Janiak, Christoph; Uehlin, Lars; Wu, He-Ping; Klüfers, Peter; Piotrowski, Holger; Scharmann, Tobias G.","Co-ordination engineering: when can one speak of an “understanding”? Case study of the multidentate ligand 2,2′-dimethyl-4,4′-bipyrimidine †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3121","","10.1039/a904829d","","","0.71073","MoKα","","0.0325","0.0291","","","0.0755","0.0771","","","","","","1.033","","","","has coordinates","243856","2020-10-21","18:00:00",""
"7702409","17.3846","0.0011","10.9689","0.001","21.9716","0.0014","90","","105.148","0.007","90","","4044.2","0.5","200","3","200","3","","","","","","","crystal provided by C. Janiak, Uni FR","6","I 1 2/a 1","-I 2ya","15","[(C10 H10 N4)2 Ag3](PF6)3 . 3 CH3CN","tris(acetonitrile)-bis(μ-2,2'-dimethyl-4,4'-bipyrimidine)-trisilver(I) hexafluorophosphate","","- C26 H29 Ag3 F18 N11 P3 -","- C26 H29 Ag3 F18 N11 P3 -","- C104 H116 Ag12 F72 N44 P12 -","4","0.5","","Janiak, Christoph; Uehlin, Lars; Wu, He-Ping; Klüfers, Peter; Piotrowski, Holger; Scharmann, Tobias G.","Co-ordination engineering: when can one speak of an “understanding”? Case study of the multidentate ligand 2,2′-dimethyl-4,4′-bipyrimidine †","Journal of the Chemical Society, Dalton Transactions","1999","","17","3121","","10.1039/a904829d","","","0.71073","MoKα","","0.0403","0.0364","","","0.0974","0.0996","","","","","","1.046","","","","has coordinates","243856","2020-10-21","18:00:00",""
"7702410","9.017","0.0005","11.4957","0.0006","22.1396","0.0012","79.136","0.001","82.101","0.001","88.93","0.001","2232.3","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C46 H34 Cl N9 O7 Ru -","- C46 H34 Cl N9 O7 Ru -","- C92 H68 Cl2 N18 O14 Ru2 -","2","1","","Chao, Hui; Li, Run-Hua; Ye, Bao-Hui; Li, Hong; Feng, Xiao-Long; Cai, Ji-Wen; Zhou, Jian-Ying; Ji, Liang-Nian","Syntheses, characterization and third order non-linear optical properties of the ruthenium(II) complexes containing 2-phenylimidazo[4,5-f ][1,10]phenanthroline derivatives †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3711","","10.1039/a905790k","","","0.71073","MoKα","","0.0596","0.0475","","","0.1299","0.1399","","","","","","1.037","","","","has coordinates","243857","2020-10-21","18:00:00",""
"7702411","17.545","0.003","8.2966","0.0009","19.997","0.003","90","","110.91","0.01","90","","2719.1","0.7","293","2","293","2","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C21 H27 B N9 O2 Re S Si -","- C21 H27 B N9 O2 Re S Si -","- C84 H108 B4 N36 O8 Re4 S4 Si4 -","4","1","","Paulo, António; Domingos, Ângela; Santos, Isabel","Control of the hapticity of pyridine-2-thiolate ligands in rhenium(V) oxo complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3735","","10.1039/a905911c","","","0.71073","MoKα","","0.1369","0.075","","0.1892","0.1358","","","","1.113","1.088","1.088","","","","","has coordinates","243858","2020-10-21","18:00:00",""
"7702412","10.419","0.001","25.297","0.002","11.582","0.001","90","","94.35","0.02","90","","3043.9","0.5","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C27 H25 B N11 O Re S3 -","- C27 H25 B N11 O Re S3 -","- C108 H100 B4 N44 O4 Re4 S12 -","4","1","","Paulo, António; Domingos, Ângela; Santos, Isabel","Control of the hapticity of pyridine-2-thiolate ligands in rhenium(V) oxo complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3735","","10.1039/a905911c","","","0.71073","MoKα","","0.1004","0.0507","","0.1148","0.0747","","","","1.104","1.118","1.118","","","","","has coordinates","243858","2020-10-21","18:00:00",""
"7702413","8.513","0.0006","9.1937","0.0008","16.678","0.002","80.472","0.009","81.748","0.009","89.193","0.006","1273.9","0.2","293","2","293","2","","","","","","","","8","P -1","-P 1","2","","","","- C18 H19 B Cl4 N9 O Re S -","- C18 H19 B Cl4 N9 O Re S -","- C36 H38 B2 Cl8 N18 O2 Re2 S2 -","2","1","","Paulo, António; Domingos, Ângela; Santos, Isabel","Control of the hapticity of pyridine-2-thiolate ligands in rhenium(V) oxo complexes †","Journal of the Chemical Society, Dalton Transactions","1999","","21","3735","","10.1039/a905911c","","","0.71073","MoKα","","0.0689","0.0481","","0.108","0.0937","","","","1.143","1.099","1.099","","","","","has coordinates","243858","2020-10-21","18:00:00",""
"7702414","13.824","0.003","9.671","0.003","15.292","0.002","90","","112.35","0.01","90","","1890.8","0.8","297.2","","297.2","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C29 H43 Cl4 O7 P Ru S3 -","- C29 H43 Cl4 O7 P Ru S3 -","- C58 H86 Cl8 O14 P2 Ru2 S6 -","2","1","","Yamamoto, Yasuhiro; Sugawara, Ken-ichiro; Aiko, Tsuyoshi; Ma, Jian-Fang","Reaction of [RuCl2(DMSO)4] with aromatic phosphines bearing ortho-methoxy groups †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4003","","10.1039/a906435d","","","0.7107","MoKα","","","0.0373","","","0.0405","","","","","1.352","1.352","","","","","has coordinates","243859","2020-10-21","18:00:00",""
"7702415","14.253","0.003","16.592","0.003","12.623","0.003","102.13","0.02","110.07","0.02","102.09","0.02","2609.3","1.1","298.2","","298.2","","","","","","","","compound4b","7","P -1","-P 1","2","","","","- C48 H59 Cl4 O10 P2 Ru S2 -","- C48 H59 Cl4 O10 P2 Ru S2 -","- C96 H118 Cl8 O20 P4 Ru2 S4 -","2","1","","Yamamoto, Yasuhiro; Sugawara, Ken-ichiro; Aiko, Tsuyoshi; Ma, Jian-Fang","Reaction of [RuCl2(DMSO)4] with aromatic phosphines bearing ortho-methoxy groups †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4003","","10.1039/a906435d","","","0.7107","MoKα","","","0.0509","","","0.0645","","","","","1.879","1.879","","","","","has coordinates","243859","2020-10-21","18:00:00",""
"7702416","11.441","0.005","19.851","0.003","19.068","0.003","90","","93.17","0.02","90","","4324","2","299.2","","299.2","","","","","","","","compound 5a","7","P 1 21/n 1","-P 2yn","14","","","","- C47 H46 Cl2 N3 O2 P Ru -","- C47 H46 Cl2 N3 O2 P Ru -","- C188 H184 Cl8 N12 O8 P4 Ru4 -","4","1","","Yamamoto, Yasuhiro; Sugawara, Ken-ichiro; Aiko, Tsuyoshi; Ma, Jian-Fang","Reaction of [RuCl2(DMSO)4] with aromatic phosphines bearing ortho-methoxy groups †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4003","","10.1039/a906435d","","","0.7107","MoKα","","","0.0477","","","0.0654","","","","","1.297","1.297","","","","","has coordinates","243859","2020-10-21","18:00:00",""
"7702417","11.667","0.003","20.205","0.004","19.932","0.004","90","","93.17","0.02","90","","4691.4","1.8","299.2","","299.2","","","","","","","","compound 5b","7","P 1 21/n 1","-P 2yn","14","","","","- C50 H52 Cl2 N3 O2 P Ru -","- C50 H52 Cl2 N3 O2 P Ru -","- C200 H208 Cl8 N12 O8 P4 Ru4 -","4","1","","Yamamoto, Yasuhiro; Sugawara, Ken-ichiro; Aiko, Tsuyoshi; Ma, Jian-Fang","Reaction of [RuCl2(DMSO)4] with aromatic phosphines bearing ortho-methoxy groups †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4003","","10.1039/a906435d","","","0.7107","MoKα","","","0.0534","","","0.1113","","","","","1.898","1.898","","","","","has coordinates","243859","2020-10-21","18:00:00",""
"7702418","13.7","0.01","14.555","0.009","12.346","0.007","101.25","0.05","114.69","0.05","68.35","0.05","2077","3","299.2","","299.2","","","","","","","","compound6","6","P -1","-P 1","2","","","","- C42 H40 Cl4 O5 P2 Ru -","- C42 H40 Cl4 O5 P2 Ru -","- C84 H80 Cl8 O10 P4 Ru2 -","2","1","","Yamamoto, Yasuhiro; Sugawara, Ken-ichiro; Aiko, Tsuyoshi; Ma, Jian-Fang","Reaction of [RuCl2(DMSO)4] with aromatic phosphines bearing ortho-methoxy groups †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4003","","10.1039/a906435d","","","0.7107","MoKα","","","0.0725","","","0.0984","","","","","1.911","1.911","","","","","has coordinates","243859","2020-10-21","18:00:00",""
"7702419","15.805","0.004","13.353","0.003","13.251","0.002","83.32","0.02","83.92","0.02","87.91","0.02","2761.1","1","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C63 H53 Ag N3 O3 P3 -","- C63 H53 Ag N3 O3 P3 -","- C126 H106 Ag2 N6 O6 P6 -","2","1","","Cingolani, Augusto; Effendy,; Marchetti, Fabio; Pettinari, Claudio; Skelton, Brian W.; White, Allan H.","Synthesis and structural systematics of mixed triphenylphosphine/imidazole base adducts of silver(I) oxyanion salts †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4047","","10.1039/a906624a","","","0.71073","MoKα","","0.076","0.048","","0.051","","0.046","","","1.395","","","1.55","","","","has coordinates","243860","2020-10-21","18:00:00",""
"7702420","12.947","0.007","15.034","0.002","20.551","0.002","90","","99.43","0.03","90","","3946","2","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H38 Ag N5 O3 P2 -","- C42 H38 Ag N5 O3 P2 -","- C168 H152 Ag4 N20 O12 P8 -","4","1","","Cingolani, Augusto; Effendy,; Marchetti, Fabio; Pettinari, Claudio; Skelton, Brian W.; White, Allan H.","Synthesis and structural systematics of mixed triphenylphosphine/imidazole base adducts of silver(I) oxyanion salts †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4047","","10.1039/a906624a","","","0.71073","MoKα","","0.164","0.069","","0.104","","0.068","","","1.056","","","1.137","","","","has coordinates","243860","2020-10-21","18:00:00",""
"7702421","21.888","0.002","9.895","0.003","19.241","0.004","90","","92.09","0.01","90","","4164.5","1.6","293","","293","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C44 H42 Ag N5 O3 P2 -","- C44 H42 Ag N5 O3 P2 -","- C176 H168 Ag4 N20 O12 P8 -","4","0.5","","Cingolani, Augusto; Effendy,; Marchetti, Fabio; Pettinari, Claudio; Skelton, Brian W.; White, Allan H.","Synthesis and structural systematics of mixed triphenylphosphine/imidazole base adducts of silver(I) oxyanion salts †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4047","","10.1039/a906624a","","","0.71073","MoKα","","0.051","0.041","","0.044","","0.043","","","1.658","","","1.75","","","","has coordinates","243860","2020-10-21","18:00:00",""
"7702422","13.684","0.001","12.965","0.002","23.464","0.003","90","","116.461","0.008","90","","3726.7","0.8","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C40 H36 Ag N3 O3 P2 -","- C40 H36 Ag N3 O3 P2 -","- C160 H144 Ag4 N12 O12 P8 -","4","1","","Cingolani, Augusto; Effendy,; Marchetti, Fabio; Pettinari, Claudio; Skelton, Brian W.; White, Allan H.","Synthesis and structural systematics of mixed triphenylphosphine/imidazole base adducts of silver(I) oxyanion salts †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4047","","10.1039/a906624a","","","0.71073","MoKα","","0.128","0.052","","0.066","","0.048","","","1.248","","","1.47","","","","has coordinates","301878","2025-08-22","23:10:56",""
"7702423","14.516","0.005","14.219","0.005","10.022","0.004","89.71","0.03","71.83","0.03","62.54","0.03","1720.2","1.3","293","","293","","","","","","","","","7","P -1","-P 1","2","","","","- C32 H33 Ag F3 N6 O2 P -","- C32 H33 Ag F3 N6 O2 P -","- C64 H66 Ag2 F6 N12 O4 P2 -","2","1","","Cingolani, Augusto; Effendy,; Marchetti, Fabio; Pettinari, Claudio; Skelton, Brian W.; White, Allan H.","Synthesis and structural systematics of mixed triphenylphosphine/imidazole base adducts of silver(I) oxyanion salts †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4047","","10.1039/a906624a","","","0.71073","MoKα","","0.087","0.047","","0.05","","0.043","","","1.416","","","1.668","","","","has coordinates","243860","2020-10-21","18:00:00",""
"7702424","29.421","0.003","9.27","0.001","19.122","0.002","90","","117.888","0.001","90","","4609.5","0.8","153","","153","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C46 H48 Ag2 N4 O6 P2 S2 -","- C46 H48 Ag2 N4 O6 P2 S2 -","- C184 H192 Ag8 N16 O24 P8 S8 -","4","0.5","","Cingolani, Augusto; Effendy,; Marchetti, Fabio; Pettinari, Claudio; Skelton, Brian W.; White, Allan H.","Synthesis and structural systematics of mixed triphenylphosphine/imidazole base adducts of silver(I) oxyanion salts †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4047","","10.1039/a906624a","","","0.71073","MoKα","","0.027","0.023","","0.034","","0.032","","","1.057","","","1.08","","","","has coordinates","243860","2020-10-21","18:00:00",""
"7702425","11.972","0.005","10.496","0.006","17.976","0.017","90","","111.24","0.06","90","","2105","3","293","","293","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C42 H38 Ag2 N6 O4 P2 -","- C42 H38 Ag2 N6 O4 P2 -","- C84 H76 Ag4 N12 O8 P4 -","2","0.5","","Cingolani, Augusto; Effendy,; Marchetti, Fabio; Pettinari, Claudio; Skelton, Brian W.; White, Allan H.","Synthesis and structural systematics of mixed triphenylphosphine/imidazole base adducts of silver(I) oxyanion salts †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4047","","10.1039/a906624a","","","0.71073","MoKα","","0.045","0.037","","0.057","","0.054","","","1.539","","","1.61","","","","has coordinates","243860","2020-10-21","18:00:00",""
"7702426","18.869","0.007","14.603","0.004","19.523","0.004","90","","112.1","0.02","90","","4984","3","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29.5 H69 Li3 N12 Si6 -","- C29.5 H63 Li3 N12 Si6 -","- C118 H252 Li12 N48 Si24 -","4","1","","Boesveld, W. Marco; Hitchcock, Peter B.; Lappert, Michael F.","Reactions of 1,3,5-triazine with organolithium compounds containing trimethylsilyl substituents; X-ray structures of 1,3,5-triaza- and 1,3,5,7-tetraaza-heptatrienyllithium compounds †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4041","","10.1039/a907375b","","","0.71073","MoKα","","0.1186","0.061","","0.1608","0.1316","","","","1.02","1.095","1.095","","","","","has coordinates","243861","2020-10-21","18:00:00",""
"7702427","13.022","0.003","8.134","0.004","22.607","0.006","90","","106.43","0.02","90","","2296.8","1.4","173","2","173","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","[Li2(thf){Me3SiNCHNCHNCH(SiMe3)2}2]","","","- C30 H68 Li2 N6 O Si6 -","- C30 H68 Li2 N6 O Si6 -","- C60 H136 Li4 N12 O2 Si12 -","2","0.5","","Boesveld, W. Marco; Hitchcock, Peter B.; Lappert, Michael F.","Reactions of 1,3,5-triazine with organolithium compounds containing trimethylsilyl substituents; X-ray structures of 1,3,5-triaza- and 1,3,5,7-tetraaza-heptatrienyllithium compounds †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4041","","10.1039/a907375b","","","0.71073","MoKα","","0.1112","0.0621","","0.1615","0.1361","","","","1.044","1.114","1.114","","","","","has coordinates","243861","2020-10-21","18:00:00",""
"7702428","28.389","0.005","11.343","0.002","10.29","0.002","90","","90","","90","","3313.5","1","173","2","173","2","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C22 H53 Li N6 Si3 -","- C22 H55 Li N6 Si3 -","- C88 H220 Li4 N24 Si12 -","4","0.5","","Boesveld, W. Marco; Hitchcock, Peter B.; Lappert, Michael F.","Reactions of 1,3,5-triazine with organolithium compounds containing trimethylsilyl substituents; X-ray structures of 1,3,5-triaza- and 1,3,5,7-tetraaza-heptatrienyllithium compounds †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4041","","10.1039/a907375b","","","0.71073","MoKα","","0.1059","0.0605","","0.1575","0.1362","","","","1.025","1.122","1.122","","","","","has coordinates","243861","2020-10-21","18:00:00",""
"7702429","10.047","0.003","12.148","0.004","13.646","0.003","82.42","0.02","76.68","0.02","76.74","0.02","1572","0.8","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H88 Li4 N12 Si8 -","- C40 H88 Li4 N12 Si8 -","- C40 H88 Li4 N12 Si8 -","1","0.5","","Boesveld, W. Marco; Hitchcock, Peter B.; Lappert, Michael F.","Reactions of 1,3,5-triazine with organolithium compounds containing trimethylsilyl substituents; X-ray structures of 1,3,5-triaza- and 1,3,5,7-tetraaza-heptatrienyllithium compounds †","Journal of the Chemical Society, Dalton Transactions","1999","","22","4041","","10.1039/a907375b","","","0.71073","MoKα","","0.0769","0.0481","","0.1242","0.1088","","","","1.03","1.067","1.067","","","","","has coordinates","243861","2020-10-21","18:00:00",""
"7702430","9.891","0.011","12.416","0.014","26.81","0.03","90","","90","","90","","3292","6","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C31 H37 Cl2 Cu N7 O8 -","- C31 H37 Cl2 Cu N7 O8 -","- C124 H148 Cl8 Cu4 N28 O32 -","4","1","","Costa, Judite; Delgado, Rita; Drew, Michael G. B.; Félix, Vitor","Methyl pyridine derivatives of 14-membered tetraaza macrocycles. A new host with high selectivity for cadmium †","Journal of the Chemical Society, Dalton Transactions","1999","","24","4331","","10.1039/a907512g","","","0.71073","MoKα","","0.1294","0.0933","","","0.2644","0.2986","","","","","","1.16","","","","has coordinates","301878","2025-08-22","23:10:56",""
"7702431","22.761","0.013","13.423","0.007","24.023","0.01","90","","108.216","0.017","90","","6972","6","220","","220","","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C53 H102 Cl2 Gd2 Mn2 O24 -","- C53 H102 Cl2 Gd2 Mn2 O24 -","- C212 H408 Cl8 Gd8 Mn8 O96 -","4","0.5","","Benelli, Cristiano; Murrie, Mark; Parsons, Simon; Winpenny, Richard E. P.","Synthesis, structural and magnetic characterisation of a new Mn‒Gd pivalate: preparation from a pre-formed hexanuclear cluster †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4125","","10.1039/a907977g","","","0.71073","MoKα","","0.1663","0.0767","","","0.1578","0.2033","","","","","","1.011","","","","has coordinates","243863","2020-10-21","18:00:00",""
"7702432","22.641","0.009","13.418","0.004","24.024","0.008","90","","108.15","0.03","90","","6935","4","200","2","200","2","","","","","","","","6","I 1 2/a 1","-I 2ya","15","","","","- C53 H102 Cl2 Dy2 Mn2 O24 -","- C53 H102 Cl2 Dy2 Mn2 O24 -","- C212 H408 Cl8 Dy8 Mn8 O96 -","4","0.5","","Benelli, Cristiano; Murrie, Mark; Parsons, Simon; Winpenny, Richard E. P.","Synthesis, structural and magnetic characterisation of a new Mn‒Gd pivalate: preparation from a pre-formed hexanuclear cluster †","Journal of the Chemical Society, Dalton Transactions","1999","","23","4125","","10.1039/a907977g","","","0.71073","MoKα","","0.0476","0.0327","","","0.0619","0.0687","","","","","","1.042","","","","has coordinates","243863","2020-10-21","18:00:00",""
"8101403","7.6365","0.0013","8.5086","0.0012","10.7161","0.0015","93.096","0.017","97.968","0.019","106.367","0.018","658.44","0.17","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H15 Cu N3 O5 -","- C11 H15 Cu N3 O5 -","- C22 H30 Cu2 N6 O10 -","2","1","","Warda, Salam A.","Crystal structure of dimeric aqua(N-salicylidene-rac-alaninato-O,N, O')copper(II)–urea (1/1), C~11~H~15~CuN~3~O~5~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","77","78","","","","","","","","0.0438","","","0.0774","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101404","5.895","0.003","7.505","0.005","18.909","0.007","90","","90","","90","","836.6","0.8","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H8 Cl N O4 -","- C6 H8 Cl N O4 -","- C24 H32 Cl4 N4 O16 -","4","1","","Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; Alte da Veiga, L.; Martin-Gil, J.","Crystal structure of anilinium perchlorate, C~6~H~5~NH~3~^+^ClO~4~^‒^","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","85","86","","","","","","","","0.0389","","","0.0916","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101405","26.564","0.004","15.377","0.002","20.617","0.003","90","","124.74","","90","","6920.4","1.7","150","","150","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C31.5 H38 Cl Fe I3 N P -","- C31.5 H38 Cl Fe I3 N P -","- C252 H304 Cl8 Fe8 I24 N8 P8 -","8","1","","Kliß, Rainer; Hauptmann, Ralf; Henkel, Gerald","Crystal structure of benzyltriethylammonium triiodo(triphenylphosphino) iron(II)‒dichloromethane(1.0/0.5), [C~13~H~22~N][FeI~3~P(C~6~H~5~) ~3~] · 0.5CH~2~Cl~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","135","136","","","","","","","","0.0272","","","0.0656","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101406","15.371","0.006","13.422","0.005","16.751","0.006","90","","100.67","0.03","90","","3396","2","150","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C56 H122 Fe2 N2 O4 S6 -","- C56 H122 Fe2 N2 O4 S6 -","- C112 H244 Fe4 N4 O8 S12 -","2","0.5","","Hauptmann, Ralf; Lackmann, Jörg; Henkel, Gerald","Crystal structure of tetraethylammonium anti-bis(μ-cyclohexane- thiolato)-tetrakis(cyclohexanethiolato)diiron(II)‒tetrakismethanol, [(C~2~H~5~)~4~N]~2~[Fe~2~(SC~6~H~11~)~6~] · 4CH~3~OH","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","132","134","","","","","","","","0.0692","","","0.1558","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101407","9.671","0.002","9.324","0.001","15.17","0.002","90","","92","0.01","90","","1367.1","0.4","150","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C14 H42 Fe2 N2 S6 -","- C14 H42 Fe2 N2 S6 -","- C28 H84 Fe4 N4 S12 -","2","0.5","","Chen, Changneng; Hauptmann, Ralf; Lackmann, Jörg; Henkel, Gerald","Crystal structure of tetramethylammonium anti-bis(μ-methanethiolato)- tetrakis(methanethiolato)diiron(II), [(CH~3~)~4~N]~2~[Fe~2~(SCH~3~) ~6~]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","137","138","","","","","","","","0.0253","","","0.0621","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101408","17.379","0.003","9.637","0.002","30.759","0.006","90","","90","","90","","5151.6","1.7","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","bis(1,5 diamino-2-methyl-pentane) bis(zirconium) tetra(nitrilotriacetate) tetrahydrate","","","- C18 H34 N4 O14 Zr -","- C36 H68 N8 O28 Zr2 -","- C144 H272 N32 O112 Zr8 -","4","1","","Haussuühl, Eiken; Schreuer, Juergen","Crystal structure of 1,5-diamino-2-methylpentane zirconium bis(nitrilotriacetate) dihydrate, NH~3~(CH~2~)~3~CHCH~3~CH~2~NH~3~ Zr[N(CH~2~COO)~3~]~2~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","71","73","","","","","","","","0.0291","","","0.0582","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101409","8.632","0.002","13.73","0.003","14.765","0.003","64.83","0.03","89.54","0.03","80.85","0.03","1560.1","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H15 N O S -","- C20 H15 N O S -","- C80 H60 N4 O4 S4 -","4","2","","Spirlet, Marie-Rose; Mohsine, Abdelaziz; Christians, Léon","Crystal structure of N-benzyl-dibenzo[d,f]-1,2-thiazepin-3-one, C~20~H~15~NOS","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","139","140","","","","","","","","0.0514","","","0.0884","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101410","7.1812","0.0002","13.8521","0.0001","19.161","0.0004","90","","91.099","0.001","90","","1905.68","0.07","213","2","213","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H20 Br2 N4 O3 -","- C15 H20 Br2 N4 O3 -","- C60 H80 Br8 N16 O12 -","4","1","","Bustamante, Carlos D.; Staples, Richard J.","Crystal structure of 1,1-trimethylenebis[4-(hydroxyiminomethyl)pyridinium bromide] hydrate, (C~15~H~18~N~4~O~2~)Br~2~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","141","142","","","","","","","","0.0324","","","0.0568","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101411","13.098","0.002","23.673","0.003","13.289","0.002","90","","90.15","0.014","90","","4120.5","1.1","298","2","293","2","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C44 H34 Cl2 F3 O2 P2 Re S -","- C44 H34 Cl2 F3 O2 P2 Re S -","- C176 H136 Cl8 F12 O8 P8 Re4 S4 -","4","1","","Sawusch, S.; Schilde, U.","Crystal structure of dichloro[4,4,4-trifluoro-1-(2'-thienyl)butane-1,3- dionato]-bis(triphenylphosphine)rhenium(III), [Re(C~44~H~34~Cl~2~F~3~O~2~P~2~S)]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","81","82","","","","","","","","0.0347","","","0.09","","","","","","","","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101412","7.9152","0.0008","7.7166","0.0006","10.4111","0.0009","90","","111","","90","","591.68","0.08","296","1","296","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C7 H13 N O9 S -","- C7 H12 N O9 S -","- C14 H24 N2 O18 S2 -","2","1","","Shan, Yongkui; Huang, Songping D.","Crystal structure of L-cysteine L-tartarte monohydrate, C~7~H~15~NO~9~S","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","41","42","","","","","","","","0.0353","","","0.0591","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101413","8.97","0.004","15.315","0.002","16.023","0.002","90","","100.49","0.03","90","","2164.4","0.9","298","1","298","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H42 Si2 -","- C18 H42 Si2 -","- C72 H168 Si8 -","4","1","","Antomattei, Augie; Soderquist, John A.; Huang, Songping D.","Crystal structure of hexaisopropyldisilane, C~18~H~42~Si~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","43","44","","","","","","","","0.0439","","","","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101414","15.597","0.002","9.688","0.001","21.931","0.003","90","","94.17","0.01","90","","3305.1","0.7","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C29 H38 Ce N5 O4 S3 -","- C29 H38 Ce N5 O4 S3 -","- C116 H152 Ce4 N20 O16 S12 -","4","1","","Saleh, Muhammad Idiris; Salhin, Abdussalam; Talipov, Samat; Saad, Bahruddin; Fun, Hoong-Kun; Razak Ibrahim, Abdul","Crystal structure of N,N'-dibenzyl-1,14,10,13-tetraoxa-7,16- diazacyclooctadecane cerium(III) thiocyanate, C~29~H~38~CeN~5~O~4~S~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","45","46","","","","","","","","0.0333","","","0.0808","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101415","9.2","0.006","15.134","0.005","13.722","0.006","90","","90","","90","","1910","1","200","","200","","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C9 H18 Cl N3 S6 Te -","- C9 H18 Cl N3 S6 Te -","- C36 H72 Cl4 N12 S24 Te4 -","4","1","","Cox, M. J.; Tiekink, E. R. T.","Crystal structure of chlorotris(dimethyldithiocarbamato)tellurium(IV), [Te(S~2~CNMe~2~)~3~Cl]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","49","50","","","","","","","","0.0353","","","0.0435","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101416","6.4522","0.001","6.4547","0.0015","8.3603","0.0017","82.504","0.011","82.56","0.02","80.982","0.017","338.82","0.12","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- B2 H6 Mg4 O20 P4 -","- B2 Mg4 O20 P4 -","- B2 Mg4 O20 P4 -","1","1","","Hauf, Cornelia; Boy, Insan; Kniep, Rüdiger","Crystal structure of dimagnesium (monohydrogenmonophosphate- dihydrogenmonoborate-monophosphate), Mg~2~[BP~2~O~7~(OH)~3~]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","3","4","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101417","9.923","","15.437","","13.731","","90","","99.01","","90","","2077.3","","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","[(phenanthroline)(1-phenyl)-4,4,4-trifluoro-1,3-butanedianto)(O-nitrato)- copper(II)]","","- C22 H14 Cu F3 N3 O5 -","- C22 H14 Cu F3 N3 O5 -","- C88 H56 Cu4 F12 N12 O20 -","4","1","","Voutsas, G. P.","Crystal structure of [(phenanthroline)(1-phenyl-4,4,4-trifluoro-1, 3-butanedionato)(O-nitrato)copper(II)], CuF~3~O~2~N~2~C~22~H~14~[NO~3~]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","31","32","","","","","","","","0.0429","","","0.1279","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101418","6.296","0.005","8.204","0.007","8.653","0.008","71.92","0.06","80.61","0.07","83.84","0.06","418.4","0.6","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","Trans-bis[2-hydroxy5-methylaceophenone-oximato]Ni(II)","","- C18 H20 N2 Ni O4 -","- C18 H20 N2 Ni O4 -","- C18 H20 N2 Ni O4 -","1","0.5","","Voutsas, G. P.; Keramidas, K. G.; Dova, E.; Lalia-Kantouri, M.; Hartophylles, M.","Crystal structure of trans-bis[2-hydroxy-5-methyl-phenonethanone– oximato-N,O]nickel(II), C~18~H~20~N~2~NiO~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","33","34","","","","","","","","0.0448","","","0.1145","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101419","11.771","0.009","18.684","0.006","13.97","0.01","90","","103.9","0.04","90","","2981.7","3.2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C34 H41 Cl O Ti -","- C34 H41 Cl O Ti -","- C136 H164 Cl4 O4 Ti4 -","4","1","","Werner, Helmut; Schmittel, Michael","Crystal structure of chloro-di-η^5^-cyclopentadienyl-[1,1-dimesityl- 3,3-dimethyl-1-buten-2-oxy]titan(IV), C~34~H~41~ClOTi","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","47","48","","","","","","","","0.0457","","","0.1067","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101420","10.403","0.001","13.55","0.002","20.343","0.002","90","","101.92","0.01","90","","2805.7","0.6","293","","293","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H39 Cl3 Cu2 N6 O9 -","- C16 H38 Cl3 Cu2 N6 O13 -","- C64 H152 Cl12 Cu8 N24 O52 -","4","1","","Elliot, David J.; Martin, Lisandra L.","Crystal structure of bis(1,4-dimethyl-1,4,7-triazacyclononyl)-μ- chloro-μ-hydroxodicopper(II) perchlorate, C~16~H~39~ClCu~2~N~6~O (ClO~4~)~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","38","40","","","","","","","","0.068","","","0.084","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8101421","28.541","0.003","7.2661","0.0008","16.032","0.002","90","","104.607","0.002","90","","3217.2","0.5","298.2","","298.2","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C19 H18 O3 -","- C19 H18 O3 -","- C152 H144 O24 -","8","1","","Zhou, Hongping; Lai, Chunqiu; Montes, Ingrid","Crystal structure of 1,5-bis(2-methoxyphenyl)-1,4-pentadien-3-one, C~19~H~18~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","53","54","","","","","","","","0.057","","","0.0708","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101422","9.936","0.002","9.936","0.002","5.1632","0.0006","90","","90","","90","","509.7","0.2","293","2","293","2","","","","","","","","4","P 4/n b m :2","-P 4a 2b","125","","","","- As4 Ca Na2 O12 -","- As4 Ca Na2 O12 -","- As8 Ca2 Na4 O24 -","2","0.125","","Graia, Mohsen; Driss, Ahmed; Jouini, Tahar","Crystal structure of sodium calcium cyclo-tetraarsenate(V), CaNa~2~As~4~O~12~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","1","2","","","","","","","","0.0257","","","0.0496","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"8101423","10.7656","0.0012","10.7656","0.0012","3.842","0.0005","90","","90","","90","","445.28","0.09","293","2","293","2","","","","","","","","2","I 4/m","-I 4","87","","","","- Te4 Zr5 -","- Te4 Zr5 -","- Te8 Zr10 -","2","0.125","","Örlygsson, Gissur; Harbrecht, Bernd","Crystal structure of pentazirconium tetratelluride, Zr~5~Te~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","5","6","","","","","","","","0.0151","","","0.0346","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101424","6.64","0.001","17.034","0.001","14.168","0.001","90","0.001","93.651","0.001","90","0.001","1599.2","0.4","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H21 Br O4 -","- C17 H21 Br O4 -","- C68 H84 Br4 O16 -","4","1","","Yates, Matthew H.; Ciufoloni, Marco A.; Bavoux, C.; Perrin, M.","Crystal structure of 2-(bromomethyl)-spiro[2,3-dihydro-5-methoxybenzofuran- 3,1'(4',4'-ethylendioxy)cyclohexane], C~17~H~21~BrO~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","55","56","","","","","","","","0.048","","","0.1368","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101425","6.385","0.001","8.925","0.002","13.45","0.003","91.25","0.03","103.65","0.03","108.93","0.03","700.5","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","oxovanadium(IV)hydrogen phosphate tetrahydrate","","","- H9 O9 P V -","- H18 O18 P2 V2 -","- H36 O36 P4 V4 -","2","1","","Fratzky, Dietmar; Worzala, Horst; Goetze, Thomas; Meisel, Manfred","Redetermination of the crystal structure of oxovanadium(IV)hydrogen phosphate tetrahydrate, VOHPO~4~ · 4H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","9","10","","","","","","","","0.0337","","","0.0976","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101426","9.637","0.003","13.453","0.004","25.163","0.009","90","0","97.86","0.02","90","0","3231.6","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H12 Cu N2 O4 -","- C20 H12 Cu N2 O4 -","- C160 H96 Cu8 N16 O32 -","8","1","","Pardo, Olivier; Tomas, Alain; Viossat, Bernard; Bachet, Bernard; Nguyen-Huy, Dung","Crystal structure of bis[N,O-1-isoquinolinecarboxylato]copper(II), C~20~H~12~CuN~2~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","61","62","","","","","","","","0.0641","","","0.1986","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101427","12.0005","0.0007","6.2388","0.0009","16.9734","0.0015","90","","110.609","0.006","90","","1189.5","0.2","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 O2 -","- C16 H16 O2 -","- C64 H64 O8 -","4","1","","Güneş, Bilal; Soylu, Hüseyin; Özbey, Süheyla; Aydın, Ali","Crystal structure of 1,4:5,8-dimethano-1,1a,4,4a,5,5a,8,8a-octahydro- anthracene-9,10-dione, C~16~H~16~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","29","30","","","","","","","","0.0474","","","0.1084","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101428","14.024","0.005","14.024","0.005","16.785","0.005","90","","90","","90","","3301","2","193","2","193","2","","","","","","","","5","I 41/a :2","-I 4ad","88","","","","- C8 H8 N Na O -","- C8 H8 N Na O -","- C128 H128 N16 Na16 O16 -","16","1","","Czado, Wolfgang; Müller, Ulrich","Crystal structure of sodium phenolate–acetonitrile (1/1), NaOC~6~H~5~ · CH~3~CN","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","63","64","","","","","","","","0.0509","","","0.0768","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101429","5.74","0.003","16.151","0.008","13.29","0.006","90","","100.24","0.03","90","","1210.6","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","bis(rubidium)hydrogen nitrilotriacetate dihydrate","","","- C6 H11 N O8 Rb2 -","- C6 H11 N O8 Rb2 -","- C24 H44 N4 O32 Rb8 -","4","1","","Schreuer, Jürgen; Haussühl, Eiken","Crystal structure of bis(rubidium) hydrogen nitrilotriacetate dihydrate, Rb~2~(NH(CH~2~COO)~3~) · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","69","70","","","","","","","","0.0286","","","0.0565","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101430","11.941","0.002","19.505","0.005","3.392","0.001","90","","90","","90","","790.1","0.6","293","2","293","2","","","","","","","","3","P n n m","-P 2 2n","58","","","","- Ni2 Se8 Ta11 -","- Ni2 Se8 Ta11 -","- Ni4 Se16 Ta22 -","2","0.25","","Conrad, M.; Harbrecht, B.","Crystal structure of dinickel undecatantalum octaselenide, Ni~2~Ta~11~Se~8~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","7","8","","","","","","","","0.034","","","0.059","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101431","5.9528","0.0008","10.224","0.003","10.975","0.003","90","","90","","90","","667.7","0.3","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","4,5-dichloro-1,2,3-dithiazolium","","- C2 Cl3 N S2 -","- C2 Cl3 N S2 -","- C8 Cl12 N4 S8 -","4","1","","Rabe, Susanne; Müller, Ulrich","Crystal structure of 4,5-dichloro-1,2,3-dithiazolium chloride, [C~2~NS~2~Cl~2~]Cl","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","68","68","10.1515/ncrs-1999-0137","","","","","","","0.0244","","","0.0601","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101432","11.576","0.0014","23.581","0.005","23.23","0.004","90","","91.337","0.013","90","","6339.6","1.8","193","2","193","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C74 H63 Br Li N O4 P4 -","- C74 H63 Br Li N O4 P4 -","- C296 H252 Br4 Li4 N4 O16 P16 -","4","1","","Czado, Wolfgang; Müller, Ulrich","Crystal structure of tetrakis(triphenylphosphine oxide)lithium bromide‒ acetonitrile (1/1), Li(OP(C~6~H~5~)~3~)~4~Br · CH~3~CN","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","65","67","","","","","","","","0.0544","","","0.1168","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101433","10.2616","0.0008","14.652","0.002","21.824","0.003","102.612","0.001","99.963","0.001","98.882","0.001","3090","1","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","","","- C74 H80 O14 -","- C74 H80 O14 -","- C148 H160 O28 -","2","1","","Thuéry, Pierre; Nierlich, Martine; Asfari, Zouhair; Vicens, Jacques","Crystal structure of a new calix[4]arene-crown including a diphenylenespacer, C~68~H~68~O~12~ · 2CH~3~COCH~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","129","131","","","","","","","","0.0913","","","0.2227","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101434","4.835","0.001","6.984","0.001","8.449","0.001","90","","90","","90","","285.28","0.03","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Dysprosium hydroxide carbonate","","","- C H Dy O4 -","- C Dy O4 -","- C4 Dy4 O16 -","4","1","","Doert, Thomas; Rademacher, Otto","Crystal structure of dysprosium hydroxide carbonate, DyOHCO~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","11","12","","","","","","","","0.0375","","","0.0951","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101435","8.83","0.002","9.253","0.002","18.225","0.003","81.14","0.02","81.794","0.015","61.09","0.02","1283.8","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H37 N3 O3 -","- C28 H37 N3 O3 -","- C56 H74 N6 O6 -","2","1","","Langhals, Heinz; Ismael, Rami; Polborn, Kurt","Crystal structure of N,N'-dimethyl-N''-(1-methylpropyl)naphthalene- 1:4,5-tricarboxylic-4,5-imide-1,8-hydrazame, C~19~H~19~N~3~O~3~ and of N,N'-dimethyl-N''-(1-hexylheptyl)naphthalene-1:4,5-tricarboxylic- 4,5-imide-1,8-hydrazame, C~28~H~37~N~3~O~3~, two naphthalene hydrazamimides","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","35","37","","","","","","","","0.1014","","","0.3935","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101436","7.215","0.002","8.5552","0.0011","13.694","0.004","90.87","0.02","96.28","0.03","108.41","0.02","796","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H19 N3 O3 -","- C19 H19 N3 O3 -","- C38 H38 N6 O6 -","2","1","","Langhals, Heinz; Ismael, Rami; Polborn, Kurt","Crystal structure of N,N '-dimethyl-N ''-(1-methylpropyl)naphthalene-1 : 4,5-tricarboxylic-4,5-imide-1,8-hydrazame, C19H19N3O3 and of N,N '-dimethyl-N ''-(1-hexylheptyl)naphthalene-1 : 4,5-tricarboxylic-4,5-imide-1,8-hydrazame, C28H37N3O3, two naphthalene hydrazamimides","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","35","37","","","","","","","","0.0798","","","0.2036","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101437","10.1828","0.001","40.6683","0.001","13.2016","0.001","90","","109.817","0.01","90","","5143.3","0.7","190","2","190","2","","","","","","","","6","I 1 a 1","I -2ya","9","","","","- C14 H19 Cu N3 O3 S -","- C14 H19 Cu N3 O3 S -","- C168 H228 Cu12 N36 O36 S12 -","12","3","","Warda, Salam A.","Crystal structure of (N-ethylthiourea-S)(2,2-dimethyl-N-salicylideneglycinato- O,N,O')copper(II), C~14~H~19~CuN~3~O~3~S","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","74","76","","","","","","","","0.0321","","","0.0494","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101438","8.142","0.003","6.611","0.002","16.987","0.004","90","","99.35","0.04","90","","902.2","0.5","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","(5R)-menthoxy-3,7-dimethyl-isouric acid * isouric acid is: 5,7-dihydro-3H-purine-2,6,8-trione * menthoxy is: (2'S-isopropyl-5'R-methylcyclohex-(1'R)-yloxy)- * alternative is: (5R)-1-p-Menth-3-yloxy- (cf. Modrić & Poje, Acta Cryst. C46 (1990) 1336-1338.)","","","- C17 H26 N4 O4 -","- C17 H26 N4 O4 -","- C34 H52 N8 O8 -","2","1","","Poje, Nevenka; Poje, Mirko; Vicković, Ivan","Crystal structure of 5R-(2'S-isopropyl-5'R-methylcyclohex-1'R-yloxy)- 3,7-dimethyl-5,7-dihydro-3H-purine-2,6,8-trione, C~17~H~26~N~4~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","109","110","","","","","","","","0.0433","","","0.0864","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101439","5.653","0.002","5.894","0.002","14.016","0.01","82.23","0.04","82.16","0.04","73.22","0.02","440.6","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C10 H26 I K N2 O6 -","- C5 H13 I0.5 K0.5 N O3 -","- C10 H26 I K N2 O6 -","2","1","","Andrade, L. C. R.; Costa, M. M. R.; Paixão, J. A.; Agostinho Moreira, J.; Almeida, A.; Chaves, M. R.; Klöpperpieper, A.","Crystal structure of betaine potassium iodide dihydrate, (C~5~H~11~NO~2~) ~2~KI · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","83","84","","","","","","","","0.0205","","","0.0497","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101440","8.46","0.004","9.04","0.005","9.741","0.002","90","","90.75","0.03","90","","744.9","0.6","300","2","300","2","","","","","","","","2","P 1 21 1","P 2yb","4","","","","- C6 N6 -","- C6 N6 -","- C24 N24 -","4","2","","Kroke, Edwin; Schwarz, Marcus; Riedel, Ralf; Svoboda, Ingrid; Fuess, Hartmut","Crystal structure of 1,3,5-triazine-2,4,6-tricarbonitrile, C~6~N~6~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","111","112","","","","","","","","0.0434","","","0.0968","","","","","","","","","","","has coordinates,has disorder","301880","2025-08-22","23:45:45",""
"8101441","8.051","0.003","9.43","0.002","18.293","0.005","90","","100.32","0.03","90","","1366.4","0.7","223","2","253","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","3,3'-thiodipropionitril-pentachlorotantalum(V)","","","- C6 H8 Cl5 N2 S Ta -","- C6 H8 Cl5 N2 S Ta -","- C24 H32 Cl20 N8 S4 Ta4 -","4","1","","Ahmed, Ibrahim Abdelhalim; Blachnik, Roger; Reuter, Hans; Stumpf, Klaus","Crystal structure of pentachloro(3,3'-thiodipropionitrile)tantalum(V), TaCl~5~[NC(CH~2~)~2~S(CH~2~)~2~CN] and of pentachloro(3,3'-thiodipropionitrile) niobium(V), NbCl~5~[NC(CH~2~)~2~S(CH~2~)~2~CN]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","117","118","","","","","","","","0.031","","","0.0734","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101442","8.0691","0.001","9.4689","0.0009","18.44","0.002","90","","100.186","0.01","90","","1386.7","0.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C6 H8 Cl5 N2 Nb S -","- C6 H8 Cl5 N2 Nb S -","- C24 H32 Cl20 N8 Nb4 S4 -","4","1","","Ahmed, Ibrahim Abdelhalim; Blachnik, Roger; Reuter, Hans; Stumpf, Klaus","Crystal structure of pentachloro(3,3'-thiodipropionitrile)tantalum(V), TaCl~5~[NC(CH~2~)~2~S(CH~2~)~2~CN] and of pentachloro(3,3'-thiodipropionitrile) niobium(V), NbCl~5~[NC(CH~2~)~2~S(CH~2~)~2~CN]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","117","118","","","","","","","","0.0202","","","0.0567","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101443","9.016","0.005","10.264","0.007","8.337","0.006","96.03","0.06","99.83","0.05","115.73","0.04","670.7","0.9","293","","293","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H40 Cl2 Cu N4 O10 -","- C18 H36 Cl2 Cu N4 O10 -","- C18 H36 Cl2 Cu N4 O10 -","1","0.5","","Hazari, S. K. S.; Roy, T. G.; Dey, B. K.; Chakrabarti, S.; Tiekink, E. R. T.","Crystal structure of (3,10-C-meso-3,5,7,7,10,12,14,14-octamethyl-1, 4,8,11-tetraazacyclotetradeca-4,11-diene)copper dihydrate, [Cu(Me~8~ [14]diene)(ClO~4~)~2~] · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","51","52","","","","","","","","0.0437","","","0.0525","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101444","11.079","0.002","11.079","0.002","11.079","0.002","90","","90","","90","","1359.9","0.4","293","2","293","2","","","","","","","","3","P m -3 n","-P 4n 2 3","223","Clathrate","","","- Cs8 Ge38 In8 -","- Cs8 Ge37.78 In8.22 -","- Cs8 Ge37.78 In8.22 -","1","0.0208333","","Menke, H.; Carrillo-Cabrera, W.; Peters, K.; Peters, E.-M.; von Schnering, H. G.","Crystal structure of the clathrate Cs~8~In~8~Ge~38~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","14","14","","","","","","","","0.0478","","","0.102","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101445","13.6171","0.0013","10.128","0.002","7.962","0.002","90","","90","","90","","1098.1","0.3","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","propionitrile-tantalumpentachloride","","","- C3 H5 Cl5 N Ta -","- C3 H5 Cl5 N Ta -","- C12 H20 Cl20 N4 Ta4 -","4","1","","Ahmed, Ibrahim Abdelhalim; Blachnik, Roger; Reuter, Hans; Stumpf, Klaus","Crystal structure of pentachloro(propionitrile)tantalum(V), TaCl~5~ (NC-CH~2~-CH~3~) and of pentachloro(propionitrile)niobium(V), NbCl~5~ (NC-CH~2~-CH~3~)","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","119","120","","","","","","","","0.0387","","","0.1038","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101446","13.6274","0.0013","10.1107","0.0014","7.9265","0.0012","90","","90","","90","","1092.1","0.2","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C3 H5 Cl5 N Nb -","- C3 H5 Cl5 N Nb -","- C12 H20 Cl20 N4 Nb4 -","4","1","","Ahmed, Ibrahim Abdelhalim; Blachnik, Roger; Reuter, Hans; Stumpf, Klaus","Crystal structure of pentachloro(propionitrile)tantalum(V), TaCl~5~ (NC-CH~2~-CH~3~) and of pentachloro(propionitrile)niobium(V), NbCl~5~ (NC-CH~2~-CH~3~)","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","119","120","","","","","","","","0.0488","","","0.1283","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101447","10.957","0.003","10.957","0.003","18.948","0.005","90","","90","","90","","2274.8","1.1","193","2","193","2","","","","","","","","5","P 41","P 4w","76","","","","- C18 H28 I2 Ni P2 -","- C18 H28 I2 Ni P2 -","- C72 H112 I8 Ni4 P8 -","4","1","","Frenzen, Gerlinde; Reim, Stefan; Sippel, Heike; Frauenrath, Herbert","Crystal structure of diiodo[(+)-1,2-bis((2S,5S)-2,5-dimethylphospholano) benzene-P,P']nickel, C~18~H~28~I~2~NiP~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","121","122","","","","","","","","0.0387","","","0.0743","","","","","","","","","","","has coordinates","201214","2020-10-21","18:00:00",""
"8101448","10.39","","10.39","","18.962","0.001","90","","90","","90","","2046.99","0.11","193","2","193","2","","","","","","","","5","P 41","P 4w","76","","","","- C18 H28 Cl2 Ni P2 -","- C18 H28 Cl2 Ni P2 -","- C72 H112 Cl8 Ni4 P8 -","4","1","","Frenzen, Gerlinde; Reim, Stefan; Sippel, Heike; Frauenrath, Herbert","Crystal structure of dichloro[(+)-1,2-bis((2S,5S)-2,5-dimethylphospholano) benzene-P,P']nickel, C~18~H~28~Cl~2~NiP~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","123","124","","","","","","","","0.0279","","","0.0664","","","","","","","","","","","has coordinates","201214","2020-10-21","18:00:00",""
"8101449","6.244","0.001","14.686","0.003","14.344","0.002","90","","100.5","0.02","90","","1293.3","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H23 N O2 -","- C12 H23 N O2 -","- C48 H92 N4 O8 -","4","1","","Frenzen, Gerlinde; Rabe, Susanne; Tomm, Sabine; Frauenrath, Herbert","Crystal structure of syn-N-methyl-N-(3,5,5-trimethyl-2-oxohex-4-yl) acetamide, C~12~H~23~NO~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","125","126","","","","","","","","0.0707","","","0.1366","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101450","8.565","0.003","8.92","0.003","18.612","0.003","90","","90","","90","","1422","0.7","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H23 N O -","- C15 H23 N O -","- C60 H92 N4 O4 -","4","1","","Frenzen, Gerlinde; Tomm, Sabine; Frauenrath, Herbert","Crystal structure of anti-3-(N,N-diethylamino)-2-ethyl-3-phenylpropanale, C~15~H~23~NO","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","127","128","","","","","","","","0.0812","","","0.1526","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101451","8.134","0.004","8.134","0.004","15.771","0.008","90","","90","","90","","1043.4","0.9","298","2","298","2","","","","","","","","2","I 4/m c m","-I 4 2c","140","","","","- Ge3 Sr5 -","- Ge3 Sr5 -","- Ge12 Sr20 -","4","0.125","","Nesper, Reinhard; Zürcher, Fabio","Crystal structure of pentastrontium trigermanide, Sr~5~Ge~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","21","21","","","","","","","","0.0454","","","0.1163","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101452","8.519","0.004","8.519","0.004","16.554","0.008","90","","90","","90","","1201","1","298","2","298","2","","","","","","","","2","P 4/n c c :2","-P 4a 2ac","130","","","","- Ba5 Ge3 -","- Ba5 Ge3 -","- Ba20 Ge12 -","4","0.25","","Nesper, Reinhard; Zürcher, Fabio","Crystal structure of pentabarium trigermanide, Ba~5~Ge~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","22","22","","","","","","","","0.0446","","","0.0891","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101453","8.089","0.004","8.089","0.004","15.733","0.008","90","","90","","90","","1029.4","0.9","298","2","298","2","","","","","","","","2","I 4/m c m","-I 4 2c","140","","","","- Si3 Sr5 -","- Si3 Sr5 -","- Si12 Sr20 -","4","0.125","","Nesper, Reinhard; Zürcher, Fabio","Redetermination of the crystal structure of pentastrontium trisilicide, Sr~5~Si~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","19","19","","","","","","","","0.0288","","","0.0551","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101454","8.465","0.006","8.465","0.006","16.45","0.01","90","","90","","90","","1179","1","298","2","298","2","","","","","","","","2","P 4/n c c :2","-P 4a 2ac","130","","","","- Ba5 Si3 -","- Ba5 Si3 -","- Ba20 Si12 -","4","0.25","","Nesper, Reinhard; Zürcher, Fabio","Refinement of the crystal structure of pentabarium trisilicide, Ba~5~Si~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","20","20","","","","","","","","0.0352","","","0.0937","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101455","11.3987","0.0008","4.0235","0.0003","26.9993","0.0014","90","","90","","90","","1238.26","0.14","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","praseodymium(III) nitride sulfide chloride (6/3/4/1)","","","- Cl N3 Pr6 S4 -","- Cl N3 Pr6 S4 -","- Cl4 N12 Pr24 S16 -","4","0.5","","Meyer, Monika; Schleid, Thomas","Crystal structure of hexapraseodymium(III) trinitride tetrasulfide chloride, Pr~6~N~3~S~4~Cl","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","23","24","","","","","","","","0.0373","","","0.0787","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101456","14.367","0.003","8.571","0.002","9.994","0.002","90","","94.78","0.03","90","","1226.4","0.5","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- F6 Ga Li3 -","- F6 Ga Li3 -","- F72 Ga12 Li36 -","12","1.5","","Koehler, Juergen; Tyagi, A. K.","Crystal structure of β-lithium hexafluorogallate, Li~3~GaF~6~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","25","26","","","","","","","","0.0265","","","0.0617","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101457","24.744","0.005","3.913","0.001","8.974","0.002","90","","90","","90","","868.9","0.3","293","2","293","2","","","","","","","","3","P m m n :2","-P 2ab 2a","59","","","","- Cs In7 S9 -","- Cs0.958 In7.001 S9.08 -","- Cs1.916 In14.002 S18.16 -","2","0.25","","Reiner, Christof; Deiseroth, Hans Jörg","Crystal structure of cesium heptaindium nonasulfide, CsIn~7~S~9~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","13","13","","","","","","","","0.019","","","0.0393","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101458","14.475","0.002","14.475","0.002","9.894","0.001","90","","90","","120","","1795.3","0.4","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- Er6 F30 O Sr7 -","- Er6 F31 Sr7 -","- Er18 F93 Sr21 -","3","0.166667","","Koehler, Juergen; Tyagi, A.K.","Crystal structure of heptastrontium hexaerbium triacontafluoride oxide, Sr~7~Er~6~F~30~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","1","27","28","","","","","","","","0.0362","","","0.0671","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101459","7.0746","0.0002","8.8235","0.0003","16.0023","0.0008","84.671","0.005","89.926","0.004","85.615","0.006","991.66","0.07","293","2","293","2","","","","","","","","5","P 1","P 1","1","","","","- C20 H29 Cl N2 O2 -","- C20 H29 Cl N2 O2 -","- C40 H58 Cl2 N4 O4 -","2","2","","Csöregh, Ingeborg; Sandberg, Rune","Crystal structure and absolute configuration of 1'-[3-(diethylamino) propyl]-3,4-dihydrospiro[naphthalene-1(2H),3'-pyrrolidine-2',5'-dione hydrochloride, RAC-109 I ·HCl, C20H28N2O2 · HCl","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","227","229","","","","","","","","0.038","","","0.043","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101460","8.269","0.009","6.215","0.009","14.816","0.008","90","","91.85","0.06","90","","761","1.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H19 N O3 -","- C17 H19 N O3 -","- C34 H38 N2 O6 -","2","1","","Cirilli, Roberto; Gasparrini, Francesco; Villani, Claudio; Gavuzzo, Enrico; Cirilli, Maurizio","Crystal structure of (S)-3-(1-methylethyl)-5-[(1-naphthalenyloxy)methyl]- 2-oxazolidinone, C17H19NO3","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","179","180","","","","","","","","0.044","","","0.1195","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101461","12.373","0.002","7.367","0.002","14.1","0.003","90","","109.26","0.02","90","","1213.3","0.5","291","2","291","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H28 N2 O4 -","- C28 H28 N2 O4 -","- C56 H56 N4 O8 -","2","1","","Kolev, Tsonko; Glavcheva, Zornitza; Schürmann, Markus; Preut, Hans; Bleckmann, Paul; Radomirska, Valentina","Crystal structure of bis[R-(+)-1-(1-naphthyl)ethylammonium]squarate, [C12H14N]2C4O4","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","187","188","","","","","","","","0.0386","","","0.1055","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101462","11.647","0.003","25.293","0.004","19.832","0.004","90","","91.99","0.02","90","","5839","2","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","[Cu4(iso-C3H7O)2(O)(S-alkyne)4]","","","- C52 H92 Cu4 O3 S4 -","- C52 H92 Cu4 O3 S4 -","- C208 H368 Cu16 O12 S16 -","4","1","","Olbrich, Falk; Gröger, Gunther; Behrens, Ulrich","Crystal structure of bis(isopropoxo)(oxo)tetrakis(3,3,6,6-tetramethyl- 1-thia-cyclohept-4-yne)tetracopper(I)-n-hexane (1/1), [Cu4(iso-C3H7O) 2(O)(C10H16S)4] · C6H14, of hydroxo-isopropoxo-oxo-tetrakis (3,3,6,6-tetramethyl-1-thia-cyclohept-4-yne)tetracopper(I), [Cu4(OH) (iso-C3H7O)(O)(C10H16S)4] and of dihydroxo-oxo-tetrakis(3,3,6,6-tetramethyl- 1-thia-cyclohept-4-yne)-tetracopper(I), [Cu4(OH)2(O)(C10H16S)4]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","195","200","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101463","18.663","0.006","18.709","0.002","14.527","0.005","90","","98.58","0.02","90","","5016","2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[Cu4(OH)(C3H7O)(S-alkyne)4]","","","- C43 H72 Cu4 O3 S4 -","- C43 H72 Cu4 O3 S4 -","- C172 H288 Cu16 O12 S16 -","4","0.5","","Olbrich, Falk; Gröger, Gunther; Behrens, Ulrich","Crystal structure of bis(isopropoxo)(oxo)tetrakis(3,3,6,6-tetramethyl- 1-thia-cyclohept-4-yne)tetracopper(I)-n-hexane (1/1), [Cu4(iso-C3H7O) 2(O)(C10H16S)4] · C6H14, of hydroxo-isopropoxo-oxo-tetrakis (3,3,6,6-tetramethyl-1-thia-cyclohept-4-yne)tetracopper(I), [Cu4(OH) (iso-C3H7O)(O)(C10H16S)4] and of dihydroxo-oxo-tetrakis(3,3,6,6-tetramethyl- 1-thia-cyclohept-4-yne)-tetracopper(I), [Cu4(OH)2(O)(C10H16S)4]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","195","200","","","","","","","","0.0407","","","0.1074","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101464","27.503","0.004","9.579","0.001","22.733","0.004","90","","126.54","0.01","90","","4811.8","1.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","[Cu4(OH)2(O)(S-alkyne)4]","","","- C40 H66 Cu4 O3 S4 -","- C40 H66 Cu4 O3 S4 -","- C160 H264 Cu16 O12 S16 -","4","0.5","","Olbrich, Falk; Gröger, Gunther; Behrens, Ulrich","Crystal structure of bis(isopropoxo)(oxo)tetrakis(3,3,6,6-tetramethyl- 1-thia-cyclohept-4-yne)tetracopper(I)-n-hexane (1/1), [Cu4(iso-C3H7O) 2(O)(C10H16S)4] · C6H14, of hydroxo-isopropoxo-oxo-tetrakis (3,3,6,6-tetramethyl-1-thia-cyclohept-4-yne)tetracopper(I), [Cu4(OH) (iso-C3H7O)(O)(C10H16S)4] and of dihydroxo-oxo-tetrakis(3,3,6,6-tetramethyl- 1-thia-cyclohept-4-yne)-tetracopper(I), [Cu4(OH)2(O)(C10H16S)4]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","195","200","","","","","","","","0.0465","","","0.1355","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101465","13.5594","0.0006","21.164","0.002","21.365","0.002","90","","95.424","0.01","90","","6104","2","123","2","123","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C60 H86 O14 P2 -","- C60.184 H81 O14 P2 -","- C240.736 H324 O56 P8 -","4","1","","Thuéry, Pierre; Nierlich, Martine; Abidi, Rym; Asfari, Zouhair; Vicens, Jacques","Crystal structure of 1,3-bis(diethoxyphosphoryl)-2,4-bis(ethylacetate)- p-tert-butylcalix[4]arene, C60H86O14P2","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","154","156","","","","","","","","0.0564","","","0.1142","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101466","7.724","0.001","8.6981","0.001","11.6205","0.0012","90.008","0.009","92.737","0.013","90.012","0.013","779.8","0.2","296","","296","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C5 H6 N4 O5 -","- C5 H6 N4 O5 -","- C20 H24 N16 O20 -","4","1","","Meiyappan, Muthuraman; Bagieu-Beucher, Muriel; Le Fur, Yvette","Crystal structure of 4-(nitroamino)pyridinium nitrate, C5H6N3O2+NO3-","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","201","202","","","","","","","","0.043","","","","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101467","10.681","0.002","10.681","","12.056","0.003","90","","90","","120","","1191.1","0.5","293","","293","","","","","","","","","5","R 3 :H","R 3","146","","","","- C12 H25 Cl3 Cu N4 -","- C12 H25 Cl3 Cu N4 -","- C36 H75 Cl9 Cu3 N12 -","3","0.333333","","Karan, N. K.; Sen, S.; Saha, M. K.; Mitra, S.; Tiekink, E. R. T.","Crystal structure of [Cu(Hdabco)(dabco)Cl3] (dabco = 1,4-diazabicyclo [2.2.2]octane), C12H25Cl3CuN4","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","203","204","","","","","","","","0.0296","","","0.0264","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101468","12.187","0.005","17.399","0.004","10.105","0.002","90","0.02","96.43","0.03","90","0.03","2129","2","294","","294","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C25 H25 Br N2 S -","- C24 H26 Br N3 S -","- C96 H104 Br4 N12 S4 -","4","0.5","","Alilou, El Houssine; El Hallaoui, Abdelilah; El Ghadraoui, El Houssine; Pierrot, Marcel; Regliér, Marius","Crystal structure of N-(2-pyridyl)methyl-N-(3-thienyl)methyl-5,7-dihydrodibenzo [c,e]azepinium bromide, C25H25N2SBr","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","213","214","","","","","","","","0.093","","","0.175","","","","","","","","","","","has coordinates","285101","2023-07-08","13:54:17",""
"8101469","7.3032","0.0007","14.747","0.003","16.248","0.0018","90","","92.693","0.01","90","","1748","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H13 Mo N3 O4 -","- C17 H13 Mo N3 O4 -","- C68 H52 Mo4 N12 O16 -","4","1","","Shamsudin, M.; Affan, M. A.; Hitam, R.; Yamin, B. M.; Boshaala, Ahmed M. A.; Fun, Hoong-Kun; Ibrahim, Abdul Razak","Crystal structure of methylpyridylphenylhydrazone tetracarbonyl molybdenum(0), C17H13MoN3O4","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","215","216","","","","","","","","0.0317","","","0.06","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101470","9.2282","0.0004","9.2902","0.0006","9.5154","0.0009","91.241","0.006","109.179","0.006","116.508","0.004","675.69","0.08","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C12 H17 O7 -","- C12 H17 O7 -","- C24 H34 O14 -","2","1","","Podlaha, J.; Císařová, I.; Holý, P.; Závada, J.","Crystal structure of 1,2,3,4,5,6-hexakis(2'-carboxyethyl)benzene dihydrate, C24H30O12 · 2H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","183","184","","","","","","","","0.0503","","","0.1346","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101471","10.4425","0.001","10.8969","0.0011","11.3796","0.0008","95.423","0.008","116.136","0.006","98.735","0.008","1129.8","0.2","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C21 H24 O15 -","- C21 H24 O15 -","- C42 H48 O30 -","2","1","","Podlaha, J.; Císařová, I.; Holý, P.; Závada, J.","Crystal structure of 1H-2,3,4,5,6,7,8,9-octahydrocyclopenta-[e]-as- indacene-2,2,5,5,8,8-hexacarboxylic acid trihydrate, C21H18O12 · 3H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","185","186","","","","","","","","0.0398","","","0.095","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101472","7.8574","0.0006","14.791","0.0011","16.8742","0.0015","107.16","0.005","99.995","0.005","97.512","0.005","1810.5","0.3","298","2","","","","","","","","","","3","P -1","-P 1","2","","","","- C17 H24 O7 -","- C17 H24 O7 -","- C68 H96 O28 -","4","2","","Ullmann, Astrid; Zahn, Gernot; Schnaubelt, Jürgen; Reissig, Hans-Ulrich","Crystal structure of trimethyl 3-methyl-4-oxo-(E)-8-cyclodecene-1, 1,6-tricarboxylate, C17H24O7","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","221","223","","","","","","","","0.0494","","","0.0948","","","","","","","","","","","has coordinates,has disorder","301880","2025-08-22","23:45:45",""
"8101473","13.563","0.002","20.834","0.003","17.156","0.003","90","","106.86","0.02","90","","4639.4","1.3","291","2","291","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H66 O6 P S -","- C48 H57 O6 P S -","- C192 H228 O24 P4 S4 -","4","1","","Selkti, M.; Coleman, A. W.; Routaboul, J.; Kalchenko, V. I.; Tomas, A.; Villain, F.; de Rango, C.","Crystal structure of [mono-O-(diethoxy)thiophosphonato]tetra-tert- butylcalix[4]arene, C48H66O6PS","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","224","226","","","","","","","","0.0693","","","0.1605","","","","","","","","","","","has coordinates","201214","2020-10-21","18:00:00",""
"8101474","5.7511","0.0005","17.022","0.002","7.2499","0.0007","90","","99.024","0.002","90","","701","0.1","213","2","213","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C5 H9 N O S -","- C5 H9 N O S -","- C20 H36 N4 O4 S4 -","4","1","","Gray, Thomas; Laplaza, Catalina E.; Staples, Richard J.","Crystal structure of 4,4-dimethyloxazolidine-2-thione, C5H9NOS","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","230","230","","","","","","","","0.0372","","","0.0944","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101475","15.92","0.007","16.673","0.008","20.583","0.01","77.8","0.06","81","0.06","72.6","0.04","5070","4","","","193","2","","","","","","","","6","P -1","-P 1","2","","","","- C70 H108 Cl2 N20 Ni9 O40 -","- C70 H70 Cl2 N20 Ni9 O40 -","- C140 H140 Cl4 N40 Ni18 O80 -","2","1","","Pajunen, A.; Mutikainen, I.; Saarinen, H.; Orama, M.","Crystal structure of hexaaquadi(μ3-hydroxo)tetra(μ2-hydroxo) tetrakis-(μ3-{1-[2-(6-methylpyridyl)]ethanone oximato})hexakis (μ2-{1-[2-(6-methylpyridyl)]ethanone oximato)nonanickel(II) perchlorate hydrate, [Ni9(C7H7N2O)10(OH)6(H2O)6](ClO4)2 · 10H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","217","220","","","","","","","","0.1084","","","0.2626","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101476","14.87","0.004","3.876","0.004","25.251","0.004","90","","121.48","0.03","90","","1241.1","1.4","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 O4 -","- C16 H12 O4 -","- C64 H48 O16 -","4","1","","Shoja, M.; Bisso, S.; Kabban, R.; Athanasopoulos, D.","Crystal structure of 6-hydroxy-2'-methoxyflavone, C16H12O4","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","233","234","","","","","","","","0.078","","","0.085","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101477","27.781","0.005","6.657","0.002","14.203","0.005","90","","106.94","0.02","90","","2512.7","1.3","293","","293","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C16 H14 O2 -","- C16 H14 O2 -","- C128 H112 O16 -","8","1","","Shoja, M.","Crystal structure of 2'-hydroxy-4-methylchalcone, C16H14O2","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","235","236","","","","","","","","0.049","","","0.048","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101478","9.4706","0.0001","16.352","","20.3687","0.0002","90","","99.117","0.001","90","","3114.57","0.04","183","2","183","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C48 H108 Mo4 N12 -","- C48 H108 Mo4 N12 -","- C96 H216 Mo8 N24 -","2","0.25","","Armstrong, William H.; Bonitatebus, Peter J. Jr.","Crystal structure of tris(diisopropylethylenediamido)dimolybdenum (III) (Mo–Mo), C48H108Mo4N12","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","241","242","","","","","","","","0.0379","","","0.0842","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101479","16.38","0.003","13.003","0.004","18.23","0.004","90","","104.23","0.015","90","","3763.7","1.4","183","2","183","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C32 H70 N6 Na Nb O2 -","- C32 H70 N6 Na Nb O2 -","- C128 H280 N24 Na4 Nb4 O8 -","4","0.5","","Armstrong, William H.; Bonitatebus, Peter J. Jr.","Crystal structure of N,N'-diisopropylethylenediamido-μ(1kN',2kN)-bis(N,N'- diisopropylethenediamido-1kN,2kN')niobium(V)-bis(tetrahydrofuran)sodium(I), [Nb(iPr2en)3{Na(thf)2}]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","243","244","","","","","","","","0.0441","","","0.1124","","","","","","","","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101480","14.272","0.003","9.842","0.002","15.722","0.003","90","","100.6","0.05","90","","2170.8","0.7","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C50 H50 N4 O8 -","- C50 H50 N4 O8 -","- C100 H100 N8 O16 -","2","0.5","","Matos Beja, A.; Paixão, J. A.; Ramos Silva, M.; Alte da Veiga, L.; Rocha Gonsalves, A. M. d'A.; Pereira, M. M.; Piñeiro, M.","Crystal structure of 5,10,15,20-tetrakis(4-methoxyphenyl)porphyrin‒ water‒methanol (1/2/2), C48H38N4O4 · 2CH3OH · 2H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","253","254","","","","","","","","0.0639","","","0.1696","","","","","","","","","","","has coordinates,has disorder","189513","2020-10-21","18:00:00",""
"8101481","10.308","0.003","14.317","0.004","17.623","0.004","90","0.02","90","0.02","90","0.02","2600.7","1.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","5,7,14,16-Tetraamino-1,2,3,10,11,12-hexathia[3,3]metacyclophan * 2 DMF","","","- C18 H26 N6 O2 S6 -","- C18 H26 N6 O2 S6 -","- C72 H104 N24 O8 S24 -","4","1","","Getzschmann, Jürgen; Rademacher, Otto; Doert, Thomas; Böttcher, Peter","Crystal structure of 6,8,14,16-tetraamino-2,3,4,10,11,12-hexathiatricyclo [11.3.1.15,9]octadeca-5,7,9(18),13(17),14,16-hexaen–dimethylformamide (1/2), [C6H2(NH2)2(S3)]2 · 2DMF","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","255","256","","","","","","","","0.0432","","","0.1179","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101482","8.767","0.008","11.3","0.006","18.562","0.005","90","","93.47","0.09","90","","1836","2","291","2","291","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(2-Diphenylphosphinylethyl)trimethylstannane","","","- C17 H23 O P Sn -","- C17 H23 O P Sn -","- C68 H92 O4 P4 Sn4 -","4","1","","Böduel, Rainer René; Zachwieja, Uwe; Preut, Hans; Mitchell, Terence","Crystal structure of diphenyl[2-(1,1,1-trimethylstannyl)ethyl]phosphine oxide, C17H23OPSn","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","189","190","","","","","","","","0.0666","","","0.1525","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101483","8.783","0.008","14.274","0.009","9.316","0.005","90","","95.39","0.05","90","","1162","1","293","","293","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 O3 -","- C15 H12 O3 -","- C60 H48 O12 -","4","1","","Feng, M.-C.; Tay, M. G.; Yeap, G.-Y.; Norani, M. M.; Teoh, S. G.; Tiekink, E. R. T.","Crystal structure of E-1-(2-hydroxyphenyl)-3-(3-hydroxyphenyl)-2-propen- 1-one, C15H12O3","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","205","206","","","","","","","","0.0577","","","0.0575","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101484","7.463","0.002","10.12","0.003","10.186","0.001","62.15","0.02","71.39","0.02","73.91","0.02","637.1","0.3","293","","293","","","","","","","","","3","P -1","-P 1","2","","","","- C16 H12 O4 -","- C16 H12 O4 -","- C32 H24 O8 -","2","1","","Shoja, M.; Sullivan, P.","Crystal structure of 3-hydroxy-2'-methoxyflavone, C16H12O4","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","237","238","","","","","","","","0.042","","","0.047","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101485","24.021","0.005","4.978","0.004","20.996","0.002","90","","112.69","0.01","90","","2316","2","293","","293","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C15 H12 O3 -","- C15 H12 O3 -","- C120 H96 O24 -","8","1","","Shoja, M.; Samuel, K.","Crystal structure of 2'-hydroxyflavanone, C15H12O3","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","239","240","","","","","","","","0.06","","","0.07","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101486","7.035","0.001","11.024","0.002","8.686","0.002","90","","111.89","0.03","90","","625.1","0.2","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H15 N O5 -","- C12 H15 N O5 -","- C24 H30 N2 O10 -","2","1","","Kolev, Tsonko; Glavcheva, Zornitza; Schürmann, Markus; Preut, Hans; Bleckmann, Paul; Radomirska, Valentina","Crystal structure of R-(+)-1-phenylethylammonium hydrogensquarate monohydrate, C12H13NO4 · H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","191","192","","","","","","","","0.0441","","","0.1161","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101487","23.485","0.002","23.485","0.002","5.807","0.001","90","","90","","90","","3202.8","0.7","293","2","293","2","","","","","","","","3","I 43","","","","","","- C19 H20 O4 -","- C19 H20 O4 -","- C152 H160 O32 -","8","","","Frey, Wolfgang; Remen, Lubos; Jäger, Volker; Gracza, Tibor","Crystal structure of (1S,3S,4R,7S)-7-benzyloxy-3-[(1S)-1-hydroxy-1- phenylmethyl]-2,5-dioxabicyclo[2.2.1]heptane, C19H20O4","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","257","258","","","","","","","","0.0452","","","0.1064","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101488","5.197","0.001","14.526","0.003","5.659","0.001","90","","117.08","0.01","90","","380.37","0.13","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C7 H10 O5 -","- C7 H10 O5 -","- C14 H20 O10 -","2","1","","Frey, Wolfgang; Gracza, Tibor; Hasenöhrl, Thomas; Lieberknecht, Albrecht; Jäger, Volker","Crystal structure of (3aR,5S,6R,6aR)-6-hydroxy-5-hydroxymethyl-perhydrofuro [3,2-b]furan-2-one, C7H10O5","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","259","260","","","","","","","","0.038","","","0.0784","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101489","7.4136","0.0011","14.3392","0.0013","9.2247","0.0012","90","","107.702","0.012","90","","934.2","0.2","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H10 N2 Se -","- C9 H10 N2 Se -","- C36 H40 N8 Se4 -","4","1","","Aydın, Abdullah; Soylu, Hüseyin; Kücükbay, Hasan; Akkurt, Mehmet; Ercan, Filiz","Crystal structure of 1,3-dimethylbenzimidazole-2-selenone, C9H10N2Se","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","295","296","","","","","","","","0.038","","","0.1151","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101490","28.6028","0.0008","16.2921","0.0006","40.5413","0.0013","90","","91.113","0.002","90","","18889","3","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C91 H135 Cl3 N3 O11.5 -","- C91.04 H116.5 Cl3 N3 O11.5 -","- C728.32 H932 Cl24 N24 O92 -","8","1","","Thuéry, Pierre; Nierlich, Martine; Abidi, Rym; Asfari, Zouhair; Vicens, Jacques","Crystal structure of 1,3,5-trimethoxy-2,4,6-triamide-calix[6]arene- chloroform‒ethanol‒water (1/1/1.5/1), C91H123N3O9 · CHCl3 · 1.5C2H5OH · H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","157","160","","","","","","","","0.0848","","","0.2254","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101491","11.8207","0.0002","20.4092","0.0004","12.429","0.0001","90","","108.173","0.003","90","","2848.94","0.08","213","2","213","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H20 Cl N -","- C8 H20 Cl N -","- C96 H240 Cl12 N12 -","12","3","","Staples, Richard J.","Crystal structure of anhydrous tetraethylammonium chloride, [(CH3CH2)4N]Cl","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","231","232","","","","","","","","0.0532","","","0.1159","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101492","7.403","0.001","15.916","0.003","11.344","0.002","90","","94.38","0.02","90","","1332.7","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 Cl5 N Nb -","- C8 H7 Cl5 N Nb -","- C32 H28 Cl20 N4 Nb4 -","4","1","","Stumpf, Klaus; Blachnik, Roger; Reuter, Hans","Crystal structure of pentachloro(phenylacetonitrile)niobium(V), (C6H5CH2CN)NbCl5","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","279","280","","","","","","","","0.0273","","","0.0692","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101493","10.887","0.001","16.896","0.002","12.38","0.002","90","","110.443","0.012","90","","2133.9","0.4","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H10 Cl10 N2 Nb2 -","- C7 H10 Cl10 N2 Nb2 -","- C28 H40 Cl40 N8 Nb8 -","4","1","","Stumpf, Klaus; Blachnik, Roger; Reuter, Hans","Crystal structure of pimelonitrile-N,N-bis[pentachloroniobium(V)], Cl5Nb(NC(CH2)5CN)NbCl5","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","281","282","","","","","","","","0.0342","","","0.0663","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101494","17.334","0.006","7.814","0.006","24.278","0.006","90","","99.82","0.02","90","","3240.2","2.8","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C54 H80 O34 S4 -","- C54 H80 O34 S4 -","- C108 H160 O68 S8 -","2","1","","Saviano, Michele; Iacovino, Rosa; Benedetti, Ettore; Cucinotta, Vincenzo; Grasso, Giulia; Sciotto, Domenico","Crystal structure of 6,6'-ditosyl-α-α'-trehalose–methanol–water (1/2/2), C52H68O30S4 · 2CH3OH · 2H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","297","299","","","","","","","","0.0832","","","0.203","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101495","12.305","0.001","15.55","0.002","18.066","0.002","90","","90","","90","","3456.7","0.6","293","","293","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C15 H18 Cl2 N2 Sn -","- C15 H18 Cl2 N2 Sn -","- C120 H144 Cl16 N16 Sn8 -","8","1","","Basu Baul, S. S.; Basu Baul, T. S.; Tiekink, E. R. T.","Crystal structure of dichlorodimethyl[N-(2-pyridylmethylene)-3-toluidine]tin, C15H18Cl2N2Sn","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","207","208","","","","","","","","0.0394","","","0.0387","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101496","11.824","0.002","17.739","0.002","7.167","0.001","90","","90","","90","","1503.3","0.4","296","","296","","","","","","","","","4","P b c m","-P 2c 2b","57","","","","- C5 H9 Na O4 -","- C3.75 H7.25 Na0.5 O2.5 -","- C30 H58 Na4 O20 -","8","1","","Muthuraman, Meiyappan; Le Fur, Yvette; Nicoud, Jean-François; Masse, René; Desiraju, Gautam","Crystal structure of sodium glutaconaldehyde tetrahydrate, Na2(C5H5O2) 2 · 4H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","283","284","","","","","","","","0.034","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101497","6.812","0.002","31.203","0.007","8.162","0.001","90","","101.93","0.02","90","","1697.4","0.7","291","2","291","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H34 N8 O23 -","- C26 H30 N8 O23 -","- C52 H60 N16 O46 -","2","1","","Kolev, Tsonko; Glavcheva, Zornitza; Stahl, Rainer; Preut, Hans; Bleckmann, Paul; Radomirska, Valentina","Crystal structure of L-canavanine hydrogensquarate semihydrate, C26H34N8O23","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","193","194","","","","","","","","0.0733","","","0.1053","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101498","8.565","0.002","9.813","0.002","32.226","0.006","90","","90","","90","","2708.5","1","293","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C15 H20 N2 -","- C15 H20 N2 -","- C120 H160 N16 -","8","1","","Mrozek, Agnieszka; Karolak-Wojciechowska, Janina; Yalçin, Ismail; Şener, Esin","Crystal structure of 2[2'-cyclohexyl]ethyl benzimidazole, C15H20N2","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","181","182","","","","","","","","0.0636","","","","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101499","7.017","0.002","6.989","0.001","9.648","0.002","90","","93.26","0.02","90","","472.4","0.2","300","2","300","2","","","","","","","","4","P 1 21 1","P 2yb","4","10,11-didehydroquincorine","","","- C10 H15 N O -","- C10 H15 N O -","- C20 H30 N2 O2 -","2","1","","Wartchow, R.; Schrake, O.; Braje, W. M.; Hoffmann, H.M.R.","Crystal structure of (1S,2S,4S,5R)-2-hydroxymethyl-5-ethynyl-1-azabicyclo [2.2.2]octane, (HOCH2)(HC2)(C7H11N)","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","285","286","","","","","","","","0.0341","","","0.039","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101500","16.851","0.002","6.892","0.002","16.098","0.002","90","","110.6","0.007","90","","1750.1","0.4","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 Cl2 N2 Sn -","- C15 H18 Cl2 N2 Sn -","- C60 H72 Cl8 N8 Sn4 -","4","1","","Basu Baul, S.; Basu Baul, T. S.; Tiekink, E. R. T.","Crystal structure of dichlorodimethyl[N-(2-pyridylmethylene)-4-toluidine] tin, C15H18Cl2N2Sn","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","209","210","","","","","","","","0.0326","","","0.0327","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101501","16.912","0.003","7.0266","0.0007","15.441","0.002","90","","109.613","0.01","90","","1728.5","0.4","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H18 Cl2 N2 Sn -","- C15 H18 Cl2 N2 Sn -","- C60 H72 Cl8 N8 Sn4 -","4","1","","Basu Baul, S.; Basu Baul, T. S.; Tiekink, E. R. T.","Crystal structure of dichlorodimethyl[N-(2-pyridylmethylene)-2-toluidine] tin, C15H18Cl2N2Sn","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","211","212","","","","","","","","0.0551","","","0.0596","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101502","23.001","0.005","7.763","0.002","10.424","0.002","90","","90","","90","","1861.3","0.7","293","2","293","2","","","","","","","","6","P b c n","-P 2n 2ab","60","potassium sulfanilate 1.5 hydrate","","","- C6 H9 K N O4.5 S -","- C6 H9 K N O4.5 S -","- C48 H72 K8 N8 O36 S8 -","8","1","","Schreuer, Jürgen","Crystal structure of potassium sulfanilate sesquihydrate, KH2NC6H4SO3 · 1.5H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","287","288","","","","","","","","0.0303","","","0.0776","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101503","23.271","0.005","7.844","0.002","10.635","0.002","90","","90","","90","","1941.3","0.7","296","2","296","2","","","","","","","","6","P b c n","-P 2n 2ab","60","rubidium sulfanilate sesquihydrate","","","- C6 H9 N O4.5 Rb S -","- C6 H9 N O4.5 Rb S -","- C48 H72 N8 O36 Rb8 S8 -","8","1","","Schreuer, Jürgen","Crystal structure of rubidium sulfanilate sesquihydrate, RbH2NC6H4SO3 · 1.5H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","289","290","","","","","","","","0.0244","","","0.0496","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101504","5.352","0.001","7.986","0.002","19.527","0.004","90","","94.06","0.03","90","","832.5","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","lithium sulfanilate hydrate","","","- C6 H8 Li N O4 S -","- C6 H8 Li N O4 S -","- C24 H32 Li4 N4 O16 S4 -","4","1","","Schreuer, Jürgen","Crystal structure of lithium sulfanilate hydrate, LiH2NC6H4SO3 · H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","291","292","","","","","","","","0.031","","","0.0801","","","","","","","","","","","has coordinates","287979","2023-12-04","10:22:03",""
"8101505","7.98","0.002","23.42","0.005","10.789","0.002","90","","91.52","0.03","90","","2015.7","0.8","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","cesium sulfanilate hydrate","","","- C6 H8 Cs N O4 S -","- C6 H8 Cs N O4 S -","- C48 H64 Cs8 N8 O32 S8 -","8","4","","Schreuer, Jürgen","Crystal structure of cesium sulfanilate hydrate, CsH2NC6H4SO3 · H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","293","294","","","","","","","","0.0278","","","0.0653","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101506","9.9965","0.0001","14.3429","0.0002","18.5817","0.0001","90","","91.671","0.001","90","","2663.09","0.05","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H41 N O3 Sn -","- C26 H41 N O3 Sn -","- C104 H164 N4 O12 Sn4 -","4","1","","Teoh, S. G.; Tan, D. S.; Yeap, G. Y.; Fun, H. K.","Crystal structure of tricyclohexylaqua[3-pyridylacrylato]tin(IV), C26H41NO3Sn","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","161","162","","","","","","","","0.0345","","","0.0897","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101507","15.951","0.002","4.607","0.001","17.294","0.002","90","","103.7","0.1","90","","1234.7","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 Br N O -","- C14 H12 Br N O -","- C56 H48 Br4 N4 O4 -","4","1","","Yeap, Guan-Yeow; Sandro, Calogero; Teoh, Siang-Guan; Teo, Soon-Beng","Crystal structure of 3-bromo-1-[(2-methylphenylimino)methyl]phenol, C14H12BrNO","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","163","164","","","","","","","","0.0359","","","0.1044","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101508","6.205","0.001","6.205","0.001","8.733","0.002","90","","90","","90","","336.24","0.11","293","2","293","2","","","","","","","","3","I 4/m m m","-I 4 2","139","","","","- Ba1.25 Bi0.75 O2.7 -","- Ba1.25 Bi0.75 O2.7 -","- Ba5 Bi3 O10.8 -","4","0.125","","Dietze, Utta; Steins, Manfred; Lorenz, Michael; Bente, Klaus; Doering, Thomas","Crystal structure of barium bismuth oxide, Ba2(Ba0.5Bi0.5Bi)O5.4","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","153","153","","","","","","","","0.048","","","0.1213","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101509","12.29","0.002","12.29","0.002","12.29","0.002","90","","90","","90","","1856.3","0.5","300","2","300","2","","","","","","","","3","I a -3 d","-I 4bd 2c 3","230","holmium gallium garnet","","","- Ga5 Ho3 O12 -","- Ga5 Ho3 O12 -","- Ga40 Ho24 O96 -","8","0.0833333","","Patzke, Greta; Wartchow, Rudolf; Binnewies, Michael","Crystal structure of triholmium pentagallium dodecaoxide, Ho3Ga2(GaO4) 3 and of tridysprosium pentagallium dodecaoxide, Dy3Ga2(GaO4)3","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","143","144","","","","","","","","0.0184","","","0.0285","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101510","12.306","0.001","12.306","0.001","12.306","0.001","90","","90","","90","","1863.6","0.3","300","2","300","2","","","","","","","","3","I a -3 d","-I 4bd 2c 3","230","dysprosium gallium garnet","","","- Dy3 Ga5 O12 -","- Dy3 Ga5 O12 -","- Dy24 Ga40 O96 -","8","0.0833333","","Patzke, Greta; Wartchow, Rudolf; Binnewies, Michael","Crystal structure of triholmium pentagallium dodecaoxide, Ho3Ga2(GaO4)3 and of tridysprosium pentagallium dodecaoxide, Dy3Ga2(GaO4)3","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","143","144","","","","","","","","0.0166","","","0.0259","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101511","12.245","0.001","12.245","0.001","12.245","0.001","90","","90","","90","","1836","0.3","300","2","300","2","","","","","","","","5","P 21 3","P 2ac 2ab 3","198","sodium zincarsenate","","","- As4 H6 Na6 O19 Zn3 -","- As4 H6 Na6 O19 Zn3 -","- As16 H24 Na24 O76 Zn12 -","4","0.333333","","Gesing, Thorsten M.; Wartchow, Rudolf","Crystal structure of hexasodium trizinc tetraarsenate trihydrate, Na6Zn3(AsO4)4 · 3H2O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","145","146","","","","","","","","0.0182","","","0.0361","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101512","9.16","0.005","6.643","0.004","8.339","0.006","90","","116.52","0.05","90","","454","0.5","293","2","293","2","","","","","","","","3","C 1 2/m 1","-C 2y","12","Tin(II)dioxodecafluorostannate(IV)","","","- F5 O Sn2 -","- F5 O Sn2 -","- F20 O4 Sn8 -","4","0.5","","Chang, Jen-Hui; Köhler, Jürgen","Crystal structure of tin(II)dioxodecafluorostannate(IV), Sn~4~O~2~F~10~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","147","148","","","","","","","","0.0203","","","0.0467","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101513","7.865","0.002","7.865","0.002","3.898","0.001","90","","90","","120","","208.8","0.1","293","2","293","2","","","","","","","","3","P 6/m m m","-P 6 2","191","","","","- Al9 Co2 Eu -","- Al9 Co2 Eu -","- Al9 Co2 Eu -","1","0.0416667","","Thiede, Verena M. T.; Jeitschko, Wolfgang","Crystal structure of europium cobalt aluminide (1/2/9), EuCo2Al9","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","149","150","","","","","","","","0.0144","","","0.0351","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101514","12.391","0.002","12.391","0.002","12.391","0.002","90","","90","","90","","1902.6","0.4","297","2","297","2","","","","","","","","5","I a -3 d","-I 4bd 2c 3","230","","","","- Al12 Fe12 Na24 O96 Te16 -","- Al1.374 Fe1.626 Na3 O12 Te2 -","- Al10.992 Fe13.008 Na24 O96 Te16 -","8","0.0833333","","Wedel, Boris; Sugiyama, Kazuma","Crystal structure of sodium iron aluminium tellurate, a new tellurium compound with garnet structure, Na3(Fe,Al)3Te2O12","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","2","151","152","","","","","","","","0.0154","","","0.0421","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101515","8.597","0.002","10.033","0.002","10.914","0.002","88.46","0.03","68.71","0.03","81.99","0.03","868.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","hydroxylammonium sulfanilate","","","- C6 H10 N2 O4 S -","- C6 H10 N2 O4 S -","- C24 H40 N8 O16 S4 -","4","2","","Schreuer, Jürgen","Crystal structure of hydroxylammonium sulfanilate, (NH~3~OH)H~2~NC~6~H~4~SO~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","319","320","","","","","","","","0.0281","","","0.0774","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101516","7.934","0.004","20.525","0.006","5.642","0.002","91.1","0.03","91.58","0.04","87.29","0.03","917.2","0.6","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C21 H19 F3 O3 -","- C21 H19 F3 O3 -","- C42 H38 F6 O6 -","2","1","","Avery, T. D.; Taylor, D. K.; Tiekink, E. R. T.","Crystal structure of benzyl 2-(3-methyl-2-(p-trifluoromethylbenzoyl)- cyclopropyl)acetate, C~21~H~19~F~3~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","363","364","","","","","","","","0.0662","","","0.0635","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101517","10.491","0.004","9.314","0.004","26.586","0.008","90","","92.131","0.01","90","","2595.9","0.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","1,8-diamino-octane zirconium bis(nitrilotriacetate) dihydrate","","","- C20 H38 N4 O14 Zr -","- C20 H38 N4 O14 Zr -","- C80 H152 N16 O56 Zr4 -","4","1","","Haussühl, Eiken; Giester, Gerald; Tillmanns, Ekkehart","Crystal structure of 1,8-diaminooctane zirconium bis(nitrilotriacetate) dihydrate, (NH~3~(CH~2~)~8~NH~3~)Zr(N(CH~2~COO)~3~)~2~ · 2 H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","373","374","","","","","","","","0.0289","","","0.0756","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101518","9.941","0.002","11.209","0.002","10.639","0.002","90","","114.38","0.01","90","","1079.8","0.4","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C13 H22 N5 O14 Tl Zr -","- C13 H22 N5 O14 Tl Zr -","- C26 H44 N10 O28 Tl2 Zr2 -","2","1","","Haussühl, Eiken; Giester, Gerald; Tillmanns, Ekkehart","Crystal structure of thallium guanidinium zirconium bis(nitrilotriacetate) dihydrate, Tl(C(NH~2~)~3~)Zr(N(CH~2~COO)~3~)~2~ · 2 H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","375","376","","","","","","","","0.0256","","","0.0623","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101519","9.266","0.003","14.659","0.005","30.703","0.017","90","","90","","90","","4171","3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 N4 O4 -","- C20 H26 N4 O4 -","- C160 H208 N32 O32 -","8","2","","Ramos Silva, M.; Paixão, J. A.; Matos Beja, A.; Alte da Veiga, L.; Martin-Gil, J.","Crystal structure of L-argininium diphenylacetate, C~6~H~15~N~4~O~2~ ^+^C~14~H~11~O~2~^‒^","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","326","328","","","","","","","","0.0669","","","0.179","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101520","5.0321","0.0003","14.8258","0.0009","17.427","0.001","90","","90","","90","","1300.1","0.1","296.7","","296","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H13 N O6 S -","- C11 H13 N O6 S -","- C44 H52 N4 O24 S4 -","4","1","","Shan, Yongkui; Huang, Songping D.","Crystal structure of R-(-)-N-benzenesulphonylglutamic acid, C~11~H~13~NO~6~S","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","379","380","","","","","","","","0.0274","","","0.0411","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101521","10.1958","0.0006","22.01","0.001","15.0067","0.0009","90","","108.843","0.001","90","","3187.2","0.3","296.7","","296","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C48 H84 N6 O24 P6 -","- C48 H72 N6 O24 P6 -","- C96 H144 N12 O48 P12 -","2","1","","Shan, Yongkui; Huang, Songping D.","Crystal structure of R-(+)-1-phenylethylammonium dihydrogenphosphate, C~48~H~84~N~6~O~24~P~6~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","391","393","","","","","","","","0.0534","","","0.0636","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101522","6.1829","0.0006","34.03","0.003","7.4127","0.0007","90","","90.045","0.002","90","","1559.7","0.2","296.2","","296.2","","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C19 H18 O3 -","- C19 H18 O3 -","- C76 H72 O12 -","4","1","","Shan, Yongkui; Zhou, Hongping; Huang, Songping D.","Crystal structure of 1,5-bis(4-methoxyphenyl)-1,4-pentadien-3-one, C~19~H~18~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","381","382","","","","","","","","0.0596","","","0.0859","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101523","13.3994","0.0007","23.098","0.001","26.379","0.001","90","","90.265","0.001","90","","8164.4","0.6","296.7","","296.7","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H100 N5 O43 V18 -","- C40 H100 N5 O43 V18 -","- C160 H400 N20 O172 V72 -","4","1","","Shan, Yongkui; Huang, Songping D.","Crystal structure of pentakis(tetraethylammonium) octadecavanadate, [(C~2~H~5~)~4~N]~5~[V~18~O~42~(H~2~O)]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","383","386","","","","","","","","0.076","","","0.0836","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101524","12.6005","0.0009","11.8803","0.0008","16.573","0.001","90","","104.675","0.001","90","","2400","0.3","296","1","296","1","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H16 Cl3 N4 O4 Rh -","- C24 H16 Cl3 N4 O4 Rh -","- C96 H64 Cl12 N16 O16 Rh4 -","4","1","","Ji, Zhiqin; Shan, Yongkui; Guadalupe, Ana R.; Huang, Songping","Crystal structure of cis-dichlorobis(1,10-phenanthroline)rhodium(III) perchlorate, C~24~H~16~Cl~3~N~4~O~4~Rh","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","387","388","","","","","","","","0.0555","","","0.0633","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101525","9.354","0.004","10.099","0.004","10.774","0.002","74.92","0.02","64.51","0.02","64.31","0.03","824.5","0.6","296","1","296","1","","","","","","","","6","P -1","-P 1","2","","","","- C17 H14 Cl N3 O2 S -","- C17 H14 Cl N3 O2 S -","- C34 H28 Cl2 N6 O4 S2 -","2","1","","Perazza, Maribelliz; Rivera, Luis A.; Cordero, Marisol; Huang, Songping D.","Crystal structure of (E)-2-(2-chloro-5-nitrostyryl)-1-(methylthio) methylbenzimidazole, C~17~H~14~ClN~3~O~2~S","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","389","390","","","","","","","","0.061","","","0.074","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101526","5.848","0.001","12.707","0.001","18.919","0.002","90","","90","","90","","1405.9","0.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C8 H4 Cl5 F3 N Nb -","- C8 H4 Cl5 F3 N Nb -","- C32 H16 Cl20 F12 N4 Nb4 -","4","1","","Stumpf, Klaus; Blachnik, Roger; Roth, Georg","Crystal structure of {3-(trifluormethyl)benzonitrile}pentachloro-niobium(V), NbCl~5~(m-CF~3~)C~6~H~4~CN","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","397","398","","","","","","","","0.0177","","","0.0324","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101527","12.594","0.003","10.182","0.002","24.385","0.005","90","","101.52","0.03","90","","3063.9","1.1","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C24 H20 Cl6 Nb P S4 -","- C24 H20 Cl6 Nb P S4 -","- C96 H80 Cl24 Nb4 P4 S16 -","4","1","","Stumpf, Klaus; Blachnik, Roger; Roth, Georg; Kastner, Guido","Crystal structure of tetra(thiophenyl)phosphonium hexachloro-niobate(V), [P(SC~6~H~5~)~4~][NbCl~6~]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","399","400","","","","","","","","0.0273","","","0.063","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101528","8.297","0.004","9.266","0.004","25.173","0.011","90","","90","","90","","1935.3","1.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H23 N O7 -","- C19 H23 N O7 -","- C76 H92 N4 O28 -","4","1","","Henkel, Sonja; Kuban, Juraij; Pruschek, Petra; Jäger, Volker","Crystal structure of (3aS,4R,5S,6R,6aS)-4,5,6-triacetoxy-1-benzyl- 3,3a,4,5,6,6a-hexahydro-1H-cyclopent[c]-isoxazole, C~19~H~23~NO~7~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","401","402","","","","","","","","0.0574","","","0.1602","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101529","7.729","0.002","50.439","0.012","7.515","0.002","90","","90","","90","","2929.7","1.2","293","2","293","2","","","","","","","","5","F m m 2","F 2 -2","42","","","","- C30 H28 Cl4 N2 Pb -","- C30 H28 Cl4 N2 Pb -","- C120 H112 Cl16 N8 Pb4 -","4","0.25","","Braun, Markus; Frey, Wolfgang","Crystal structure of bis(2-anthrylmethylammonium) lead tetrachloride, (C~15~H~11~NH~3~)~2~PbCl~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","335","336","","","","","","","","0.0568","","","0.1383","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101530","33.816","0.009","5.6121","0.001","5.578","0.0007","90","","93.69","0.02","90","","1056.4","0.4","293","2","293","2","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","","- C16 H24 Cl4 N2 Pb -","- C16 H24 Cl4 N2 Pb -","- C32 H48 Cl8 N4 Pb2 -","2","0.25","","Braun, Markus; Frey, Wolfgang","Crystal structure of bis(2-phenylethylammonium) lead tetrachloride, C~16~H~24~Cl~4~N~2~Pb","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","337","338","","","","","","","","0.0355","","","0.0879","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101531","17.97","0.004","12.288","0.002","21.9","0.004","90","","90.73","0.03","90","","4835.5","1.6","293","2","293","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C9 H22 Co F9 N4 O11 S3 -","- C9 H18 Co F9 N4 O11 S3 -","- C72 H144 Co8 F72 N32 O88 S24 -","8","2","","Düpre, Y.; Bartscherer, E.; Sander, J.; Huch, V.; Hegetschweiler, K.","Crystal structure of diaqua[tris(2-aminoethyl)amine]cobalt(III) tris (trifluoromethanesulfonate), [Co(tren)(OH~2~)~2~](CF~3~SO~3~)~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","406","409","","","","","","","","0.0465","","","0.1179","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101532","11.225","0.002","14.354","0.003","16.926","0.003","90","","90","","90","","2727.2","0.9","293","2","293","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C7 H22 Cl Co N4 O5 -","- C7 H22 Cl Co N4 O5 -","- C56 H176 Cl8 Co8 N32 O40 -","8","1","","Düpre, Y.; Bartscherer, E.; Maas, O.; Sander, J.; Hegetschweiler, K.","Crystal structure of carbonato[tris(2-aminoethyl)amine]cobalt(III) chloride dihydrate, [Co(tren)CO~3~]Cl · 2 H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","405","405","","","","","","","","0.038","","","0.0987","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101533","16.217","0.003","5.235","0.004","20.756","0.003","90","","103.289","0.011","90","","1715","1.4","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","(-)-α-Conidendrin","","","- C20 H20 O6 -","- C23 H20 O6 -","- C92 H80 O24 -","4","1","","Stomberg, Rolf; Lundquist, Knut","Crystal structure of (-)-α-conidendrin, C~20~H~20~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","403","404","","","","","","","","0.0444","","","0.1291","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101534","15.994","0.003","9.78","0.002","31.354","0.004","90","","94.46","0.01","90","","4889.6","1.5","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H28 Br4 Co N2 -","- C18 H28 Br4 Co N2 -","- C144 H224 Br32 Co8 N16 -","8","1","","Wiest, Thomas; Eickmeier, Henning; Reuter, Hans; Blachnik, Roger","Crystal structure of bis(trimethylphenylammonium) tetrabromocobaltate, [Me~3~PhN]~2~[CoBr~4~], and of bis(trimethylphenylammonium) tetrachlorocobaltate, [Me~3~PhN]~2~[CoCl~4~]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","394","396","","","","","","","","0.0542","","","0.1039","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101535","15.542","0.002","9.552","0.002","30.86","0.005","90","","95.451","0.011","90","","4560.6","1.3","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H28 Cl4 Co N2 -","- C18 H28 Cl4 Co N2 -","- C144 H224 Cl32 Co8 N16 -","8","1","","Wiest, Thomas; Eickmeier, Henning; Reuter, Hans; Blachnik, Roger","Crystal structure of bis(trimethylphenylammonium) tetrabromocobaltate, [Me~3~PhN]~2~[CoBr~4~], and of bis(trimethylphenylammonium) tetrachlorocobaltate, [Me~3~PhN]~2~[CoCl~4~]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","394","396","","","","","","","","0.0428","","","0.1075","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101536","19.844","0.005","5.684","0.002","14.646","0.006","90","","90.51","0.03","90","","1651.9","1","293","2","293","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C16 H21 N O2 S -","- C16 H21 N O2 S -","- C64 H84 N4 O8 S4 -","4","1","","Tinant, Bernard; Declercq, Jean-Paul; Jnoff, Eric; Ghosez, Leon","Crystal structure of S-ethyl (3S,4R,5S,6S)-5-carbothioate-3,4-dimethyl- 6-phenyltetrahydropyridin-2(1H)-one, C~16~H~21~NO~2~S","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","321","322","","","","","","","","0.0772","","","","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101537","28.091","0.004","9.209","0.002","11.142","0.002","90","","97.31","0.01","90","","2858.9","0.9","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C13 H18.5 N2 O5.25 -","- C13 H18.5 N2 O5.25 -","- C104 H148 N16 O42 -","8","2","","Tinant, Bernard; Declercq, Jean-Paul; Jnoff, Eric; Ghosez, Leon","Crystal structure of 6-acetyl-3,4-dimethyl-5-[(2-oxo-1,3-oxazolidin- 3-yl)-carbonyl]tetrahydropyridin-2(1H)-one—water (4/1), C~13~H~18~N~2~O~5~ · 0.25 H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","323","325","","","","","","","","0.0512","","","","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101538","23.63","0.04","5.576","0.01","17.98","0.03","90","","95.11","0.13","90","","2361","7","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C15 H12 O3 -","- C15 H12 O3 -","- C120 H96 O24 -","8","1","","Feng, Meow-Chan; Howie, R. Alan; Rufino, Helena; Yeap, Guan-Yeow; Tay, Meng-Guan; Teoh, Siang-Guan","Crystal structure of 3-(2-hydroxyphenyl)-1-(2'-hydroxyphenyl)-2-propen- 1-one, C~15~H~12~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","329","330","","","","","","","","0.1081","","","0.2044","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101539","33.619","0.007","7.8195","0.0012","7.7282","0.0013","90","","90","","90","","2031.6","0.6","293","2","293","2","","","","","","","","5","C m c 21","C 2c -2","36","","","","- C14 H20 Cl4 N2 Pb -","- C14 H20 Cl4 N2 Pb -","- C56 H80 Cl16 N8 Pb4 -","4","0.5","","Braun, Markus; Frey, Wolfgang","Crystal structure of bis(benzylammonium) lead tetrachloride, (C~7~H~7~NH~3~) ~2~PbCl~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","331","332","","","","","","","","0.0213","","","0.0544","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101540","7.7485","0.0015","7.79","0.002","20.859","0.003","90","","90","","90","","1259","0.4","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","","","","- C22 H24 Cl4 N2 Pb -","- C22 H24 Cl4 N2 Pb -","- C44 H48 Cl8 N4 Pb2 -","2","0.25","","Braun, Markus; Frey, Wolfgang","Crystal structure of bis(2-naphthylmethylammonium) lead tetrachloride, (C~11~H~9~NH~3~)~2~PbCl~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","333","334","","","","","","","","0.0479","","","0.1113","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"8101541","10.27","0.003","19.496","0.004","10.27","0.004","90","","106.15","0.01","90","","1975.1","0.9","293","","293","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C23 H21 N O3 Sn -","- C23 H21 N O3 Sn -","- C92 H84 N4 O12 Sn4 -","4","1","","Basu Baul, T. S.; Dutta, S.; Tiekink, E. R. T.","Crystal structure of diphenyltin(IV) N-(2-hydroxy-5-ethylacetophenone) glycinate, C~23~H~21~NO~3~Sn","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","361","362","","","","","","","","0.0268","","","0.0257","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101542","5.4166","0.0005","8.2886","0.0008","12.339","0.001","90","","92.18","0.01","90","","553.57","0.09","","","291","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C10 H11 F O4 S -","- C10 H11 F O4 S -","- C20 H22 F2 O8 S2 -","2","1","","Zukerman-Schpector, J.; Olivato, Paulo R.; Yreijo, Marcelo H.","Crystal structure of 2'-fluorophenyl-2-ethylsulfonyl acetate, C~10~H~11~FO~4~S","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","365","366","","","","","","","","0.0375","","","0.088","","","","","","","","","","","has coordinates,has disorder","176728","2020-10-21","18:00:00",""
"8101543","7.272","0.005","12.625","0.009","7.143","0.004","94.1","0.05","102.99","0.05","82.11","0.06","632.4","0.7","295","","295","","","","","","","","","5","P -1","-P 1","2","","","","- C2 H12 Cl4 N6 Zn -","- C2 H12 Cl4 N6 Zn -","- C4 H24 Cl8 N12 Zn2 -","2","1","","Furukawa, Yoshihiro; Ishida, Hiroyuki; Kashino, Setsuo","Crystal structure of bis(guanidinium) tetrachlorozincate, [C(NH~2~)~3~]~2~ZnCl~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","367","368","","","","","","","","0.089","","","0.058","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101544","7.176","0.002","8.175","0.009","22.424","0.01","90","","95.1","0.03","90","","1310","2","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H32 N10 Ni O6 -","- C22 H32 N10 Ni O6 -","- C44 H64 N20 Ni2 O12 -","2","0.5","","Lemoine, P.; Tomas, A.; Viossat, B.; Prangé, T.","Crystal structure of bis(N,N-dimethylbiguanide)nickel(II) salicylate, C~22~H~32~N~10~NiO~6~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","369","370","","","","","","","","0.053","","","0.1382","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101545","9.128","0.002","8.931","0.002","9.572","0.002","90","","100.1","0.03","90","","768.2","0.3","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","silver sulfanilate","","","- C6 H6 Ag N O3 S -","- C6 H6 Ag N O3 S -","- C24 H24 Ag4 N4 O12 S4 -","4","1","","Schreuer, Jürgen","Crystal structure of silver sulfanilate, AgH~2~NC~6~H4SO~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","311","312","","","","","","","","0.0234","","","0.0549","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101546","9.866","0.002","19.799","0.004","10.079","0.002","90","","114.98","0.03","90","","1784.6","0.6","290","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","thallium sulfanilate hemihydrate","","","- C6 H7 N O3.5 S Tl -","- C6 H7 N O3.5 S Tl -","- C48 H56 N8 O28 S8 Tl8 -","8","2","","Schreuer, Jürgen","Crystal structure of thallium sulfanilate semihydrate, TlH~2~NC~6~H4SO~3~ · 0.5 H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","313","314","","","","","","","","0.0369","","","0.0708","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101547","11.317","0.002","7.562","0.002","11.827","0.002","90","","109.19","0.03","90","","955.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","ammonium sulfanilate hydrate","","","- C6 H12 N2 O4 S -","- C6 H12 N2 O4 S -","- C24 H48 N8 O16 S4 -","4","1","","Schreuer, Jürgen","Crystal structure of ammonium sulfanilate hydrate, NH4H~2~NC~6~H4SO~3~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","315","316","","","","","","","","0.0314","","","0.0811","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101548","11.1","0.002","7.448","0.001","24.228","0.005","90","","95.69","0.03","90","","1993.1","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","methylammonium sulfanilate","","","- C7 H12 N2 O3 S -","- C7 H12 N2 O3 S -","- C56 H96 N16 O24 S8 -","8","2","","Schreuer, Jürgen","Crystal structure of methylammonium sulfanilate, (CH~3~NH~3~)H~2~NC~6~H4SO~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","317","318","","","","","","","","0.0425","","","0.1068","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101549","10.86312","0.00017","8.30123","0.00014","5.16054","0.00008","90","","90","","90","","465.36","0.01","293","2","293","2","","","","","","","","5","P n a 21","P 2c -2n","33","Zeolite A(BW)","","","- As4 H8 Li4 O20 Zn4 -","- As H2 Li O5 Zn -","- As4 H8 Li4 O20 Zn4 -","4","1","","Gesing, Thorsten M.","Crystal structure of lithium zinc arsenate hydrate, LiZnAsO~4~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","301","301","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101550","12.501","0.001","11.752","0.001","13.923","0.002","90","","90","","90","","2045.5","0.4","","","293","1","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- Cl10 Cs4 O Ru2 -","- Cl5 Cs2 O0.5 Ru -","- Cl40 Cs16 O4 Ru8 -","8","1","","da Silva, Roberto Santana; Zukerman-Schpector, J.; Tfouni, Elia; Lever, A. B. P.","Crystal structure of cesium μ-oxo-bis[pentachlororuthenate(IV)], Cs~4~[Ru~2~Cl~10~O]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","303","304","10.1515/ncrs-1999-0304","","","","","","","0.0616","","","0.1915","","","","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8101551","7.427","0.002","7.781","0.002","14.523","0.003","90","","90","","90","","839.3","0.4","298","2","298","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","rubidium sulfamate","","","- H2 N O3 Rb S -","- H2 N O3 Rb S -","- H16 N8 O24 Rb8 S8 -","8","1","","Schreuer, Jürgen","Crystal structure of rubidium sulfamate, RbH~2~NSO~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","305","305","","","","","","","","0.0311","","","0.0575","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101552","8.25","0.002","7.6246","0.001","8.4","0.002","90","","116.11","0.02","90","","474.5","0.17","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","cesium sulfamate","","","- Cs H2 N O3 S -","- Cs H2 N O3 S -","- Cs4 H8 N4 O12 S4 -","4","1","","Schreuer, Jürgen","Crystal structure of cesium sulfamate, CsH~2~NSO~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","306","306","","","","","","","","0.0229","","","0.0765","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101553","5.239","0.0013","6.2624","0.0016","24.755","0.005","90","","90","","90","","812.2","0.3","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","cesium hydrogen sulfamate","","","- Cs H5 N2 O6 S2 -","- Cs H5 N2 O6 S2 -","- Cs4 H20 N8 O24 S8 -","4","1","","Schreuer, Jürgen","Crystal structure of cesium hydrogen sulfamate, CsH~2~NSO~3~ · H~3~NSO~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","307","308","","","","","","","","0.0227","","","0.0492","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101554","9.969","0.002","13.077","0.003","6.0199","0.0016","90","","90","","90","","784.8","0.3","302","2","302","2","","","","","","","","4","P n a 21","P 2c -2n","33","ammonium sulfate hydrogen sulfamate","","","- H11 N3 O7 S2 -","- H11 N3 O7 S2 -","- H44 N12 O28 S8 -","4","1","","Schreuer, Jürgen","Crystal structure of ammonium sulfate hydrogen sulfamate, (NH4)~2~SO4 · H~3~NSO~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","3","309","310","","","","","","","","0.0278","","","0.07","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101555","11.9053","0.0008","19.348","0.001","7.4578","0.0005","90","","90","","90","","1717.9","0.2","296.2","","296.2","","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C10 H12 N4 O8 Zn -","- C10 H12 N4 O8 Zn0.5 -","- C40 H48 N16 O32 Zn2 -","4","0.5","","Xiong, Ren-Gen; Lewandowski, Brad J.; Huang, Songping D.","Crystal structure of diaqua-4,4'-bipyridinezinc nitrate Zn(4,4'-bipy) (H~2~O)~2~(NO~3~)~2~: a one-dimensional coordination polymer","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","461","462","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101556","14.684","0.002","13.251","0.002","7.982","0.001","90","","92.87","0.01","90","","1551.1","0.4","293","","293","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H16 O6 -","- C18 H15 O6 -","- C72 H60 O24 -","4","1","","Habsaoui, Amar; Gaydou, Emile M.; Wallet, Jean-Claude","Crystal structure of 6-hydroxy-2',3',4'-trimethoxyflavone, C~18~H~16~O~6~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","465","466","","","","","","","","0.057","","","0.082","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101557","6.791","0.002","8.114","0.002","10.311","0.003","88.04","0.02","86.4","0.02","84.87","0.02","564.6","0.2","293","","293","","","","","","","","","5","P -1","-P 1","2","","","","- C10 H12 N2 O3 S -","- C10 H12 N2 O3 S -","- C20 H24 N4 O6 S2 -","2","1","","Cousson, Alain; Coustard, Jean-Marie","Crystal structure of (E)-1-(methylthio)-1-(4'-methoxyphenylamino)- 2-nitroethene, C~10~H~12~N~2~O~3~S","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","467","468","","","","","","","","0.0318","","","0.0306","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101558","5.278","0.003","8.235","0.004","9.667","0.002","95.26","0.04","103.68","0.04","102.16","0.04","394.7","0.3","293","","300","","","","","","","","","5","P -1","-P 1","2","","","","- C5 H9 N O3 S -","- C5 H9 N O3 S -","- C10 H18 N2 O6 S2 -","2","1","","Cousson, Alain; Coustard, Jean-Marie","Crystal structure of ethyl (Z)-2-hydroxyimino-2-(methylsulfanyl)acetate, C~5~H~9~SNO~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","469","470","","","","","","","","0.065575","","","0.078575","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101559","14.009","0.001","6.221","0.001","19.315","0.001","90","","95.261","0.001","90","","1676.2","0.3","291","1","291","1","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C40 H34 Sn2 -","- C40 H34 Sn2 -","- C80 H68 Sn4 -","2","0.5","","Jurkschat, Klaus; Schürmann, Markus; Schulte, Marcus","Crystal structure of 1,4-bis(triphenylstannyl)-2-butyne, Ph~3~SnCH~2~C≡ CCH~2~SnPh~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","471","472","","","","","","","","0.0282","","","0.0437","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101560","7.59","0.001","9.083","0.001","12.786","0.001","75.448","0.001","80.461","0.001","80.326","0.001","834","0.2","291","1","170","1","","","","","","","","6","P -1","-P 1","2","","","","- C12 H14 Cl2 O3 Sn W -","- C12 H14 Cl2 O3 Sn W -","- C24 H28 Cl4 O6 Sn2 W2 -","2","1","","Jurkschat, Klaus; Kaltenbrunner, Ulrich; Schürmann, Markus","Crystal structure of tert-butyl-1κC-2-(η^5^-cyclopentadienyl) dichloro-1κ^2^Cl-tricarbonyl-2κ^3^C-tintungsten (S‒W), tert-Bu[Cp(CO)~3~W]SnCl~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","473","474","","","","","","","","0.04","","","0.0988","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101561","6.363","0.004","12.535","0.004","16.641","0.003","90","","90","","90","","1327.3","1","293","2","293","2","","","","","","","","4","P 21 c n","P -2n 2a","33","","","","- C14 H15 N3 O2 -","- C14 H15 N3 O2 -","- C56 H60 N12 O8 -","4","1","","Paixão, J. A.; Matos Beja, A.; Ramos Silva, M.; Alte da Veiga, L.","Crystal structure of N,N'-diphenylguanidinium formate, C~14~H~15~N~3~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","475","476","","","","","","","","0.0273","","","0.0766","","","","","","","","","","","has coordinates","202018","2020-10-21","18:00:00",""
"8101562","8.861","0.001","11.794","0.001","10.891","0.001","90","0.001","103.682","0.001","90","0.001","1105.9","0.3","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H11 N O4 -","- C11 H11 N O4 -","- C44 H44 N4 O16 -","4","1","","Kakou-Yao, R.; Saba, A.; Ebby, N.; Pierrot, M.; Aycard, J. P.","Crystal structure of 3-(1'-nitropropyl)isobenzofuran-1(3H)-one, C~11~H~11~NO~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","479","480","","","","","","","","0.089","","","0.171","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101563","7.799","0.002","12.019","0.002","21.665","0.003","94.11","0.02","97.59","0.02","91.29","0.02","2006.8","0.7","291","2","291","2","","","","","","","","3","P -1","-P 1","2","","","","- C27 H18 O3 -","- C27 H18 O3 -","- C108 H72 O12 -","4","2","","Kolev, Tsonko; Glavcheva, Zornitza; Schürmann, Markus; Preut, Hans; Bleckmann, Paul; Radomirska, Valentina","Crystal structure of 1,3,5-tribenzoylbenzene, C~27~H~18~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","487","489","","","","","","","","0.0796","","","0.1295","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101564","22.598","0.003","11.626","0.001","18.539","0.002","90","","116.37","0.01","90","","4364","1","293","2","293","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C37 H42 Au2 Cl8 N4 O8 P2 -","- C36.5 H41 Au2 Cl2 N4 O8 P2 -","- C146 H164 Au8 Cl8 N16 O32 P8 -","4","0.5","","Bachechi, Fiorella; Burini, Alfredo; Galassi, Rossana; Pietroni, Bianca Rosa; Tesei, Dania","Crystal structure of bis(3,5-dimethylpyrazole)-N,N'-μ-[1,3-bis (diphenylphosphino)propane]-P,P'-digold(I)] diperchlorate, C~37~H~42~N~4~P~2~Au~2~Cl~2~O~8~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","497","498","10.1515/ncrs-1999-0449","","","","","","","0.0608","","","0.0772","","","","","","","","","","","has coordinates","188740","2020-10-21","18:00:00",""
"8101565","5.553","0.001","7.692","0.001","15.676","0.001","90","0.01","92.812","0.001","90","0.01","668.8","0.2","298","","","","","","","","","","","4","P 1 c 1","P -2yc","7","","","","- C16 H9 N O6 -","- C16 H9 N O6 -","- C32 H18 N2 O12 -","2","1","","Kakou-Yao, R.; Saba, A.; Ebby, N.; Aycard, J. P.","Crystal structure of 4-(α-hydroxy-p-nitrobenzyl)isochroman-1,3-dione, C~16~H~9~NO~6~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","481","482","","","","","","","","0.037","","","0.213","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101566","8.7185","0.0001","11.4066","0.0001","22.9699","0.0003","90","","90","","90","","2284.32","0.04","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H17 Mo N3 O4 -","- C24 H17 Mo N3 O4 -","- C96 H68 Mo4 N12 O16 -","4","1","","Shamsudin, M.; Affan, M. A.; Hitam, R.; Yamin, B. M.; Fun, H. K.; Ibrahim, R. A.","Crystal structure of methylpyridylbenzophenoneazine tetracarbonylmolybdenum(0), C~24~H~17~MoN~3~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","499","500","","","","","","","","0.027","","","0.0506","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101567","23.7325","0.0005","7.9631","0.0003","12.3151","0.0009","90","","90","","90","","2327.4","0.2","293","2","293","2","","","","","","","","4","P m n 21","P 2ac -2","31","","","","- C44 H58 O10 P2 -","- C44.006 H58.014 O10.003 P2 -","- C88.012 H116.028 O20.006 P4 -","2","0.5","","Reck, Guenter; Schneider, Matthias; Gloede, Joerg; Vollhardt, Dieter","Crystal structure of 11,23-bis(diisopropylphosphono)-25,26,27,28- tetramethoxycalix[4]arene, C~44~H~58~O~10~P~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","501","502","","","","","","","","0.0781","","","0.2375","","","","","","","","","","","has coordinates,has disorder","130149","2020-10-21","18:00:00",""
"8101568","16.806","0.004","9.488","0.003","19.898","0.007","90","","107.96","0.02","90","","3018.1","1.5","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C30 H23 Ag Br N2 O2 P -","- C30 H23 Ag Br N2 O2 P -","- C120 H92 Ag4 Br4 N8 O8 P4 -","4","1","","Jin, Qiong-Hua; Xin, Xiu-Lan; Zhu, Fu-Jiang; Li, Yan","Crystal structure of bromo-(1,10-phenathroline-N,N')(triphenylphosphine) silver(I) dihydrate, Ag(Phen)(PPh~3~)Br · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","503","504","","","","","","","","0.0675","","","0.1798","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101569","25.234","0.004","13.985","0.002","12.425","0.002","90","","90","","90","","4385","3","293","2","293","2","","","","","","","","5","I b a m","-I 2 2c","72","","","","- C10 H27 Cl6 N3 Se -","- C10 Cl6 N3 Se -","- C80 Cl48 N24 Se8 -","8","0.5","","Müller, Ulrich; Eckhoff, Brigitta","Crystal structure of bis(tetramethylammonium)-hexachloroselenate(IV‒ acetonitrile (1/1), [N(CH~3~)~4~]~2~[SeCl~6~] · CH~3~CN, a structure related to epasolite","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","505","506","","","","","","","","0.0583","","","0.1237","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101570","11.829","0.003","11.829","0.003","7.33","0.002","90","","90","","90","","1025.5","0.4","293","2","293","2","","","","","","","","5","I -4","I -4","82","Tetraphenylphosphonium-thiocyanate","","","- C25 H20 N P S -","- C25 H20 N P S -","- C50 H40 N2 P2 S2 -","2","0.25","","Köckerling, Martin; Willems, Johannes B.","Crystal structure of tetraphenylphosphonium thiocyanate, (C~6~H~5~)~4~P(SCN)","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","460","460","","","","","","","","0.0356","","","0.0988","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101571","13.725","0.001","13.261","0.001","18.083","0.002","90","","90","","90","","3291.2","0.5","193","2","193","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C16 H22 Li N O4 -","- C16 H22 Li N O4 -","- C128 H176 Li8 N8 O32 -","8","1","","Langlotz, Ira; Marsch, Michael; Harms, Klaus; Boche, Gernot","Crystal structure of (benzylcyano-N)-(1,4,7,10-tetraoxocyclodecane-O,O',O'',O''')-lithium, C~16~H~22~LiNO~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","509","510","10.1515/ncrs-1999-0455","","","","","","","0.0786","","","0.2118","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101572","8.403","0.001","17.024","0.002","9.406","0.002","90","","100.805","0.009","90","","1321.7","0.4","193","2","193","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C29 H40 Li N3 O -","- C29 H40 Li N3 O -","- C58 H80 Li2 N6 O2 -","2","1","","Ledig, Burkhard; Marsch, Michael; Harms, Klaus; Boche, Gernot","Crystal structure of (1-cyano-indenyl-N-((-)spateine-N,N')-(tetrafuran-O)-lithium, C~29~H~40~LiN~3~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","511","512","10.1515/ncrs-1999-0456","","","","","","","0.043","","","0.1127","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101573","12.288","0.005","9.517","0.008","18.125","0.007","90","","109.26","0.03","90","","2000","1","293","","293","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C20 H18 Cu I N P Se -","- C20 H18 Cu I N P Se -","- C80 H72 Cu4 I4 N4 P4 Se4 -","4","1","","Lobana, T. S.; Verma, R.; Mahajan, R.; Tiekink, E. R. T.","Crystal structure of di-μ-iodo-bis{(methylcyanide-N) (triphenylselenophosphorane)copper(I)}, [CuI(Ph~3~PSe)(CH~3~CN)]~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","513","514","","","","","","","","0.0544","","","0.0586","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101574","19.7821","0.0003","10.6352","0.0002","31.4217","0.0004","90","","90","","90","","6610.7","0.2","243","2","243","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C48 H84 N6 O20 P2 U2 -","- C48 N6 O20 P2 U2 -","- C192 N24 O80 P8 U8 -","4","1","","Cherfa, Samy; Pecaut, Jacques; Nierlich, Martine","Crystal structure of octyl(phenyl)-N,N-diisobutylcarbamoylmethylphosphine dioxouranium nitrate, C~48~H~84~N~6~O~20~P~2~U~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","523","525","","","","","","","","0.0623","","","0.148","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101575","12.553","0.003","6.531","0.003","12.587","0.003","90","","110.25","0.01","90","","968.1","0.6","293","2","293","2","","","","","","","","6","P 1 2/a 1","-P 2ya","13","","","","- C10 H28 F6 N2 O6 Ta -","- C10 H28 F6 N2 O6 Ta -","- C20 H56 F12 N4 O12 Ta2 -","2","0.5","","Ramos Silva, M.; Matos Beja, A.; Paixão, J. A.; Alte da Veiga, L.; Martin-Gil, J.","Crystal structure of betainium hexafluorotantalum(IV) dihydrate, (C~5~H~12~NO~2~)~2~TaF~6~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","477","478","","","","","","","","0.0299","","","0.0676","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101576","11.833","0.001","6.681","0.001","12.396","0.001","90","","93.682","0.01","90","","978","0.2","296.2","","296.2","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C12 H24 Mg N2 O14 -","- C12 H24 Mg0.5 N2 O14 -","- C24 H48 Mg N4 O28 -","2","0.5","","Muthuraman, Meiyappan; Bordet, Pierre; Le Fur, Yvette","Crystal structure of hexaaquamagnesium bis(p-nitrophenolate) dihydrate, Mg(H~2~O)~6~(O~2~NC~6~H~4~O)~2~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","527","528","","","","","","","","0.029","","","0.044","","","","","","","","","","","has coordinates","193981","2020-10-21","18:00:00",""
"8101577","12.3942","0.0011","5.8532","0.0012","15.6315","0.0011","90","","111.62","0.002","90","","1054.2","0.2","295","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H9 N O S -","- C13 H9 N O S -","- C52 H36 N4 O4 S4 -","4","1","","Aydın, Abdullah; Soylu, Hüseyin; Akkurt, Mehmet; Arıcı, Cengiz; Erdemir, Mustafa","Redetermination of the crystal structure of 2-(o-hydroxyphenyl)-Δ ^2^-1,3-benzo[4,5]thiazoline, C~13~H~9~NOS","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","529","530","","","","","","","","0.047","","","0.121","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101578","9.146","0.003","12.946","0.006","6.36","0.005","100.85","0.06","102.58","0.05","99.92","0.03","703.8","0.8","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C28 H28 Cl2 Sn2 -","- C28 H28 Cl2 Sn2 -","- C28 H28 Cl2 Sn2 -","1","0.5","","Dakternieks, D.; Lim, A. E. K.; Jurkschat, K.; Tiekink, E. R. T.","Crystal structure of chloro[4-(1-chloro-1,1-diphenylstannyl)-butyl] diphenylstannane, Ph~2~ClSn(CH~2~)~4~SnPh~2~Cl","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","515","516","","","","","","","","0.042","","","0.05","","","","","","","","","","","has coordinates","209080","2020-10-21","18:00:00",""
"8101579","7.534","0.001","16.23","0.001","11.911","0.001","90","0.001","108.382","0.001","90","0.001","1382.1","0.4","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H12 Cl2 O2 -","- C15 H12 Cl2 O2 -","- C60 H48 Cl8 O8 -","4","1","","Kakou-Yao, R.; Degny, E.; Ebby, N.; Aycard, J. P.","Crystal structure of 1-(2',6'-dichlorophenyl)-1-hydroxy-2-o-toluyl- ethane-2-one, C~15~H~12~Cl~2~O~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","485","486","","","","","","","","0.058","","","0.108","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101580","15.173","0.001","6.069","0.001","14.344","0.001","90","0.01","110.074","0.001","90","0.01","1240.6","0.4","298","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H9 F O4 -","- C16 H9 F O4 -","- C64 H36 F4 O16 -","4","1","","Kakou-Yao, R.; Saba, A.; Ebby, N.; Aycard, J. P.","Crystal structure of 4-(α-hydroxy-p-fluorobenzyl)isochroman- 1,3-dione, C~16~H~9~FO~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","483","484","","","","","","","","0.074","","","0.174","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101581","6.625","0.001","14.297","0.004","14.377","0.003","90","","90","","90","","1361.8","0.5","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H16 N4 O5 -","- C11 H16 N4 O5 -","- C44 H64 N16 O20 -","4","1","","Poje, Nevenka; Poje, Mirko; Vicković, Ivan","Crystal structure of (-)-4R,5R-(2R,3R-butylenedioxy)-3,7- dimethyltetrahydropurine-2,6,8-trione, C~11~H~16~N~4~O~5~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","531","532","","","","","","","","0.04","","","","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101582","7.919","0.002","4.7437","0.001","17.59","0.01","90","","91.71","0.04","90","","660.5","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C2 H8 As N O6 -","- C2 H8 As N O6 -","- C8 H32 As4 N4 O24 -","4","1","","Andrade, L. C. R.; Costa, M. M. R.; Paixão, J. A.; Agostinho Moreira, J.; Almeida, A.; Chaves, M. R.; Klöpperpieper, A.","Crystal structure of glycinium arsenate, C~2~NH~8~O~2~^+^AsO~4~^-^","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","535","536","","","","","","","","0.0211","","","0.05","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101583","9.185","0.001","5.2293","0.0009","20.168","0.003","90","","90","","90","","968.7","0.2","","","293","1","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C9 H10 O3 S -","- C9 H10 O3 S -","- C36 H40 O12 S4 -","4","1","","Zukerman-Schpector, J.; Olivato, P. R.; Bueno, E.; Guerrero, S. A.","Crystal structure of 1-phenylsulfonyl-2-propanone, C~9~H~10~O~3~S","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","563","564","","","","","","","","0.0441","","","0.085","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101584","13.176","0.005","14.043","0.002","17.289","0.006","90","","108.75","0.03","90","","3029.3","1.6","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H46 Cl4 N4 O2 Pd -","- C22 H46 Cl4 N4 O2 Pd -","- C88 H184 Cl16 N16 O8 Pd4 -","4","1","","Kuhn, Norbert; Göhner, Martin; Steimann, Manfred; Nachtigall, Christiane","Crystal structure of bis(1,3-diisopropyl-4,5-dimethylimidazolium) tetrachloropalladate dihydrate, (C~11~H~21~N~2~)~2~PdCl~4~ · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","565","566","","","","","","","","0.0476","","","0.1121","","","","","","","","","","","has coordinates","200426","2020-10-21","18:00:00",""
"8101585","21.793","0.004","5.2544","0.0009","10.807","0.008","90","","111.7","0.03","90","","1149.8","0.9","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","Perfluoroadipic Acid dihydrate","","","- C6 H6 F8 O6 -","- C6 H6 F8 O6 -","- C24 H24 F32 O24 -","4","0.5","","Centore, Roberto; Tuzi, Angela; Dr. Roberto Centore","Crystal structure of 2,2,3,3,4,4,5,5-octafluorohexanedioic acid dihydrate, (HOOC)C~4~F~8~(COOH) · 2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","526","526","","","","","","","","0.0325","","","0.0635","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101586","13.404","0.002","10.516","0.002","14.634","0.003","90","","92.47","0.02","90","","2060.8","0.7","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","1,1'-diethyl-2,2'-cyanine nitrate monohydrate","","","- C23 H25 N3 O4 -","- C23 H25 N3 O4 -","- C92 H100 N12 O16 -","4","1","","Koch, Oliver; Lork, Enno; Kleemeier, Malte; Schröer, Wolffram","Crystal structure of 1-ethyl-2-(1-ethyl-1H-quinoline-2-ylidenmethylene) quinolinium nitrate monohydrate, (C~23~H~25~N~2~)NO~3~ · H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","567","568","","","","","","","","0.0582","","","0.1391","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101587","7.6","0.001","9.184","0.001","7.9","0.001","90","","112.46","0.01","90","","509.58","0.11","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C6 H16 Cl2 N2 O3 -","- C6 H16 Cl2 N2 O3 -","- C12 H32 Cl4 N4 O6 -","2","1","","Henkel, Sonja; Kieß, Frank-Michael; Jäger, Volker","Crystal structure of 5-amino-1,4,5-trideoxy-1,4-imino-L-mannitol bis (hydrochloride), C~6~H~16~Cl~2~N~2~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","569","570","","","","","","","","0.0263","","","0.0666","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101588","22.4727","0.0004","10.2609","0.0003","20.0375","0.0003","90","","77.832","0.001","90","","4516.65","0.24","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","(THF)2Li(mu-Cl)2Ti(THF)2Cl2","","","- C16 H32 Cl4 Li O4 Ti -","- C16 H32 Cl4 Li O4 Ti -","- C128 H256 Cl32 Li8 O32 Ti8 -","8","2","","Rabe, Gerd W.; Rheingold, A. L.; Concolino, T. E.","Crystal structure of di-μ-chloro-bis(tetrahyrofurano)lithium bis(tetrahydrofurano)dichlorotitanate, (THF)~2~Li(μ-Cl)~2~Ti (THF)~2~Cl~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","574","576","","","","","","","","0.0888","","","0.2313","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101589","9.0375","0.0007","11.5621","0.0009","17.714","0.001","90","","98.262","0.001","90","","1831.7","0.2","296","1","273.2","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 F6 N2 P Rh -","- C18 H20 F6 N2 P Rh -","- C72 H80 F24 N8 P4 Rh4 -","4","1","","Alejandro, Felix; Guadalupe, Ana R.; Huang, Songping D.","Crystal structure of 2,2'-bipyridine-(η^4^-cycloocta-1,5-diene) rhodium(I) hexafluorophosphate, (C~18~H~20~N~2~)RhPF~6~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","463","464","","","","","","","","0.0349","","","0.0373","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101590","10.054","0.002","13.01","0.003","20.87","0.004","90","","90","","90","","2729.8","1","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","bis(butylamine) zirconium bis(nitrilotriacetate) dihydrate","","","- C20 H40 N4 O14 Zr -","- C20 H40 N4 O14 Zr -","- C80 H160 N16 O56 Zr4 -","4","1","","Hausühl, Eiken; Giester, Gerald; Tillmanns, Ekkehart","Crystal structure of the low temperature phase of bis(butylamine) zirconium bis(nitrilotriacetate) dihydrate, [NH~3~(CH~2~)~4~]~2~Zr [N(CH~2~COO)~3~]~2~ ·2H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","571","573","","","","","","","","0.0233","","","0.0467","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101591","9.429","0.002","9.429","0.002","19.234","0.004","90","","90","","120","","1480.9","0.5","293","2","293","2","","","","","","","","4","P 65","P 65","170","(S)-3,6,8-trimethylcaffolide","","","- C8 H9 N3 O5 -","- C8 H9 N3 O5 -","- C48 H54 N18 O30 -","6","1","","Poje, Nevenka; Poje, Mirko; Vicković, Ivan","Crystal structure of (S)-1-oxa-3,6,8-triaza-3,6,8-trimethylspiro- [4.4]nonane-2,4,7,9-tetraone, C~8~H~9~N~3~O~5~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","533","534","","","","","","","","0.0356","","","","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101592","11.221","0.001","11.261","0.001","13.165","0.002","90","","90","","90","","1663.5","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 O3 Si -","- C17 H22 O3 Si -","- C68 H88 O12 Si4 -","4","1","","Tinant, Bernard; Declercq, Jean-Paul; Demaret, Christian; Adam, Jean-Michel; Ghosez, Leon","Crystal structure of (1R,2S,3R,5S)-2-(dimethylphenylsilyl)-6-oxobicyclo [3.2.0]hept-3-yl acetate, C~17~H~22~O~3~Si","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","577","578","","","","","","","","0.0354","","","","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101593","8.8039","0.0005","9.6444","0.0004","11.3739","0.0006","78.47","0.003","77.976","0.002","76.058","0.002","905.2","0.1","298","","","","","","","","","","","5","P -1","-P 1","2","","","","- C18 H12 Cl2 Fe N5 -","- C18 H12 Cl2 Fe N5 -","- C36 H24 Cl4 Fe2 N10 -","2","1","","Balogh-Hergovich, Éva; Speier, Gábor; Tapodi, Beáta; Réglier, Marius; Giorgi, Michel","Crystal structure of 1,3-bis(2'-pyridylimino)isoindolinato(dichloro) iron(III), Fe(C~18~H~12~N~5~)Cl~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","579","580","","","","","","","","0.032","","","0.049","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101594","5.0756","0.0006","8.9631","0.0008","13.4484","0.0007","90","","92.509","0.008","90","","611.22","0.08","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C5 H5 N5 O -","- C5 H5 N5 O -","- C20 H20 N20 O4 -","4","1","","Orgueira, H.; Haj, M. A.; Salas, J. M.; Jensen, W. P; Tiekink, E. R. T.","Crystal structure of 4,5-dihydro-7-amino-5-oxo-[1,2,4]-triazolo-[1, 5-a]pyrimidine, C~5~H~5~N~5~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","517","518","10.1515/ncrs-1999-0459","","","","","","","0.036","","","0.055","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101595","9.405","0.003","14.531","0.003","10.578","0.004","90","","110.24","0.03","90","","1356.4","0.7","293","","293","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H32 N2 O P2 -","- C30 H32 N2 O P2 -","- C60 H64 N4 O2 P4 -","2","1","","Robert, Frédéric; Gimbert, Yves; Averbuch, Marie-Thérèse; Durif, André; Greene, Andrew","Crystal structure of (S)-1-[bis(diphenylphosphino)amino]-2-(methoxymethyl) pyrrolidine, C~30~H~32~N~2~OP~2~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","581","582","10.1515/ncrs-1999-0490","","","","","","","0.0409","","","0.0287","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101596","13.849","0.004","9.533","0.003","20.026","0.005","90","","101.56","0.02","90","","2590.3","1.3","193","2","193","2","","","","","","","","5","P 1 2/n 1","-P 2yac","13","","","","- C56 H40 N4 P2 Se4 -","- C56 H40 N4 P2 Se4 -","- C112 H80 N8 P4 Se8 -","2","0.5","","Czado, Wolfgang; Müller, Ulrich","Crystal structure of bis-tetraphenylphosphonium 1,2,5,6-tetracyano- 3,4-diselena-hexadiene-1,6-diselenolate, [P(C~6~H~5~)~4~]~2~[Se~4~C~4~(CN)~4~]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","507","508","","","","","","","","0.0696","","","0.1311","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101597","5.557","0.005","10.149","0.007","28.597","0.003","90","","93.32","0.03","90","","1610","1","153","","153","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H20 O4 -","- C20 H20 O4 -","- C80 H80 O16 -","4","1","","Avery, T. D.; Jensen, W. P.; Taylor, D. K.; Tiekink, E. R. T.","Crystal structure of trans-3-[4-(2-oxo-2-phenylethyl)-1,3-dioxolan- 2-yl]-1-phenyl-1-propanone, C~20~H~20~O~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","519","520","","","","","","","","0.044","","","0.053","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101598","14.528","0.002","11.4681","0.0009","9.503","0.002","90","","95.94","0.01","90","","1574.7","0.3","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H24 N2 O3 -","- C16 H24 N2 O3 -","- C64 H96 N8 O12 -","4","1","","Crisp, G. T.; Jensen, W. P.; Tiekink, E. R. T.; Turner, P. D.","Crystal structure of 2,6-di(morpholinomethyl)phenol, C~16~H~24~N~2~O~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","521","522","","","","","","","","0.039","","","0.044","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101599","14.607","0.003","4.518","0.0009","18.634","0.004","90","","90","","90","","1229.7","0.4","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- Ge20 Li2.1 Mg17.9 Sr12 -","- Ge20 Li2.08 Mg17.92 Sr12 -","- Ge20 Li2.08 Mg17.92 Sr12 -","1","0.125","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of dodecastrontium octadecamagnesium dilithium eicosagermanide, Sr~12~Mg~17.9~Li~2.1~Ge~20~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","411","412","","","","","","","","0.037","","","0.0996","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101600","8.107","0.006","8.107","0.006","15.8","0.01","90","","90","","90","","1038","1","298","2","298","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","","","- Ge1.3 Si1.7 Sr5 -","- Ge1.299 Si1.701 Sr5 -","- Ge5.196 Si6.804 Sr20 -","4","0.125","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of two pentastrontium trisilicidogermanides, Sr~5~Si~1.7~Ge~1.3~ and Sr~5~Si~2.87~Ge~0.13~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","413","414","","","","","","","","0.0263","","","0.0593","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101601","8.079","0.006","8.079","0.006","15.72","0.01","90","","90","","90","","1026","1","298","2","298","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","","","- Ge0.13 Si2.87 Sr5 -","- Ge0.126 Si2.874 Sr5 -","- Ge0.504 Si11.496 Sr20 -","4","0.125","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of two pentastrontium trisilicidogermanides, Sr~5~Si~1.7~Ge~1.3~ and Sr~5~Si~2.87~Ge~0.13~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","413","414","","","","","","","","0.0263","","","0.0692","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101602","4.727","0.003","11.131","0.008","3.989","0.003","90","","90","","90","","209.8","0.3","298","2","298","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Ca0.3 Si Sr0.7 -","- Ca0.304 Si Sr0.696 -","- Ca1.216 Si4 Sr2.784 -","4","0.25","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of two strontium calcium monosilicides, Sr~0.7~Ca~0.3~Si and Sr~0.19~Ca~0.81~Si","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","415","416","","","","","","","","0.0218","","","0.0534","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101603","4.614","0.002","10.865","0.005","3.924","0.002","90","","90","","90","","196.7","0.2","298","2","298","2","","","","","","","","3","C m c m","-C 2c 2","63","","","","- Ca0.81 Si Sr0.19 -","- Ca0.807 Si Sr0.193 -","- Ca3.228 Si4 Sr0.772 -","4","0.25","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of two strontium calcium monosilicides, Sr~0.7~Ca~0.3~Si and Sr~0.19~Ca~0.81~Si","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","415","416","","","","","","","","0.0125","","","0.0305","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101605","11.802","0.008","12.147","0.009","11.966","0.008","90","","90","","90","","1715","2","298","2","298","2","","","","","","","","3","C m m m","-C 2 2","65","","","","- Ba2.82 Ca0.18 Ge4 -","- Ba2.817 Ca0.183 Ge4 -","- Ba22.536 Ca1.464 Ge32 -","8","0.5","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of two tri(barium, calcium) tetragermanides, Ba~2.82~Ca~0.18~Ge~4~ and Ba~2.89~Ca~0.11~Ge~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","417","418","","","","","","","","0.0465","","","0.1171","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101606","11.7838","0.0002","12.1818","0.0002","12.0605","0.0001","90","","90","","90","","1731.26","0.04","298","2","298","2","","","","","","","","3","C m m m","-C 2 2","65","","","","- Ba2.89 Ca0.11 Ge4 -","- Ba2.894 Ca0.106 Ge4 -","- Ba23.152 Ca0.848 Ge32 -","8","0.5","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of two tri(barium, calcium) tetragermanides, Ba~2.82~Ca~0.18~Ge~4~ and Ba~2.89~Ca~0.11~Ge~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","417","418","","","","","","","","0.0339","","","0.0714","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101607","11.773","0.008","12.126","0.008","11.95","0.008","90","","90","","90","","1706","2","298","2","298","2","","","","","","","","3","C m m m","-C 2 2","65","","","","- Ba2.62 Ge4 Sr0.38 -","- Ba2.625 Ge4 Sr0.375 -","- Ba21 Ge32 Sr3 -","8","0.5","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of tri(barium, strontium) tetragermanide, Ba~2.62~Sr~0.38~Ge~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","419","420","","","","","","","","0.0266","","","0.0704","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101608","8.536","0.004","8.536","0.004","11.804","0.006","90","","90","","90","","860.1","0.7","298","2","298","2","","","","","","","","3","P 42/m n m","-P 4n 2n","136","","","","- Ba2.37 Ge4 Sr0.63 -","- Ba2.368 Ge4 Sr0.632 -","- Ba9.472 Ge16 Sr2.528 -","4","0.25","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of tri(barium, strontium) tetragermanide, Ba~2.37~Sr~0.63~Ge~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","421","422","","","","","","","","0.0226","","","0.0545","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101609","8.01","0.006","8.01","0.006","15.73","0.01","90","","90","","90","","1009","1","298","2","298","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","","","- Ca0.38 Si3 Sr4.62 -","- Ca0.377 Si3 Sr4.623 -","- Ca1.508 Si12 Sr18.492 -","4","0.125","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of five penta(strontium, calcium) trisilicides, Sr~4.62~Ca~0.38~Si~3~, Sr~4.52~Ca~0.48~Si~3~, Sr~3.19~Ca~1.81~Si~3~, Sr~2.12~Ca~2.88~Si~3~, and Sr~0.52~Ca~4.48~Si~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","423","426","","","","","","","","0.0275","","","0.0522","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101610","7.983","0.006","7.983","0.006","15.7","0.01","90","","90","","90","","1001","1","298","2","298","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","","","- Ca0.48 Si3 Sr4.52 -","- Ca0.48 Si3 Sr4.52 -","- Ca1.92 Si12 Sr18.08 -","4","0.125","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of five penta(strontium, calcium) trisilicides, Sr~4.62~Ca~0.38~Si~3~, Sr~4.52~Ca~0.48~Si~3~, Sr~3.19~Ca~1.81~Si~3~, Sr~2.12~Ca~2.88~Si~3~, and Sr~0.52~Ca~4.48~Si~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","423","426","","","","","","","","0.0249","","","0.0475","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101611","7.885","0.006","7.885","0.006","15.52","0.01","90","","90","","90","","965","1","298","2","298","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","","","- Ca1.81 Si3 Sr3.19 -","- Ca1.794 Si3 Sr3.206 -","- Ca7.176 Si12 Sr12.824 -","4","0.125","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of five penta(strontium, calcium) trisilicides, Sr~4.62~Ca~0.38~Si~3~, Sr~4.52~Ca~0.48~Si~3~, Sr~3.19~Ca~1.81~Si~3~, Sr~2.12~Ca~2.88~Si~3~, and Sr~0.52~Ca~4.48~Si~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","423","426","","","","","","","","0.021","","","0.0395","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101612","7.786","0.006","7.786","0.006","15.37","0.01","90","","90","","90","","932","1","298","2","298","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","","","- Ca2.88 Si3 Sr2.12 -","- Ca2.884 Si3 Sr2.116 -","- Ca11.536 Si12 Sr8.464 -","4","0.125","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of five penta(strontium, calcium) trisilicides, Sr~4.62~Ca~0.38~Si~3~, Sr~4.52~Ca~0.48~Si~3~, Sr~3.19~Ca~1.81~Si~3~, Sr~2.12~Ca~2.88~Si~3~, and Sr~0.52~Ca~4.48~Si~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","423","426","","","","","","","","0.0199","","","0.0446","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101613","7.661","0.005","7.661","0.005","14.97","0.01","90","","90","","90","","879","1","298","2","298","2","","","","","","","","3","I 4/m c m","-I 4 2c","140","","","","- Ca4.48 Si3 Sr0.52 -","- Ca4.464 Si3 Sr0.536 -","- Ca17.856 Si12 Sr2.144 -","4","0.125","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of five penta(strontium, calcium) trisilicides, Sr~4.62~Ca~0.38~Si~3~, Sr~4.52~Ca~0.48~Si~3~, Sr~3.19~Ca~1.81~Si~3~, Sr~2.12~Ca~2.88~Si~3~, and Sr~0.52~Ca~4.48~Si~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","423","426","","","","","","","","0.0479","","","0.0782","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101614","8.099","0.006","4.968","0.003","9.22","0.006","90","","90","","90","","370.97","0.12","298","2","298","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Ca0.75 Si Sr1.25 -","- Ca0.752 Si Sr1.248 -","- Ca3.008 Si4 Sr4.992 -","4","0.5","","Zürcher, Fabio; Nesper, Reinhard","Crystal structure of di(strontium, calcium) monosilicide, Sr~1.25~Ca~0.75~Si","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","427","427","","","","","","","","0.0236","","","0.048","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101615","8.01978","0.00019","8.01978","0.00019","5.29905","0.00014","90","","90","","90","","340.82","0.01","295","2","295","2","","","","","","","","4","I 4/m c m","-I 4 2c","140","SrPrGa3O7","","","- Ga6 O14 Pr2 Sr2 -","- Ga10 O28 Pr4 Sr4 -","- Ga20 O56 Pr8 Sr8 -","2","0.0625","","Gesing, Thorsten M.; Uecker, Reinhard; Buhl, J.-C.","Crystal structure of strontium praseodym trigallium heptaoxide, (Sr~0.5~Pr~0.5~)~2~Ga~3~O~7~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","429","429","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101616","6.84407","0.00019","6.84407","0.00019","11.25338","0.00035","90","","90","","90","","527.12","0.03","295","2","295","2","","","","","","","","4","I 4/m c m","-I 4 2c","140","Sr2PrGaO5","","","- Ga4 O20 Pr4 Sr8 -","- Ga O5 Pr Sr2 -","- Ga4 O20 Pr4 Sr8 -","4","0.125","","Gesing, Thorsten M.; Uecker, Reinhard; Buhl, J.-C.","Crystal structure of distrontium praseodym gallium pentaoxide, Sr~2~PrGaO~5~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","430","430","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101617","7.82559","0.00042","11.03223","0.00053","11.49591","0.00065","90","","109.187","0.0033","90","","937.35","0.09","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Pr4Ga2O9","","","- Ga8 O36 Pr16 -","- Ga2 O9 Pr4 -","- Ga8 O36 Pr16 -","4","1","","Gesing, Thorsten M.; Uecker, Reinhard; Buhl, J.-C.","Crystal structure of praseodym gallate, Pr~4~Ga~2~O~9~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","431","431","","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101618","3.736","0.001","3.736","0.001","12.532","0.003","90","","90","","90","","174.92","0.08","293","2","293","2","","","","","","","","4","I 4/m m m","-I 4 2","139","strontium praseodym aluminate","","","- Al O4 Pr Sr -","- Al O4 Pr Sr -","- Al2 O8 Pr2 Sr2 -","2","0.0625","","Gesing, Thorsten M.; Uecker, Reinhard; Buhl, J.-C.","Crystal structure of strontium praseodym aluminate, SrPrAlO~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","432","432","","","","","","","","0.0104","","","0.0207","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101619","8.5657","0.0009","8.5657","0.0009","8.463","0.002","90","","90","","120","","537.7","0.1","297","","","","","","","","","","","4","P 3 2 1","P 3 2""","150","","","","- Al2 B2 K2 O7 -","- Al2 B2 K2 O7 -","- Al6 B6 K6 O21 -","3","0.5","","Hu, Zhang-Gui; Higashiyama, T.; Yoshimura, M.; Mori, Y.; Sasaki, T.","Redetermination of the crystal structure of dipotassium dialuminum borate, K~2~Al~2~B~2~O~7~, a new non-linear optical material","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","433","434","10.1515/ncrs-1999-0415","","","","","","","0.018","","","0.06","","","","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8101620","20.8276","0.0004","20.8276","0.0004","20.8276","0.0004","90","","90","","90","","9034.8","0.3","100","2","100","2","","","","","","","","5","F d -3 m :2","-F 4vw 2vw 3","227","","","","- Br16 H36 O18 Ta6 Zn -","- Br16 O18 Ta6 Zn -","- Br128 O144 Ta48 Zn8 -","8","0.0416667","","Vojnović, Marija; Bašic, Ivan; Brničević, Nevenka","Crystal structure of dodeca-<i>μ-bromo-hexaaqua-1<i>κO </i>,2<i>κO</i>,3<i>κO</i>,4<i>κO</i>,5<i>κO </i>,6<i>κO</i>-octahedro-hexatantalum tetrabromozinkate dodecahydrate, [Ta~6~Br~12~(H~2~O)~6~][ZnBr~4~] · 12H~2~O","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","435","436","","","","","","","","0.0364","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101621","6.72","0.001","13.389","0.003","6.52","0.001","90","","90","","90","","586.63","0.18","293","2","293","2","","","","","","","","2","P b c m","-P 2c 2b","57","hexapotassium pentaplumbide","","","- K8 Pb6.67 -","- K8 Pb6.68 -","- K8 Pb6.68 -","1","0.125","","Fässler, Thomas F.; Kronseder, Christian","Crystal structure of hexapotassium pentaplumbide, K~6~Pb~5~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","437","437","","","","","","","","0.0383","","","0.103","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101622","10.497","0.002","7.993","0.002","9.077","0.002","90","","117.26","0.03","90","","677","0.3","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- Al B H3 Na O10 P2 -","- Al B H3 Na O10 P2 -","- Al4 B4 H12 Na4 O40 P8 -","4","0.5","","Koch, Dunja; Kniep, Rüdiger","Crystal structure of sodium aluminum (monohydrogenmonophosphate- dihydrogenmonoborate-monophosphate), NaAl[BP~2~O~7~(OH)~3~]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","441","442","","","","","","","","0.0494","","","0.0771","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101623","6.815","0.001","6.815","0.001","6.815","0.001","90","","90","","90","","316.52","0.08","293","2","293","2","","","","","","","","2","F m -3 m","-F 4 2 3","225","dimagnesium plumbide","","","- Mg8 Pb4 -","- Mg8 Pb4 -","- Mg8 Pb4 -","1","0.00520833","","Fässler, Thomas F.; Kronseder, Christian","Refinement of the crystal structure of dimagnesium plumbide, Mg~2~Pb","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","438","438","","","","","","","","0.0143","","","0.0402","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101624","6.761","0.001","4.126","0.001","7.893","0.002","90","","90","","90","","220.18","0.08","293","2","293","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- Al Rh Yb -","- Al Rh Yb -","- Al4 Rh4 Yb4 -","4","0.5","","Cardoso Gil, Raul H.; Trovarelli, Octavio; Geibel, Christoph; Grin, Yuri","Crystal structure of ytterbium-rhodium-aluminium [1:1:1], YbRhAl","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","459","459","","","","","","","","0.0164","","","0.0355","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8101625","16.6","0.01","11.078","0.006","5.238","0.001","90","","90","","90","","963.2","0.8","293","2","293","2","","","","","","","","3","P b a n :2","-P 2ab 2b","50","","","","- O3 Te Tl2 -","- O3 Te Tl2 -","- O24 Te8 Tl16 -","8","1","","Frit, Bernard; Mercurio, Danièle; Thomas, Philippe; Champarnaud-Mesjard, Jean-Claude","Refinement of the crystal structure of dithallium(I) trioxotellurate (IV), Tl~2~TeO~3~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","439","440","","","","","","","","0.0473","","","0.0903","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101626","9.074","0.003","9.074","0.003","3.592","0.004","90","","90","","120","","256.1","0.5","","","295","","","","","","","","","3","P -6","P -6","174","","","","- Ni12 P7 Sc2 -","- Ni12 P7 Sc2 -","- Ni12 P7 Sc2 -","1","0.166667","","Oryshchyn, S.; Babizhetsky, V.; Stojko, S.; Kuzma, Yu.","Crystal structure of discandium dodecanickel heptaphosphide, Sc~2~Ni~12~P~7~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","428","428","","","","","","","","0.0266","","","0.0309","","","","","","","","","","","has coordinates","191974","2020-10-21","18:00:00",""
"8101627","9.351","0.002","8.631","0.004","9.763","0.002","90","","102.58","0.02","90","","769","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- B Cs Fe H O9 P2 -","- B Cs Fe H O9 P2 -","- B4 Cs4 Fe4 H4 O36 P8 -","4","1","","Engelhardt, Holger; Kniep, Rüdiger","Crystal structure of caesium iron(III) catena-[monohydrogenmonoborate- bis(monophosphate)], CsFe[BP~2~O~8~(OH)]","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","443","444","","","","","","","","0.0238","","","0.0829","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101628","10.475","0.001","10.475","0.001","17.412","0.002","90","","90","","90","","1910.5","0.6","","","295","","","","","","","","","2","I 41/a c d :2","-I 4bd 2c","142","sodium stannide","","","- Na4 Sn4 -","- Na4 Sn4 -","- Na32 Sn32 -","8","0.25","","Baitinger, M.; von Schnering, H. G.; Grin, Yu.; Kniep, R.","Redetermination of the crystal structure of tetrasodium tetrahedro- tetrastannide, Na~4~Sn~4~ and tetrapotassium tetrahedro-tetrastannide, K~4~Sn~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","453","454","","","","","","","","0.058","","","0.058","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101629","11.409","0.001","11.409","0.001","18.649","0.002","90","","90","","90","","2427.5","0.7","","","295","","","","","","","","","2","I 41/a c d :2","-I 4bd 2c","142","potassium stannide","","","- K4 Sn4 -","- K4 Sn4 -","- K32 Sn32 -","8","0.25","","Baitinger, M.; von Schnering, H. G.; Grin, Yu.; Kniep, R.","Redetermination of the crystal structure of tetrasodium tetrahedro- tetrastannide, Na~4~Sn~4~ and tetrapotassium tetrahedro-tetrastannide, K~4~Sn~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","453","454","","","","","","","","0.036","","","0.036","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101630","11.892","0.001","11.892","0.001","19.429","0.002","90","","90","","90","","2747.6","0.8","","","295","","","","","","","","","2","I 41/a c d :2","-I 4bd 2c","142","Rubidium plumbide","","","- Pb4 Rb4 -","- Pb4 Rb4 -","- Pb32 Rb32 -","8","0.25","","Baitinger, M.; Peters, K.; Somer, M.; von Schnering, H. G.; Carillo-Cabrera, W.; Grin, Yu.; Kniep, R.","Crystal structure of tetrarubidium tetrahedro-tetraplumbide, Rb~4~Pb~4~ and of tetracaesium tetrahedro-tetraplumbide, Cs~4~Pb~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","455","456","","","","","","","","0.0375","","","0.0375","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101631","11.757","0.001","11.757","0.001","19.215","0.002","90","","90","","90","","2656","0.7","","","295","","","","","","","","","2","I 41/a c d :2","-I 4bd 2c","142","rubidium stannide","","","- Rb16 Sn16 -","- Rb16 Sn16 -","- Rb32 Sn32 -","2","0.0625","","Baitinger, M.; Grin, Yu.; von Schnering, H. G.; Kniep, R.","Crystal structure of tetrarubidium tetrahedro-tetrastannide, Rb~4~Sn~4~ and of tetracaesium tetrahedro-tetrastannide, Cs~4~Sn~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","457","458","","","","","","","","0.0532","","","0.0532","","","","","","","","","","","has coordinates","301880","2025-08-22","23:45:45",""
"8101632","12.122","0.001","12.122","0.001","19.82","0.002","90","","90","","90","","2912.4","0.8","295","","295","","","","","","","","","2","I 41/a c d :2","-I 4bd 2c","142","Caesium stannide","","","- Cs16 Sn16 -","- Cs4 Sn4 -","- Cs32 Sn32 -","8","0.25","","Baitinger, M.; Grin, Yu.; von Schnering, H. G.; Kniep, R.","Crystal structure of tetrarubidium tetrahedro-tetrastannide, Rb~4~Sn~4~ and of tetracaesium tetrahedro-tetrastannide, Cs~4~Sn~4~","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","457","458","","","","","","","","0.0671","","","0.0671","","","","","","","","","","","has coordinates","191974","2020-10-21","18:00:00",""
"8101633","3.7637","0.0003","3.7637","0.0004","26.168","0.003","90","0.007","90","0.008","90","0.09","370.68","0.06","293","2","293","2","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","","","- Ca Fe0.61 Li3.39 N2 -","- Ca Fe0.604 Li3.396 N2 -","- Ca4 Fe2.416 Li13.584 N8 -","4","0.125","","Klatyk, Jens; Kniep, Rüdiger","Crystal structure of alkaline earth dilithium bis(nitridolithiate/ferrates (I)), Ca{Li~2~[(Li~1-x~Fe~x~)N]~2~}, x = 0.30 and Sr{Li~2~[(Li~1-x~Fe~x~N)] ~2~}, x = 0.46","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","449","450","","","","","","","","0.0184","","","0.0496","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8101634","3.7909","0.0002","3.7909","0.0004","27.719","0.003","90","0.012","90","0.01","90","0.012","398.35","0.07","293","2","293","2","","","","","","","","4","I 41/a m d :2","-I 4bd 2","141","","","","- Fe0.93 Li3.08 N2 Sr -","- Fe0.924 Li3.08 N2 Sr -","- Fe3.696 Li12.32 N8 Sr4 -","4","0.125","","Klatyk, Jens; Kniep, Rüdiger","Crystal structure of alkaline earth dilithium bis(nitridolithiate/ferrates (I)), Ca{Li~2~[(Li~1-x~Fe~x~)N]~2~}, x = 0.30 and Sr{Li~2~[(Li~1-x~Fe~x~N)] ~2~}, x = 0.46","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","449","450","","","","","","","","","","","","","","","","","","","","","","has coordinates","176728","2020-10-21","18:00:00",""
"8101635","3.724","0.002","3.724","0.002","3.6297","0.001","90","","90","","120","","43.6","0.04","293","2","293","2","","","","","","","","3","P 6/m m m","-P 6 2","191","","","","- Fe0.63 Li2.37 N -","- Fe0.631 Li2.37 N -","- Fe0.631 Li2.37 N -","1","0.0416667","","Klatyk, Jens; Kniep, Rüdiger","Crystal structure of dilithium (nitridolithiate/ferrate(I)), Li~2~ [(Li~1-x~Fe~x~)N], x = 0.63","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","447","448","10.1515/ncrs-1999-0423","","","","","","","0.0297","","","0.0725","","","","","","","","","","","has coordinates","209438","2020-10-21","18:00:00",""
"8101636","5.3559","0.0008","5.3559","0.0008","6.6778","0.0012","90","","90","","90","","191.56","0.05","293","2","293","2","","","","","","","","4","P 42/m n m","-P 4n 2n","136","","","","- Ca4 Fe0.82 Li1.18 N2 -","- Ca2 Fe0.8207 Li1.18 N2 -","- Ca4 Fe1.6414 Li2.36 N4 -","2","0.125","","Klatyk, Jens; Kniep, Rüdiger","Crystal structure of dicalcium (dinitridolithiate/ferrate(I)), Ca~2~{Li[(Li~1-x~Fe~x~)N~2~]}, x = 0.82","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","451","452","10.1515/ncrs-1999-0425","","","","","","","0.0313","","","0.0673","","","","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8101637","3.7263","0.0004","3.7263","0.0004","3.8281","0.0004","90","","90","","120","","46.033","0.008","293","2","293","2","","","","","","","","3","P 6/m m m","-P 6 2","191","","","","- Li2.27 Mn0.73 N -","- Li2.27 Mn0.731 N -","- Li2.27 Mn0.731 N -","1","0.0416667","","Klatyk, Jens; Kniep, Rüdiger","Crystal structure of dilithium (nitridolithiate/manganate(I)), Li~2~[(Li~1-x~Mn~x~)N], x = 0.73","Zeitschrift für Kristallographie - New Crystal Structures","1999","214","4","445","446","10.1515/ncrs-1999-0422","","","","","","","0.0249","","","0.0629","","","","","","","","","","","has coordinates","209540","2020-10-21","18:00:00",""
"8103429","4.397","","7.023","","7.572","","90","","90","","90","","233.824","","","","","","","","","","","","","3","I m m 2","I 2 -2","44","","Yb Au Si","","- Au Si Yb -","- Au Si Yb -","- Au4 Si4 Yb4 -","4","0.5","","Pani, M.; Fornasini, M.L.; Merlo, F.","New phases in the Yb - Au - Si and Ca - Au - Si systems","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","108","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103431","4.163","","4.163","","4.009","","90","","90","","120","","60.17","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Yb Au0.63 Si1.37","","- Au0.63 Si1.37 Yb -","- Au0.628 Si1.372 Yb -","- Au0.628 Si1.372 Yb -","1","0.0416667","","Merlo, F.; Pani, M.; Fornasini, M.L.","New phases in the Yb - Au - Si and Ca - Au - Si systems","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","108","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103432","4.454","","7.139","","7.667","","90","","90","","90","","243.788","","","","","","","","","","","","","3","I m m 2","I 2 -2","44","","Ca Au1.208 Si0.792","","- Au1.208 Ca Si0.792 -","- Au1.208 Ca Si0.792 -","- Au4.832 Ca4 Si3.168 -","4","0.5","","Fornasini, M.L.; Merlo, F.; Pani, M.","New phases in the Yb - Au - Si and Ca - Au - Si systems","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","108","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103433","4.431","","7.018","","7.631","","90","","90","","90","","237.299","","","","","","","","","","","","","3","I m m a","-I 2b 2","74","","Yb Au1.254 Si0.746","","- Au1.254 Si0.746 Yb -","- Au1.254 Si0.746 Yb -","- Au5.016 Si2.984 Yb4 -","4","0.25","","Merlo, F.; Fornasini, M.L.; Pani, M.","New phases in the Yb - Au - Si and Ca - Au - Si systems","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","108","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103434","4.151","","4.151","","4.28","","90","","90","","120","","63.867","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Ca Au0.64 Si1.36","","- Au0.64 Ca Si1.36 -","- Au0.644 Ca Si1.356 -","- Au0.644 Ca Si1.356 -","1","0.0416667","","Pani, M.; Merlo, F.; Fornasini, M.L.","New phases in the Yb - Au - Si and Ca - Au - Si systems","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","108","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103437","4.182","","4.182","","3.962","","90","","90","","120","","60.009","","","","","","","","","","","","","3","P 6/m m m","-P 6 2","191","","Yb Au0.88 Si1.12","","- Au0.88 Si1.12 Yb -","- Au0.884 Si1.116 Yb -","- Au0.884 Si1.116 Yb -","1","0.0416667","","Fornasini, M.L.; Merlo, F.; Pani, M.","New phases in the Yb - Au - Si and Ca - Au - Si systems","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","108","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","176466","2020-10-21","18:00:00",""
"8103502","13.2088","","13.2088","","5.2771","","90","","90","","90","","920.708","","","","","","","","","","","","","5","I 4/m","-I 4","87","","(Al6.57 Mg0.94 H0.87 (P O4)7.5 (H2 O)2.17) ((C3 H7)2 N H)2.193","","- C13.16 Al6.5728 Mg0.9392 O32.168 P7.504 -","- C13.16 Al6.5728 Mg0.9392 O32.168 P7.504 -","- C13.16 Al6.5728 Mg0.9392 O32.168 P7.504 -","1","0.0625","","Baur, W.H.; Bieniok, A.; Joswig, W.; Kassner, D.; Finger, G.; Kornatowski, J.","The crystal structure of the microporous solid MAPO-39 (ATN) refined from single crystal diffraction data","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","154","159","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103503","7.615","","5.152","","10.741","","90","","109.29","","90","","397.738","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Na2 Mn F5","","- F5 Mn Na2 -","- F5 Mn Na2 -","- F20 Mn4 Na8 -","4","1","","Carlson, S.; Norrestam, R.; Xu, Y.","Single crystal X-ray diffraction studies of Na2 Mn F5 at high hydrostatic pressures","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","259","263","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103506","24.182","","8.1656","","36.362","","90","","91.21","","90","","7178.46","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Bi11 Se12 Cl9","","- Bi11 Cl9 Se12 -","- Bi11 Cl9 Se12 -","- Bi88 Cl72 Se96 -","8","1","","Eggenweiler, U.; Keller, E.; Kramer, V.; Oppermann, H.; Petasch, U.","On the crystal structure of Bi11 Se12 Cl9","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","264","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","140561","2020-10-21","18:00:00",""
"8103507","11.828","","11.828","","11.828","","90","","90","","90","","1654.76","","","","","","","","","","","","","5","I a -3 d","-I 4bd 2c 3","230","","(Ca0.9 Mg0.1)3 Al2 (Si O4)3","","- Al2 Ca2.7 Mg0.3 O12 Si3 -","- Al2 Ca2.7 Mg0.3 O12 Si3 -","- Al16 Ca21.6 Mg2.4 O96 Si24 -","8","0.0833333","","Geiger, C.A.; Armbruster, T.","The crystal structure of a garnet solid solution (Ca0.9 Mg0.1)3 Al2(Si O4)3 at 295 K and 100 K: local site behaviour - dynamic and static disorder","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","211","215","","","","","","","","","","","","","","","","","","","","","","has coordinates","140687","2020-10-21","18:00:00",""
"8103508","8.409","","7.508","","10.511","","90","","111.77","","90","","616.281","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Cu2 (Se O3)2 (H2 O)","","- Cu2 H2 O7 Se2 -","- Cu2 H2 O7 Se2 -","- Cu8 H8 O28 Se8 -","4","1","","Giester, G.","New copper selenites. Part B: Cu2 (Se O3)2 . (H2 O) and Tl(III)2 Cu3 (Se O3)6","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","305","308","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103509","4.803","","9.605","","9.934","","67.05","","81.41","","77.96","","411.546","","","","","","","","","","","","","4","P -1","-P 1","2","","Tl2 Cu3 (Se O3)6","","- Cu3 O18 Se6 Tl2 -","- Cu3 O18 Se6 Tl2 -","- Cu3 O18 Se6 Tl2 -","1","0.5","","Giester, G.","New copper selenites. Part B: Cu2 (Se O3)2 . (H2 O) and Tl(III)2 Cu3 (Se O3)6","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","305","308","","","","","","","","","","","","","","","","","","","","","","has coordinates","140712","2020-10-21","18:00:00",""
"8103510","3.744","","5.7647","","11.2912","","90","","90","","90","","243.698","","","","","","","","","","","","","5","I m m m","-I 2 2","71","","(Y1.74 Ca0.26) Ba Ni O5","","- Ba Ca0.26 Ni O5 Y1.74 -","- Ba Ca0.26 Ni O5 Y1.74 -","- Ba2 Ca0.52 Ni2 O10 Y3.48 -","2","0.125","","Massarotti, V.; Capsoni, D.; Bini, M.; Altomare, A.; Moliterni, A.G.G.","Ab initio structural approach on polycrystalline Y2-x Cax Ba Ni O5 (0<x<0.33) compounds","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","205","210","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103511","14.153","","14.153","","60.72","","90","","90","","120","","10533.2","","","","","","","","","","","","","13","R 3 m :H","R 3 -2""","160","","Zr3.63 Ti3.51 Ca8.5 Mn2.13 Si2.68 Al0.42 Fe0.93 Na34.43 Sr0.77 Ce1.13 (Si3 O9)4 (Si9 O27)4 Cl (O H)6.84 (H2 O)1.5","","- Al0.42 Ca8.5 Ce1.13 Cl Fe0.93 H9.84 Mn2.13 Na34.43 O152.34 Si50.68 Sr0.77 Ti3.51 Zr3.63 -","- Al0.42 Ca8.502 Ce1.134 Cl Fe0.93 Mn2.13 Na34.431 O152.349 Si50.68 Sr0.768 Ti3.51 Zr3.63 -","- Al1.26 Ca25.506 Ce3.402 Cl3 Fe2.79 Mn6.39 Na103.293 O457.047 Si152.04 Sr2.304 Ti10.53 Zr10.89 -","3","0.166667","","Rastsvetaeva, R.K.; Khomyakov, A.P.; Chapuis, G.","Crystal structure and crystal-chemical features of a new Ti-rich member of the eudialyte family","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","271","278","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103512","10.594","","3.019","","10.299","","90","","88.98","","90","","329.344","","","","","","","","","","","","","4","I 1 2/m 1","-I 2y","12","","Fe O (O H) Cl0.227","","- Cl0.227 Fe H O2 -","- Cl0.2275 Fe O2 -","- Cl1.82 Fe8 O16 -","8","1","","Kilcoyne, S.H.; Lawrence, J.L.","The structure of iron dextran cores","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","666","669","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103513","4.583","","4.583","","5.189","","90","","90","","120","","94.387","","","","","","","","","","","","","2","P 31 2 1","P 31 2""","152","","Si O2","","- O2 Si -","- O2 Si -","- O6 Si3 -","3","0.5","","Kim-Zajonz, J.; Werner, S.; Schulz, H.","High pressure single crystal X-ray diffraction study on alpha-quartz","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","324","330","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103514","4.649","","4.649","","12.687","","90","","90","","120","","237.47","","","","","","","","","","","","","2","R -3 c :H","-R 3 2""c","167","","","","- Al2 O3 -","- Al2 O3 -","- Al12 O18 -","6","0.166667","","Kim-Zajonz, J.; Werner, S.; Schulz, H.","High pressure single crystal X-ray diffraction study on ruby up to 31 GPa","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","331","336","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8103515","24.43","","6.732","","5.442","","90","","90","","90","","895.006","","","","","","","","","","","","","3","P n a 21","P 2c -2n","33","","(Mo3.397 Re0.603) O11","","- Mo3.397 O11 Re0.603 -","- Mo3.397 O11 Re0.603 -","- Mo13.588 O44 Re2.412 -","4","1","","Weber, T.; Feller, J.; Oppermann, H.; Paufler, P.","On the exchange of molybdenum by rhenium in gamma-(Mo4-x Rex O11)","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","98","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","141191","2020-10-21","18:00:00",""
"8103516","8.095","","9.236","","7.781","","90","","115.76","","90","","523.937","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Li2 Co3 (Se O3)4","","- Co3 Li2 O12 Se4 -","- Co3 Li2 O12 Se4 -","- Co6 Li4 O24 Se8 -","2","0.5","","Wildner, M.; Andrut, M.","Crystal structure, electronic absorption spectra, and crystal field superposition model analysis of Li2 Co3 (Se O3)4","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","216","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","141193","2020-10-21","18:00:00",""
"8103517","7.9223","","7.9375","","10.7155","","90","","90","","90","","673.826","","","","","","","","","","","","","2","P c n b","-P 2b 2ac","60","","Th2 Se5","","- Se5 Th2 -","- Se5 Th2 -","- Se20 Th8 -","4","0.5","","Kohlmann, H.; Beck, H.P.","Pseudo-symmetry in the crystal structure of An2 X5 compounds (An = Th, U, Np; X = S, Se)","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","341","345","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"8103518","8.12","","8.12","","3.05","","90","","90","","120","","174.158","","","","","","","","","","","","","4","P -6","P -6","174","","Li Na (C O3)","","- C Li Na O3 -","- C Li Na O3 -","- C3 Li3 Na3 O9 -","3","0.5","","Zhukov, S.G.; Yatsenko, A.V.; Schenk, H.; Chernyshev, V.V.; D'yakov, V.A.; le Loux, R.","X-ray high temperature powder diffraction study and computer simulation of gamma-(Li Na C O3)","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","255","258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104115","6.281","","8.061","","8.118","","90.47","","106.87","","90.97","","393.242","","","","","","","","","","","","","4","P -1","-P 1","2","","Ba (O H) I (H2 O)4","","- Ba H9 I O5 -","- Ba H9 I O5 -","- Ba2 H18 I2 O10 -","2","1","","Peter, S.; Lutz, H.D.; Jauch, M.; Reehuis, W.","Neutron single-crystal study of barium hydroxide iodide tetrahydrate, a compound with most strongly distorted hydrate H2 O molecules","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","290","295","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9001992","18.66","","10.697","","13.874","","90","","90","","90","","2769.33","","","","","","","","","","","","","6","P n c 2","P 2 -2bc","30","","","Armenite","- Al6 Ba Ca2 H4 O32.11 Si9 -","- Al6 Ba Ca2 H4 O32.11 Si9 -","- Al24 Ba4 Ca8 H16 O128.44 Si36 -","4","1","","Armbruster, T.","Si,Al ordering in the double-ring silicate armenite, BaCa2Al6Si9O30.2H2O: A single-crystal X-ray and 29Si MAS NMR study","American Mineralogist","1999","84","","92","101","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9001993","9.668","","17.916","","5.271","","90","","102.82","","90","","890.241","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Fluoro-eckermannite","- Al0.12 F2 Mg5.76 Na2.11 O22 Si8 -","- Al0.12 F2 Mg5.76 Na2.11 O22 Si8 -","- Al0.24 F4 Mg11.52 Na4.22 O44 Si16 -","2","0.25","","Oberti, R.; Hawthorne, F. C.; Camara, F.; Raudsepp, M.","Unusual M3+ cations in synthetic amphiboles with nominal fluoro-eckermannite composition: Deviations from stoichiometry and structural effects of the cummingtonite component Sample: Al, Na.98Na1.10Mg.90Mg4.88Al.12Si8O22F2","American Mineralogist","1999","84","","102","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001994","9.82","","18.036","","5.29","","90","","103.64","","90","","910.506","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Fluoro-eckermannite","- F2 Mg4 Na3.65 O22 Sc1.06 Si8 -","- F2 Mg4 Na3.65 O22 Sc1.06 Si8 -","- F4 Mg8 Na7.3 O44 Sc2.12 Si16 -","2","0.25","","Oberti, R.; Hawthorne, F. C.; Camara, F.; Raudsepp, M.","Unusual M3+ cations in synthetic amphiboles with nominal fluoro-eckermannite composition: Deviations from stoichiometry and structural effects of the cummingtonite component Sample: Sc, Na.92Na1.97Mg.03Mg3.95Sc1.05Si8O22F2","American Mineralogist","1999","84","","102","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001995","9.691","","17.93","","5.284","","90","","102.98","","90","","894.686","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Fluoro-eckermannite","- F2 Mg5.92 Na1.83 O22 Si8 Ti0.18 -","- F2 Mg5.92 Na1.83 O22 Si8 Ti0.18 -","- F4 Mg11.84 Na3.66 O44 Si16 Ti0.36 -","2","0.25","","Oberti, R.; Hawthorne, F. C.; Camara, F.; Raudsepp, M.","Unusual M3+ cations in synthetic amphiboles with nominal fluoro-eckermannite composition: Deviations from stoichiometry and structural effects of the cummingtonite component Sample: Ti, Na.85Na1.02Mg.98Mg4.83Ti.17Si8O22F2","American Mineralogist","1999","84","","102","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001996","9.655","","17.909","","5.267","","90","","102.73","","90","","888.338","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Fluoro-eckermannite","- F2 Mg6.12 Na1.81 O22 Si8 V0.02 -","- F2 Mg6.12 Na1.81 O22 Si8 V0.02 -","- F4 Mg12.24 Na3.62 O44 Si16 V0.04 -","2","0.25","","Oberti, R.; Hawthorne, F. C.; Camara, F.; Raudsepp, M.","Unusual M3+ cations in synthetic amphiboles with nominal fluoro-eckermannite composition: Deviations from stoichiometry and structural effects of the cummingtonite component Sample: V, Na.90Na.92Mg1.08Mg4.98V.02Si8O22F2","American Mineralogist","1999","84","","102","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001997","9.722","","17.813","","5.282","","90","","103.69","","90","","888.739","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Fluoro-eckermannite","- Cr0.98 F2 Mg4.12 Na2.91 O22 Si8 -","- Cr0.98 F2 Mg4.12 Na2.91 O22 Si8 -","- Cr1.96 F4 Mg8.24 Na5.82 O44 Si16 -","2","0.25","","Oberti, R.; Hawthorne, F. C.; Camara, F.; Raudsepp, M.","Unusual M3+ cations in synthetic amphiboles with nominal fluoro-eckermannite composition: Deviations from stoichiometry and structural effects of the cummingtonite component Sample: Cr1, Na1.00Na1.97Mg.03Mg4.03Cr.97Si8O22F2","American Mineralogist","1999","84","","102","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001998","9.728","","17.825","","5.278","","90","","103.66","","90","","889.326","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Fluoro-eckermannite","- Cr0.76 F2 Mg4.42 Na2.51 O22 Si8 -","- Cr0.76 F2 Mg4.42 Na2.51 O22 Si8 -","- Cr1.52 F4 Mg8.84 Na5.02 O44 Si16 -","2","0.25","","Oberti, R.; Hawthorne, F. C.; Camara, F.; Raudsepp, M.","Unusual M3+ cations in synthetic amphiboles with nominal fluoro-eckermannite composition: Deviations from stoichiometry and structural effects of the cummingtonite component Sample: Cr2, Na1.00Na1.75Mg.25Mg4.25Cr.75Si8O22F2","American Mineralogist","1999","84","","102","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9001999","9.666","","17.902","","5.272","","90","","102.84","","90","","889.459","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Fluoro-eckermannite","- F2 Ga0.14 Mg5.8 Na2.02 O22 Si8 -","- F2 Ga0.14 Mg5.8 Na2.02 O22 Si8 -","- F4 Ga0.28 Mg11.6 Na4.04 O44 Si16 -","2","0.25","","Oberti, R.; Hawthorne, F. C.; Camara, F.; Raudsepp, M.","Unusual M3+ cations in synthetic amphiboles with nominal fluoro-eckermannite composition: Deviations from stoichiometry and structural effects of the cummingtonite component Sample: Ga, Na.94Na1.07Mg.93Mg4.87Ga.13Si8O22F2","American Mineralogist","1999","84","","102","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002000","13.7295","","13.7295","","13.7036","","90","","90","","90","","2583.12","","","","298","","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","","","Analcime","- Al1.9 H4 Na1.95 O14 Si4.1 -","- Al1.9 H4 Na1.95 O14 Si4.1 -","- Al15.2 H32 Na15.6 O112 Si32.8 -","8","0.25","","Cruciani, G.; Gualtieri, A.","Dehydration dynamics of analcime by in situ synchrotron powder diffraction Sample at T = 298 K","American Mineralogist","1999","84","","112","119","","","","","","","","","","","","","","","","","","","","","","has coordinates","303137","2025-11-01","16:23:45",""
"9002001","13.6717","","13.6717","","13.5996","","90","","90","","90","","2541.97","","","","632","","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","","","Analcime","- Al0.95 H4 Na0.9 O6.22 Si2.05 -","- Al0.95 H0.22 Na0.9 O6.11 Si2.05 -","- Al15.2 H3.52 Na14.4 O97.76 Si32.8 -","16","0.5","","Cruciani, G.; Gualtieri, A.","Dehydration dynamics of analcime by in situ synchrotron powder diffraction Sample at T = 632 K","American Mineralogist","1999","84","","112","119","","","","","","","","","","","","","","","","","","","","","","has coordinates","176465","2020-10-21","18:00:00",""
"9002002","13.6251","","13.6251","","13.587","","90","","90","","90","","2522.34","","","","921","","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","Analcime","- Al1.9 Na1.86 O12 Si4.1 -","- Al1.9 Na1.86 O12 Si4.1 -","- Al15.2 Na14.88 O96 Si32.8 -","8","0.25","","Cruciani, G.; Gualtieri, A.","Dehydration dynamics of analcime by in situ synchrotron powder diffraction Sample at T = 921 K","American Mineralogist","1999","84","","112","119","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:13:12",""
"9002003","8.402","","13.043","","14.308","","90","","115.3","","90","","1417.58","","","","293.15","","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","","Feldspar","- Al1.16 O8 Pb Si2.84 -","- Al1.16 O8 Pb Si2.84 -","- Al9.28 O64 Pb8 Si22.72 -","8","1","","Benna, P.; Tribaudino, M.; Bruno, E.","High-temperature in situ structural investigation on lead feldspar Sample at T = 20 C, single Pb atom model","American Mineralogist","1999","84","","120","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002004","8.422","","13.045","","14.31","","90","","115.34","","90","","1420.9","","","","503.15","","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","","Feldspar","- Al1.16 O8 Pb Si2.84 -","- Al1.16 O8 Pb Si2.84 -","- Al9.28 O64 Pb8 Si22.72 -","8","1","","Benna, P.; Tribaudino, M.; Bruno, E.","High-temperature in situ structural investigation on lead feldspar Sample at T = 230 C, single Pb atom model","American Mineralogist","1999","84","","120","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002005","8.44","","13.051","","14.325","","90","","115.33","","90","","1426.2","","","","738.15","","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","","Feldspar","- Al1.16 O8 Pb Si2.84 -","- Al1.16 O8 Pb Si2.84 -","- Al9.28 O64 Pb8 Si22.72 -","8","1","","Benna, P.; Tribaudino, M.; Bruno, E.","High-temperature in situ structural investigation on lead feldspar Sample at T = 465 C, single Pb atom model","American Mineralogist","1999","84","","120","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002006","8.448","","13.057","","7.166","","90","","115.25","","90","","714.926","","","","973.15","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","Feldspar","- Al0.58 O4 Pb Si1.42 -","- Al0.58 O4 Pb Si1.42 -","- Al4.64 O32 Pb8 Si11.36 -","8","1","","Benna, P.; Tribaudino, M.; Bruno, E.","High-temperature in situ structural investigation on lead feldspar Sample at T = 700 C, single Pb atom model","American Mineralogist","1999","84","","120","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002007","8.402","","13.043","","14.308","","90","","115.3","","90","","1417.58","","","","293.15","","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","","Feldspar","- Al0.58 O4 Pb0.5 Si1.42 -","- Al0.58 O4 Pb0.5 Si1.42 -","- Al9.28 O64 Pb8 Si22.72 -","16","2","","Benna, P.; Tribaudino, M.; Bruno, E.","High-temperature in situ structural investigation on lead feldspar Sample at T = 20 C, split Pb atom model","American Mineralogist","1999","84","","120","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","294030","2024-08-07","12:35:44",""
"9002008","8.422","","13.045","","14.31","","90","","115.34","","90","","1420.9","","","","503.15","","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","","Feldspar","- Al0.58 O4 Pb0.5 Si1.42 -","- Al0.58 O4 Pb0.5 Si1.42 -","- Al9.28 O64 Pb8 Si22.72 -","16","2","","Benna, P.; Tribaudino, M.; Bruno, E.","High-temperature in situ structural investigation on lead feldspar Sample at T = 230 C, split Pb atom model","American Mineralogist","1999","84","","120","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","294030","2024-08-07","12:35:44",""
"9002009","8.44","","13.051","","14.325","","90","","115.33","","90","","1426.2","","","","738.15","","","","","","","","","4","I 1 2/c 1","-I 2yc","15","","","Feldspar","- Al0.58 O4 Pb0.5 Si1.42 -","- Al0.58 O4 Pb0.5 Si1.42 -","- Al9.28 O64 Pb8 Si22.72 -","16","2","","Benna, P.; Tribaudino, M.; Bruno, E.","High-temperature in situ structural investigation on lead feldspar Sample at T = 465 C, split Pb atom model","American Mineralogist","1999","84","","120","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","294030","2024-08-07","12:35:44",""
"9002010","8.448","","13.057","","7.166","","90","","115.25","","90","","714.926","","","","973.15","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","Feldspar","- Al0.29 O2 Pb0.5 Si0.71 -","- Al0.29 O2 Pb0.5 Si0.71 -","- Al4.64 O32 Pb8 Si11.36 -","16","2","","Benna, P.; Tribaudino, M.; Bruno, E.","High-temperature in situ structural investigation on lead feldspar Sample at T = 700 C, split Pb atom model","American Mineralogist","1999","84","","120","129","","","","","","","","","","","","","","","","","","","","","","has coordinates","294030","2024-08-07","12:35:44",""
"9002011","9.7131","","10.019","","3.7363","","90","","90","","90","","363.6","","","","","","","","0","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 0 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002012","9.6944","","9.9924","","3.7316","","90","","90","","90","","361.481","","","","","","","","1030000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 1.03 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002013","9.6739","","9.9651","","3.7265","","90","","90","","90","","359.24","","","","","","","","2160000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 2.16 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002014","9.654","","9.9387","","3.7218","","90","","90","","90","","357.1","","","","","","","","3220000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 3.22 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002015","9.6349","","9.9143","","3.7168","","90","","90","","90","","355.041","","","","","","","","4340000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 4.34 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002016","9.5992","","9.8667","","3.7085","","90","","90","","90","","351.241","","","","","","","","6200000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 6.20 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002017","9.5754","","9.8352","","3.7029","","90","","90","","90","","348.724","","","","","","","","7510000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P600, x(Ti) in M1 = .070, P = 7.51 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002018","9.7602","","9.9796","","3.7479","","90","","90","","90","","365.056","","","","","","","","0","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 0.00 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002019","9.7392","","9.9539","","3.7426","","90","","90","","90","","362.819","","","","","","","","1030000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 1.03 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002020","9.7166","","9.9275","","3.7369","","90","","90","","90","","360.467","","","","","","","","2160000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 2.16 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002021","9.6949","","9.9022","","3.7313","","90","","90","","90","","358.208","","","","","","","","3220000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 3.22 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002022","9.6737","","9.8769","","3.7271","","90","","90","","90","","356.11","","","","","","","","4340000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 4.34 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002023","9.6327","","9.8302","","3.7177","","90","","90","","90","","352.034","","","","","","","","6200000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 6.20 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002024","9.608","","9.8024","","3.7114","","90","","90","","90","","349.545","","","","","","","","7510000","","","","","3","B b m m","-B 2 2b","63","","","Pseudobrookite","- Mg O5 Ti2 -","- Mg O5 Ti2 -","- Mg4 O20 Ti8 -","4","0.25","","Yang, H.; Hazen, R. M.","Comparative high-pressure crystal chemistry of karrooite, MgTi2O5, with different ordering states Sample P1400, x(Ti) in M1 = .485, P = 7.51 GPa","American Mineralogist","1999","84","","130","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002025","11.512","","11.512","","11.515","","90","","90","","90","","1526.04","","","","","","","","","","","","","5","I 41/a","","","","","Majorite","- Al0.36 Cr0.28 Mg3.68 O12 Si4.68 -","- Al0.36 Cr0.28 Mg3.68 O12 Si4.68 -","- Al2.88 Cr2.24 Mg29.44 O96 Si37.44 -","8","","","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.; Ito, E.","Structure refinement of birefringent Cr-bearing majorite Mg3(Mg.34Si.34Al.18Cr.14)2Si3O12","American Mineralogist","1999","84","","199","202","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002026","2.7992","","9.4097","","9.4832","","90","","90","","90","","249.784","","","","","","","","23960000","","","","","2","P b c m","-P 2c 2b","57","","","Fe3O4","- Fe3 O4 -","- Fe3 O4 -","- Fe12 O16 -","4","0.5","","Fei, Y.; Frost, D. J.; Mao, H. K.; Prewitt, C. T.; Hausermann, D.","In situ structure determination of the high-pressure phase of Fe3O4 Sample data recorded at P = 23.96 GPa, T = = 823 K","American Mineralogist","1999","84","","203","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002027","8.5173","","4.7453","","10.399","","90","","90","","90","","420.298","","","","","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","","PON","- N O P -","- N O P -","- N12 O12 P12 -","12","1.5","","Chateau, C.; Haines, J.; Leger, J. M.; LeSauze, A.; Marchand, R.","A moganite-type phase in the silica analog phosphorus oxynitride","American Mineralogist","1999","84","","207","210","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002028","4.7839","","4.9294","","6.9","","90","","90","","90","","162.714","","","","","","","","","","","","Synthetic","4","P b n m","-P 2c 2ab","62","","","Bridgmanite","- Fe0.05 Mg0.95 O3 Si -","- Fe0.05 Mg0.95 O3 Si -","- Fe0.2 Mg3.8 O12 Si4 -","4","0.5","","Jephcoat, A. P.; Hriljac, J. A.; McCammon, C. A.; O'Neill H St C; Rubie, D. C.; Finger, L. W.","High-resolution synchrotron X-ray powder diffraction and Rietveld structure refinement of two (Mg.95,Fe.05)SiO3 perovskite samples synthesized under different oxygen fugacity conditions Sample PV-A","American Mineralogist","1999","84","","214","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002029","4.78517","","4.93227","","6.90484","","90","","90","","90","","162.966","","","","","","","","","","","","Synthetic","4","P b n m","-P 2c 2ab","62","","","Bridgmanite","- Fe0.06 Mg0.96 O3 Si -","- Fe0.06 Mg0.96 O3 Si -","- Fe0.24 Mg3.84 O12 Si4 -","4","0.5","","Jephcoat, A. P.; Hriljac, J. A.; McCammon, C. A.; O'Neill H St C; Rubie, D. C.; Finger, L. W.","High-resolution synchrotron X-ray powder diffraction and Rietveld structure refinement of two (Mg.95,Fe.05)SiO3 perovskite samples synthesized under different oxygen fugacity conditions Sample PV-B","American Mineralogist","1999","84","","214","220","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002030","9.2554","","8.765","","5.3333","","90","","90","","90","","432.656","","","","","","","","0","","","","","5","P b c n","-P 2n 2ab","60","","","Protopyroxene","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.92 Mg6.16 O24 Sc0.92 Si8 -","4","0.5","","Yang, H.; Finger, L. W.; Conrad, P. G.; Prewitt, C. T.; Hazen, R. M.","A new pyroxene structure at high pressure: Single-crystal X-ray and Raman study of the Pbcn - P2_1cn phase transition in protopyroxene Sample at P = 0.00 GPa, (Mg1.54Li.23Sc.23)Si2O6","American Mineralogist","1999","84","","245","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002031","9.2351","","8.731","","5.3216","","90","","90","","90","","429.089","","","","","","","","1110000","","","","","5","P b c n","-P 2n 2ab","60","","","Protopyroxene","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.92 Mg6.16 O24 Sc0.92 Si8 -","4","0.5","","Yang, H.; Finger, L. W.; Conrad, P. G.; Prewitt, C. T.; Hazen, R. M.","A new pyroxene structure at high pressure: Single-crystal X-ray and Raman study of the Pbcn - P2_1cn phase transition in protopyroxene Sample at P = 1.11 GPa, (Mg1.54Li.23Sc.23)Si2O6","American Mineralogist","1999","84","","245","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002032","9.2178","","8.7039","","5.3119","","90","","90","","90","","426.178","","","","","","","","2030000","","","","","5","P b c n","-P 2n 2ab","60","","","Protopyroxene","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.92 Mg6.16 O24 Sc0.92 Si8 -","4","0.5","","Yang, H.; Finger, L. W.; Conrad, P. G.; Prewitt, C. T.; Hazen, R. M.","A new pyroxene structure at high pressure: Single-crystal X-ray and Raman study of the Pbcn - P2_1cn phase transition in protopyroxene Sample at P = 2.03 GPa, (Mg1.54Li.23Sc.23)Si2O6","American Mineralogist","1999","84","","245","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002033","9.1167","","8.7857","","5.1837","","90","","90","","90","","415.197","","","","","","","","2500000","","","","","5","P 21 c n","","","","","Protopyroxene","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.92 Mg6.16 O24 Sc0.92 Si8 -","4","1","","Yang, H.; Finger, L. W.; Conrad, P. G.; Prewitt, C. T.; Hazen, R. M.","A new pyroxene structure at high pressure: Single-crystal X-ray and Raman study of the Pbcn - P2_1cn phase transition in protopyroxene Sample at P = 2.50 GPa, (Mg1.54Li.23Sc.23)Si2O6","American Mineralogist","1999","84","","245","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002034","9.0877","","8.7526","","5.1531","","90","","90","","90","","409.883","","","","","","","","4220000","","","","","5","P 21 c n","","","","","Protopyroxene","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.92 Mg6.16 O24 Sc0.92 Si8 -","4","1","","Yang, H.; Finger, L. W.; Conrad, P. G.; Prewitt, C. T.; Hazen, R. M.","A new pyroxene structure at high pressure: Single-crystal X-ray and Raman study of the Pbcn - P2_1cn phase transition in protopyroxene Sample at P = 4.22 GPa, (Mg1.54Li.23Sc.23)Si2O6","American Mineralogist","1999","84","","245","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002035","9.0548","","8.712","","5.1209","","90","","90","","90","","403.964","","","","","","","","6140000","","","","","5","P 21 c n","","","","","Protopyroxene","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.92 Mg6.16 O24 Sc0.92 Si8 -","4","1","","Yang, H.; Finger, L. W.; Conrad, P. G.; Prewitt, C. T.; Hazen, R. M.","A new pyroxene structure at high pressure: Single-crystal X-ray and Raman study of the Pbcn - P2_1cn phase transition in protopyroxene Sample at P = 6.14 GPa, (Mg1.54Li.23Sc.23)Si2O6","American Mineralogist","1999","84","","245","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002036","9.0219","","8.6711","","5.0898","","90","","90","","90","","398.174","","","","","","","","7930000","","","","","5","P 21 c n","","","","","Protopyroxene","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.92 Mg6.16 O24 Sc0.92 Si8 -","4","1","","Yang, H.; Finger, L. W.; Conrad, P. G.; Prewitt, C. T.; Hazen, R. M.","A new pyroxene structure at high pressure: Single-crystal X-ray and Raman study of the Pbcn - P2_1cn phase transition in protopyroxene Sample at P = 7.93 GPa, (Mg1.54Li.23Sc.23)Si2O6","American Mineralogist","1999","84","","245","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002037","8.9921","","8.631","","5.0659","","90","","90","","90","","393.169","","","","","","","","9980000","","","","","5","P 21 c n","","","","","Protopyroxene","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.23 Mg1.54 O6 Sc0.23 Si2 -","- Li0.92 Mg6.16 O24 Sc0.92 Si8 -","4","1","","Yang, H.; Finger, L. W.; Conrad, P. G.; Prewitt, C. T.; Hazen, R. M.","A new pyroxene structure at high pressure: Single-crystal X-ray and Raman study of the Pbcn - P2_1cn phase transition in protopyroxene Sample at P = 9.98 GPa, (Mg1.54Li.23Sc.23)Si2O6","American Mineralogist","1999","84","","245","256","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002038","10.328","","10.724","","8.805","","105.15","","96.85","","125.47","","719.667","","","","","","","","","","","synthesized at 13-14 GPa","","5","P -1","-P 1","2","","","Aenigmatite","- Fe0.65 Mg2.163 Na O10 Si3.188 -","- Fe0.64975 Mg2.16275 Na O10 Si3.1875 -","- Fe2.599 Mg8.651 Na4 O40 Si12.75 -","4","2","","Gasparik, T.; Parise, J. B.; Reeder, R. J.; Young, V. G.; Wilford, W. S.","Composition, stability, and structure of a new member of the aenigmatite group, Na2Mg4+xFe2-2xSi6+xO20, synthesized at 13-14 GPa","American Mineralogist","1999","84","","257","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002039","6.543","","8.3918","","6.3416","","90","","113.175","","90","","320.104","","","","","","","","100","","","","","3","A 1 2/n 1","-A 2yab","15","","","Titanite","- Ca O5 Si2 -","- Ca O5 Si2 -","- Ca4 O20 Si8 -","4","0.5","","Angel, R. J.; Kunz, M.; Miletich, R.; Woodland, A. B.; Koch, M.; Knoche, R. L.","Effect of isovalent Si,Ti substitution on the bulk moduli of Ca(Ti1-xSix)SiO5 titanites P = 1 atm","American Mineralogist","1999","84","","282","287","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002040","6.5297","","8.3823","","6.3227","","90","","113.087","","90","","318.35","","","","","","","","1000000","","","","","3","A 1 2/n 1","-A 2yab","15","","","Titanite","- Ca O5 Si2 -","- Ca O5 Si2 -","- Ca4 O20 Si8 -","4","0.5","","Angel, R. J.; Kunz, M.; Miletich, R.; Woodland, A. B.; Koch, M.; Knoche, R. L.","Effect of isovalent Si,Ti substitution on the bulk moduli of Ca(Ti1-xSix)SiO5 titanites P = 1.0 GPa","American Mineralogist","1999","84","","282","287","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002041","6.5096","","8.3636","","6.2954","","90","","112.96","","90","","315.592","","","","","","","","2600000","","","","","3","A 1 2/n 1","-A 2yab","15","","","Titanite","- Ca O5 Si2 -","- Ca O5 Si2 -","- Ca4 O20 Si8 -","4","0.5","","Angel, R. J.; Kunz, M.; Miletich, R.; Woodland, A. B.; Koch, M.; Knoche, R. L.","Effect of isovalent Si,Ti substitution on the bulk moduli of Ca(Ti1-xSix)SiO5 titanites P = 2.6 GPa","American Mineralogist","1999","84","","282","287","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002042","6.485","","8.3431","","6.2653","","90","","112.784","","90","","312.534","","","","","","","","4400000","","","","","3","A 1 2/n 1","-A 2yab","15","","","Titanite","- Ca O5 Si2 -","- Ca O5 Si2 -","- Ca4 O20 Si8 -","4","0.5","","Angel, R. J.; Kunz, M.; Miletich, R.; Woodland, A. B.; Koch, M.; Knoche, R. L.","Effect of isovalent Si,Ti substitution on the bulk moduli of Ca(Ti1-xSix)SiO5 titanites P = 4.4 GPa","American Mineralogist","1999","84","","282","287","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002043","6.4699","","8.3294","","6.2444","","90","","112.688","","90","","310.473","","","","","","","","5800000","","","","","3","A 1 2/n 1","-A 2yab","15","","","Titanite","- Ca O5 Si2 -","- Ca O5 Si2 -","- Ca4 O20 Si8 -","4","0.5","","Angel, R. J.; Kunz, M.; Miletich, R.; Woodland, A. B.; Koch, M.; Knoche, R. L.","Effect of isovalent Si,Ti substitution on the bulk moduli of Ca(Ti1-xSix)SiO5 titanites P = 5.8 GPa","American Mineralogist","1999","84","","282","287","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002044","8.0836","","8.0836","","8.0836","","90","","90","","90","","528.22","","","","299","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 299 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002045","8.11006","","8.11006","","8.11006","","90","","90","","90","","533.424","","","","683","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 683 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002046","8.11142","","8.11142","","8.11142","","90","","90","","90","","533.692","","","","707","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 707 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002047","8.1159","","8.1159","","8.1159","","90","","90","","90","","534.577","","","","766","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 766 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002048","8.12066","","8.12066","","8.12066","","90","","90","","90","","535.518","","","","837","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 837 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002049","8.12577","","8.12577","","8.12577","","90","","90","","90","","536.529","","","","903","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 903 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002050","8.13098","","8.13098","","8.13098","","90","","90","","90","","537.562","","","","969","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 969 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002051","8.13564","","8.13564","","8.13564","","90","","90","","90","","538.487","","","","1035","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1035 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002052","8.13979","","8.13979","","8.13979","","90","","90","","90","","539.311","","","","1100","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1100 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002053","8.14426","","8.14426","","8.14426","","90","","90","","90","","540.2","","","","1164","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1164 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002054","8.14888","","8.14888","","8.14888","","90","","90","","90","","541.12","","","","1228","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1228 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002055","8.15365","","8.15365","","8.15365","","90","","90","","90","","542.071","","","","1291","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1291 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002056","8.15805","","8.15805","","8.15805","","90","","90","","90","","542.949","","","","1355","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1355 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002057","8.1636","","8.1636","","8.1636","","90","","90","","90","","544.058","","","","1418","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1418 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002058","8.16885","","8.16885","","8.16885","","90","","90","","90","","545.108","","","","1481","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1481 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002059","8.17402","","8.17402","","8.17402","","90","","90","","90","","546.144","","","","1544","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1544 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002060","8.1794","","8.1794","","8.1794","","90","","90","","90","","547.223","","","","1606","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1606 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002061","8.18326","","8.18326","","8.18326","","90","","90","","90","","547.998","","","","1644","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1644 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002062","8.18536","","8.18536","","8.18536","","90","","90","","90","","548.42","","","","1662","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1662 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002063","8.18455","","8.18455","","8.18455","","90","","90","","90","","548.257","","","","1650","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1650 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002064","8.17903","","8.17903","","8.17903","","90","","90","","90","","547.149","","","","1595","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1595 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002065","8.1736","","8.1736","","8.1736","","90","","90","","90","","546.06","","","","1532","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1532 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002066","8.1681","","8.1681","","8.1681","","90","","90","","90","","544.958","","","","1468","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1468 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32",""
"9002067","8.16459","","8.16459","","8.16459","","90","","90","","90","","544.256","","","","1405","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1405 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002068","8.1503","","8.1503","","8.1503","","90","","90","","90","","541.403","","","","1278","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1278 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002069","8.1473","","8.1473","","8.1473","","90","","90","","90","","540.806","","","","1214","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1214 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002070","8.14249","","8.14249","","8.14249","","90","","90","","90","","539.848","","","","1152","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1152 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002071","8.13777","","8.13777","","8.13777","","90","","90","","90","","538.91","","","","1088","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.99 Mg0.998 O4 -","- Al1.99 Mg0.998 O4 -","- Al15.92 Mg7.984 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1088 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002072","8.13316","","8.13316","","8.13316","","90","","90","","90","","537.995","","","","1024","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1024 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002073","8.12854","","8.12854","","8.12854","","90","","90","","90","","537.078","","","","961","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 961 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002074","8.1239","","8.1239","","8.1239","","90","","90","","90","","536.159","","","","898","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 898 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002075","8.11928","","8.11928","","8.11928","","90","","90","","90","","535.245","","","","834","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 834 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002076","8.11468","","8.11468","","8.11468","","90","","90","","90","","534.336","","","","770","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 770 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002077","8.11057","","8.11057","","8.11057","","90","","90","","90","","533.524","","","","710","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 710 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002078","8.10563","","8.10563","","8.10563","","90","","90","","90","","532.55","","","","610","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 610 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002079","8.09701","","8.09701","","8.09701","","90","","90","","90","","530.853","","","","516","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 516 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002080","8.09365","","8.09365","","8.09365","","90","","90","","90","","530.192","","","","464","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 464 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002081","8.09159","","8.09159","","8.09159","","90","","90","","90","","529.787","","","","405","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 405 K on cooling cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002082","8.0836","","8.0836","","8.0836","","90","","90","","90","","528.22","","","","298","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 298 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002083","8.0965","","8.0965","","8.0965","","90","","90","","90","","530.752","","","","473","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 473 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002084","8.11009","","8.11009","","8.11009","","90","","90","","90","","533.429","","","","673","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 673 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002085","8.11685","","8.11685","","8.11685","","90","","90","","90","","534.764","","","","773","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 773 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002086","8.12443","","8.12443","","8.12443","","90","","90","","90","","536.264","","","","873","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 873 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002087","8.13192","","8.13192","","8.13192","","90","","90","","90","","537.749","","","","973","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 973 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002088","8.13916","","8.13916","","8.13916","","90","","90","","90","","539.186","","","","1073","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 1073 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002089","8.14652","","8.14652","","8.14652","","90","","90","","90","","540.65","","","","1173","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 1173 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002090","8.15428","","8.15428","","8.15428","","90","","90","","90","","542.197","","","","1273","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 1273 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002091","8.16214","","8.16214","","8.16214","","90","","90","","90","","543.766","","","","1373","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 1373 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002092","8.17015","","8.17015","","8.17015","","90","","90","","90","","545.369","","","","1473","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 1473 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002093","8.17859","","8.17859","","8.17859","","90","","90","","90","","547.06","","","","1573","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 1573 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002094","8.19804","","8.19804","","8.19804","","90","","90","","90","","550.973","","","","1673","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 1673 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002095","8.20091","","8.20091","","8.20091","","90","","90","","90","","551.552","","","","1773","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 1773 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002096","8.20857","","8.20857","","8.20857","","90","","90","","90","","553.099","","","","1873","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at ISIS, Rutherford Appleton Laboratory, U.K. T = 1873 K on heating cycle, MgAl2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002097","8.0958","","8.0958","","8.0958","","90","","90","","90","","530.615","","","","364","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 364 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002098","8.09613","","8.09613","","8.09613","","90","","90","","90","","530.68","","","","374","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 374 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002099","8.09924","","8.09924","","8.09924","","90","","90","","90","","531.291","","","","420","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 420 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002100","8.10384","","8.10384","","8.10384","","90","","90","","90","","532.197","","","","502","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 502 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002101","8.1087","","8.1087","","8.1087","","90","","90","","90","","533.155","","","","563","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 563 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002102","8.11359","","8.11359","","8.11359","","90","","90","","90","","534.12","","","","636","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 636 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002103","8.1185","","8.1185","","8.1185","","90","","90","","90","","535.091","","","","707","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 707 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002104","8.12333","","8.12333","","8.12333","","90","","90","","90","","536.046","","","","778","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 778 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002105","8.12816","","8.12816","","8.12816","","90","","90","","90","","537.003","","","","848","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 848 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002106","8.13321","","8.13321","","8.13321","","90","","90","","90","","538.005","","","","916","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 916 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002107","8.13801","","8.13801","","8.13801","","90","","90","","90","","538.958","","","","984","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 984 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002108","8.14282","","8.14282","","8.14282","","90","","90","","90","","539.914","","","","1080","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1080 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002109","8.14757","","8.14757","","8.14757","","90","","90","","90","","540.859","","","","1116","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1116 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002110","8.15239","","8.15239","","8.15239","","90","","90","","90","","541.82","","","","1182","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1182 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002111","8.15738","","8.15738","","8.15738","","90","","90","","90","","542.815","","","","1232","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1232 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002112","8.16234","","8.16234","","8.16234","","90","","90","","90","","543.806","","","","1311","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1311 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002113","8.16775","","8.16775","","8.16775","","90","","90","","90","","544.888","","","","1376","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1376 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002114","8.17306","","8.17306","","8.17306","","90","","90","","90","","545.951","","","","1441","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1441 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002115","8.17838","","8.17838","","8.17838","","90","","90","","90","","547.018","","","","1506","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1506 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002116","8.18394","","8.18394","","8.18394","","90","","90","","90","","548.135","","","","1573","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1573 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002117","8.18961","","8.18961","","8.18961","","90","","90","","90","","549.275","","","","1639","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1639 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002118","8.19344","","8.19344","","8.19344","","90","","90","","90","","550.046","","","","1676","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1676 K on heating cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002119","8.19336","","8.19336","","8.19336","","90","","90","","90","","550.03","","","","1671","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1671 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002120","8.1885","","8.1885","","8.1885","","90","","90","","90","","549.051","","","","1622","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1622 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002121","8.18299","","8.18299","","8.18299","","90","","90","","90","","547.944","","","","1557","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1557 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002122","8.1776","","8.1776","","8.1776","","90","","90","","90","","546.862","","","","1492","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1492 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002123","8.17236","","8.17236","","8.17236","","90","","90","","90","","545.811","","","","1427","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1427 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002124","8.16703","","8.16703","","8.16703","","90","","90","","90","","544.744","","","","1362","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1362 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002125","8.16204","","8.16204","","8.16204","","90","","90","","90","","543.746","","","","1299","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1299 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002126","8.15701","","8.15701","","8.15701","","90","","90","","90","","542.741","","","","1235","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1235 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002127","8.15222","","8.15222","","8.15222","","90","","90","","90","","541.786","","","","1171","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1171 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002128","8.1474","","8.1474","","8.1474","","90","","90","","90","","540.825","","","","1107","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1107 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002129","8.14254","","8.14254","","8.14254","","90","","90","","90","","539.858","","","","1043","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 1043 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002130","8.13806","","8.13806","","8.13806","","90","","90","","90","","538.968","","","","978","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 978 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002131","8.13333","","8.13333","","8.13333","","90","","90","","90","","538.028","","","","913","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 913 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002132","8.1287","","8.1287","","8.1287","","90","","90","","90","","537.11","","","","834","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 834 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002133","8.12406","","8.12406","","8.12406","","90","","90","","90","","536.191","","","","783","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 783 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002134","8.11961","","8.11961","","8.11961","","90","","90","","90","","535.31","","","","718","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 718 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002135","8.11512","","8.11512","","8.11512","","90","","90","","90","","534.423","","","","654","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 654 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002136","8.11084","","8.11084","","8.11084","","90","","90","","90","","533.577","","","","591","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2.04 Mg0.96 O4 -","- Al2.04 Mg0.96 O4 -","- Al16.32 Mg7.68 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 591 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002137","8.10662","","8.10662","","8.10662","","90","","90","","90","","532.745","","","","530","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 530 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002138","8.10285","","8.10285","","8.10285","","90","","90","","90","","532.002","","","","430","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 430 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002139","8.1012","","8.1012","","8.1012","","90","","90","","90","","531.677","","","","368","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2 Mg O4 -","- Al2 Mg O4 -","- Al16 Mg8 O32 -","8","0.0416667","","Redfern, S. A. T.; Harrison, R. J.; O'Neill H St C; Wood, D. R. R.","Thermodynamics and kinetics of cation ordering in MgAl2O4 spinel up to 1600 C from in situ neutron diffraction Data collected at IPNS, Argonne National Laboratory, T = 368 K on cooling cycle, Mg.99Al2O4","American Mineralogist","1999","84","","299","310","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002140","5.486","","9.506","","10.818","","90","","99.67","","90","","556.142","","","","296.15","","","","100","","","","","5","C 1 2/m 1","-C 2y","12","","","Tetra-ferri-annite","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.08 Cs1.78 Fe7.84 O24 Si6.08 -","2","0.25","","Comodi P; Zanazzi P F; Weiss Z; Rieder M; Drabek M","""Cs-tetra-ferri-annite:"" High-pressure and high-temperature behavior of a potential nuclear waste disposal phase T = 23 deg C, P = .001 kbar, crystal 1","American Mineralogist","1999","84","","325","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:19",""
"9002141","5.444","","9.439","","10.185","","90","","100.2","","90","","515.094","","","","296.15","","","","3940000","","","","","5","C 1 2/m 1","-C 2y","12","","","Tetra-ferri-annite","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.08 Cs1.78 Fe7.84 O24 Si6.08 -","2","0.25","","Comodi P; Zanazzi P F; Weiss Z; Rieder M; Drabek M","""Cs-tetra-ferri-annite:"" High-pressure and high-temperature behavior of a potential nuclear waste disposal phase T = 23 deg C, P = 39.4 kbar, crystal 1","American Mineralogist","1999","84","","325","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002142","5.48","","9.498","","10.82","","90","","99.76","","90","","555.02","","","","296.15","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Tetra-ferri-annite","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.08 Cs1.78 Fe7.84 O24 Si6.08 -","2","0.25","","Comodi P; Zanazzi P F; Weiss Z; Rieder M; Drabek M","""Cs-tetra-ferri-annite:"" High-pressure and high-temperature behavior of a potential nuclear waste disposal phase T = 23 deg C, crystal 2","American Mineralogist","1999","84","","325","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002143","5.48","","9.5","","10.907","","90","","99.6","","90","","559.867","","","","569.15","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Tetra-ferri-annite","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.08 Cs1.78 Fe7.84 O24 Si6.08 -","2","0.25","","Comodi P; Zanazzi P F; Weiss Z; Rieder M; Drabek M","""Cs-tetra-ferri-annite:"" High-pressure and high-temperature behavior of a potential nuclear waste disposal phase T = 296 deg C, crystal 2","American Mineralogist","1999","84","","325","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002144","5.476","","9.502","","10.954","","90","","99.54","","90","","562.086","","","","708.15","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Tetra-ferri-annite","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.08 Cs1.78 Fe7.84 O24 Si6.08 -","2","0.25","","Comodi P; Zanazzi P F; Weiss Z; Rieder M; Drabek M","""Cs-tetra-ferri-annite:"" High-pressure and high-temperature behavior of a potential nuclear waste disposal phase T = 435 deg C, crystal 2","American Mineralogist","1999","84","","325","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002145","5.452","","9.448","","10.786","","90","","99.77","","90","","547.534","","","","296.15","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Tetra-ferri-annite","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.04 Cs0.89 Fe3.92 O12 Si3.04 -","- Al0.08 Cs1.78 Fe7.84 O24 Si6.08 -","2","0.25","","Comodi P; Zanazzi P F; Weiss Z; Rieder M; Drabek M","""Cs-tetra-ferri-annite:"" High-pressure and high-temperature behavior of a potential nuclear waste disposal phase T = 23 deg C after heating, crystal 2","American Mineralogist","1999","84","","325","332","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002146","7.8386","","12.3733","","6.8074","","93.319","","116.368","","92.04","","589.172","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Reedmergnerite","- B Na O8 Si3 -","- B Na O8 Si3 -","- B4 Na4 O32 Si12 -","4","","","Downs, R. T.; Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.","Compressibility mechanisms of alkali feldspars: New data from reedmergnerite Sample from Joseph Smith #1 mine, Duchesne Co., Utah, NMNH 140 P = 0, in air","American Mineralogist","1999","84","","333","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002147","7.8389","","12.3715","","6.8065","","93.311","","116.363","","92.043","","589.062","","","","","","","","0","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Reedmergnerite","- B Na O8 Si3 -","- B Na O8 Si3 -","- B4 Na4 O32 Si12 -","4","","","Downs, R. T.; Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.","Compressibility mechanisms of alkali feldspars: New data from reedmergnerite Sample from Joseph Smith #1 mine, Duchesne Co., Utah, NMNH 140 P = 0.00 GPa, in cell","American Mineralogist","1999","84","","333","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002148","7.7852","","12.3419","","6.7917","","93.332","","116.347","","92.094","","582.38","","","","","","","","880000","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Reedmergnerite","- B Na O8 Si3 -","- B Na O8 Si3 -","- B4 Na4 O32 Si12 -","4","","","Downs, R. T.; Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.","Compressibility mechanisms of alkali feldspars: New data from reedmergnerite Sample from Joseph Smith #1 mine, Duchesne Co., Utah, NMNH 140 P = 0.88 GPa","American Mineralogist","1999","84","","333","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002149","7.7231","","12.3038","","6.7719","","93.364","","116.316","","92.145","","574.357","","","","","","","","1890000","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Reedmergnerite","- B Na O8 Si3 -","- B Na O8 Si3 -","- B4 Na4 O32 Si12 -","4","","","Downs, R. T.; Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.","Compressibility mechanisms of alkali feldspars: New data from reedmergnerite Sample from Joseph Smith #1 mine, Duchesne Co., Utah, NMNH 140 P = 1.89 GPa","American Mineralogist","1999","84","","333","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002150","7.6589","","12.2675","","6.7512","","93.374","","116.256","","92.222","","566.393","","","","","","","","3000000","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Reedmergnerite","- B Na O8 Si3 -","- B Na O8 Si3 -","- B4 Na4 O32 Si12 -","4","","","Downs, R. T.; Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.","Compressibility mechanisms of alkali feldspars: New data from reedmergnerite Sample from Joseph Smith #1 mine, Duchesne Co., Utah, NMNH 140 P = 3.00 GPa","American Mineralogist","1999","84","","333","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002151","7.6194","","12.2465","","6.7389","","93.392","","116.222","","92.263","","561.599","","","","","","","","3640000","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Reedmergnerite","- B Na O8 Si3 -","- B Na O8 Si3 -","- B4 Na4 O32 Si12 -","4","","","Downs, R. T.; Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.","Compressibility mechanisms of alkali feldspars: New data from reedmergnerite Sample from Joseph Smith #1 mine, Duchesne Co., Utah, NMNH 140 P = 3.64 GPa","American Mineralogist","1999","84","","333","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002152","7.579","","12.22","","6.7141","","93.373","","116.303","","92.345","","554.92","","","","","","","","4680000","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Reedmergnerite","- B Na O8 Si3 -","- B Na O8 Si3 -","- B4 Na4 O32 Si12 -","4","","","Downs, R. T.; Yang, H.; Hazen, R. M.; Finger, L. W.; Prewitt, C. T.","Compressibility mechanisms of alkali feldspars: New data from reedmergnerite Sample from Joseph Smith #1 mine, Duchesne Co., Utah, NMNH 140 P = 4.68 GPa","American Mineralogist","1999","84","","333","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002153","5.466","","5.675","","6.61","","101.02","","95.1","","107.31","","189.804","","","","","","","","","","","","","4","P -1","-P 1","2","","","Schubnelite","- Fe H2 O5 V -","- Fe H2 O5 V -","- Fe2 H4 O10 V2 -","2","1","","Schindler, M.; Hawthorne, F. C.","Schubnelite, [Fe(VO4)(H2O)], a novel heteropolyhedral framework mineral","American Mineralogist","1999","84","","665","668","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002154","4.22","","4.176","","15.119","","90","","95.42","","90","","265.247","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","Nagyagite","- Au0.133 Pb1.476 S2 Sb0.524 Te0.867 -","- Au0.133 Pb1.476 S2 Sb0.524 Te0.867 -","- Au0.266 Pb2.952 S4 Sb1.048 Te1.734 -","2","0.5","","Effenberger, H.; Paar, W. H.; Topa, D.; Culetto, F. J.; Giester, G.","Toward the crystal structure of nagyagite, [Pb(Pb,Sb)S2][(Au,Te)]","American Mineralogist","1999","84","","669","676","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002155","10.1926","","18.1209","","5.2736","","90","","105.514","","90","","938.54","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Richterite","- Ca H2 K3 Mg5 O24 Si8 -","- Ca H2 K3 Mg5 O24 Si8 -","- Ca2 H4 K6 Mg10 O48 Si16 -","2","0.25","","Yang, H.; Konzett, J.; Prewitt, C. T.; Fei, Y.","Single-crystal structure refinement of synthetic K-substituted potassic richterite, K(KCa)Mg5Si8O22(OH)2","American Mineralogist","1999","84","","681","684","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002156","10.053","","10.053","","14.211","","90","","90","","120","","1243.79","","","","","","","","","","","","Dara-i-Pioz, Tadjikistan","9","P 6/m c c","-P 6 2c","192","","","Sogdianite","- Al0.13 Fe0.73 K Li3 Na1.7 O30 Si12 Ti0.38 Zr0.76 -","- Al0.13 Fe0.73 K Li3 Na1.7 O30 Si12 Ti0.38 Zr0.76 -","- Al0.26 Fe1.46 K2 Li6 Na3.4 O60 Si24 Ti0.76 Zr1.52 -","2","0.0833333","","Cooper, M. A.; Hawthorne, F. C.; Grew, E. S.","The crystal chemistry of sogdianite, a milarite-group mineral Note: U(1,2) for Li2 changed to match symmetry constraints.","American Mineralogist","1999","84","","764","768","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002157","5.343","","9.247","","10.397","","90","","100.04","","90","","505.815","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.46 Cs0.233 Fe1.04 H2 K0.462 Li0.3 Mg1.24 O12 Rb0.275 Si2.92 Ti0.04 -","- Al1.46 Cs0.233 Fe1.04 H2 K0.462 Li0.3 Mg1.24 O12 Rb0.275 Si2.92 Ti0.04 -","- Al2.92 Cs0.466 Fe2.08 H4 K0.924 Li0.6 Mg2.48 O24 Rb0.55 Si5.84 Ti0.08 -","2","0.25","","Hawthorne, F. C.; Teertstra, D. K.; Cerny, P.","Crystal-structure refinement of a rubidian cesian phlogopite","American Mineralogist","1999","84","","778","781","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002158","9.9134","","3.0128","","4.58","","90","","90","","90","","136.791","","","","298.15","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","Goethite","- Fe H O2 -","- Fe H O2 -","- Fe4 H4 O8 -","4","0.5","","Gualtieri, A.; Venturelli, P.","In situ study of the goethite-hematite phase transformation by real time synchrotron powder diffraction Sample at T = 25 C","American Mineralogist","1999","84","","895","904","","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:42",""
"9002159","9.9189","","3.0148","","4.5835","","90","","90","","90","","137.063","","","","429.15","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","Goethite","- Fe H O2 -","- Fe H O2 -","- Fe4 H4 O8 -","4","0.5","","Gualtieri, A.; Venturelli, P.","In situ study of the goethite-hematite phase transformation by real time synchrotron powder diffraction Sample at T = 156 C","American Mineralogist","1999","84","","895","904","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:13:12",""
"9002160","5.0145","","5.0145","","13.692","","90","","90","","120","","298.162","","","","586.15","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","Hematite-proto","- Fe1.76 H0.06 O3 -","- Fe1.76 H0.06 O3 -","- Fe10.56 H0.36 O18 -","6","0.166667","","Gualtieri, A.; Venturelli, P.","In situ study of the goethite-hematite phase transformation by real time synchrotron powder diffraction Sample at T = 313 C","American Mineralogist","1999","84","","895","904","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:13:12",""
"9002161","5.0258","","5.0258","","13.709","","90","","90","","120","","299.88","","","","790.15","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","Hematite-proto","- Fe1.9 H0.06 O3 -","- Fe1.9 H0.06 O3 -","- Fe11.4 H0.36 O18 -","6","0.166667","","Gualtieri, A.; Venturelli, P.","In situ study of the goethite-hematite phase transformation by real time synchrotron powder diffraction Sample at T = 517 C","American Mineralogist","1999","84","","895","904","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:13:12",""
"9002162","5.041","","5.041","","13.7251","","90","","90","","120","","302.05","","","","1052.15","","","","","","","","","3","R -3 c :H","-R 3 2""c","167","","","Hematite-proto","- Fe1.9 H0.06 O3 -","- Fe1.9 H0.06 O3 -","- Fe11.4 H0.36 O18 -","6","0.166667","","Gualtieri, A.; Venturelli, P.","In situ study of the goethite-hematite phase transformation by real time synchrotron powder diffraction Sample at T = 779 C","American Mineralogist","1999","84","","895","904","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:13:12",""
"9002163","8.0704","","8.0704","","8.0704","","90","","90","","90","","525.636","","","","","","","","0","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2.041 Mg0.939 O4 -","- Al2.0408 Mg0.9385 O4 -","- Al16.3264 Mg7.508 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Hull, S.","In situ powder neutron diffraction of cation partitioning vs. pressure in Mg0.94Al2.04O4 synthetic spinel Sample at P = 0.0 kbar","American Mineralogist","1999","84","","905","912","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002164","8.0694","","8.0694","","8.0694","","90","","90","","90","","525.441","","","","","","","","70000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2.041 Mg0.939 O4 -","- Al2.0408 Mg0.9387 O4 -","- Al16.3264 Mg7.5096 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Hull, S.","In situ powder neutron diffraction of cation partitioning vs. pressure in Mg0.94Al2.04O4 synthetic spinel Sample at P = 0.7 kbar","American Mineralogist","1999","84","","905","912","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002165","8.0616","","8.0616","","8.0616","","90","","90","","90","","523.919","","","","","","","","630000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2.041 Mg0.939 O4 -","- Al2.0409 Mg0.9387 O4 -","- Al16.3272 Mg7.5096 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Hull, S.","In situ powder neutron diffraction of cation partitioning vs. pressure in Mg0.94Al2.04O4 synthetic spinel Sample at P = 6.3 kbar","American Mineralogist","1999","84","","905","912","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002166","8.0452","","8.0452","","8.0452","","90","","90","","90","","520.728","","","","","","","","1820000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2.041 Mg0.939 O4 -","- Al2.0408 Mg0.9387 O4 -","- Al16.3264 Mg7.5096 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Hull, S.","In situ powder neutron diffraction of cation partitioning vs. pressure in Mg0.94Al2.04O4 synthetic spinel Sample at P = 18.2 kbar","American Mineralogist","1999","84","","905","912","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002167","8.0339","","8.0339","","8.0339","","90","","90","","90","","518.536","","","","","","","","2650000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2.039 Mg0.94 O4 -","- Al2.039 Mg0.94 O4 -","- Al16.312 Mg7.52 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Hull, S.","In situ powder neutron diffraction of cation partitioning vs. pressure in Mg0.94Al2.04O4 synthetic spinel Sample at P = 26.5 kbar","American Mineralogist","1999","84","","905","912","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002168","8.0187","","8.0187","","8.0187","","90","","90","","90","","515.599","","","","","","","","3810000","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al2.041 Mg0.939 O4 -","- Al2.0409 Mg0.9387 O4 -","- Al16.3272 Mg7.5096 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Hull, S.","In situ powder neutron diffraction of cation partitioning vs. pressure in Mg0.94Al2.04O4 synthetic spinel Sample at P = 38.1 kbar","American Mineralogist","1999","84","","905","912","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002169","19.068","","4.745","","10.289","","90","","111.18","","90","","868.041","","","","","","","","","","","","","19","P 1 2/a 1","-P 2ya","13","","","Hellandite-(Ce)","- Al0.83 B4 Be0.74 Ca4.2 Ce0.66 F0.5 Fe0.65 H0.5 La0.3 Li0.24 Mg0.11 Nd0.24 O23.5 Pr0.06 Si4 Th0.36 Ti0.41 U0.06 Y0.12 -","- Al0.83 B4 Be0.74 Ca4.2 Ce0.66 F0.5 Fe0.65 H0.5 La0.3 Li0.24 Mg0.11 Nd0.24 O23.5 Pr0.06 Si4 Th0.36 Ti0.41 U0.06 Y0.12 -","- Al1.66 B8 Be1.48 Ca8.4 Ce1.32 F Fe1.3 H La0.6 Li0.48 Mg0.22 Nd0.48 O47 Pr0.12 Si8 Th0.72 Ti0.82 U0.12 Y0.24 -","2","0.5","","Oberti, R.; Ottolini, L.; Camara, F.; Della Ventura, G.","Crystal structure of non-metamict Th-rich hellandite-(Ce) from Latium (Italy) and crystal chemistry of the hellandite-group minerals","American Mineralogist","1999","84","","913","921","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002170","15.939","","15.939","","7.146","","90","","90","","120","","1572.23","","","","","","","","","","","","Madagascar","15","R 3 m :H","R 3 -2""","160","","","Schorl","- Al7.014 B3 Ca0.1 F0.302 Fe1.233 H3.465 K0.043 Li0.006 Mg0.846 Na0.711 O30.698 Si5.832 Ti0.048 V0.006 Zn0.006 -","- Al7.014 B3 Ca0.1 F0.302 Fe1.233 H3.465 K0.043 Li0.006 Mg0.846 Na0.711 O30.698 Si5.832 Ti0.048 V0.006 Zn0.006 -","- Al21.042 B9 Ca0.3 F0.906 Fe3.699 H10.395 K0.129 Li0.018 Mg2.538 Na2.133 O92.094 Si17.496 Ti0.144 V0.018 Zn0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample 108749","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17",""
"9002171","15.963","","15.963","","7.154","","90","","90","","120","","1578.73","","","","","","","","","","","","Sebago Granite, North Windham, Oxford County, Maine, USA","14","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.576 B3 Ca0.031 F0.355 Fe1.764 H3.2 K0.03 Li0.021 Mg0.528 Mn0.015 Na0.608 O30.645 Si6 Ti0.081 -","- Al6.576 B3 Ca0.031 F0.355 Fe1.764 H3.2 K0.03 Li0.021 Mg0.528 Mn0.015 Na0.608 O30.645 Si6 Ti0.081 -","- Al19.728 B9 Ca0.093 F1.065 Fe5.292 H9.6 K0.09 Li0.063 Mg1.584 Mn0.045 Na1.824 O91.935 Si18 Ti0.243 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample DLux1","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17",""
"9002172","15.915","","15.915","","7.187","","90","","90","","120","","1576.49","","","","","","","","","","","","Dunton mine, Newry, Oxford County, Maine, USA","15","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.072 B3 Ca0.37 Cr0.009 F0.134 Fe0.549 H3.018 K0.027 Li0.006 Mg2.538 Na0.418 O30.866 Si6 Ti0.036 V0.009 -","- Al6.072 B3 Ca0.37 Cr0.009 F0.134 Fe0.549 H3.018 K0.027 Li0.006 Mg2.538 Na0.418 O30.866 Si6 Ti0.036 V0.009 -","- Al18.216 B9 Ca1.11 Cr0.027 F0.402 Fe1.647 H9.054 K0.081 Li0.018 Mg7.614 Na1.254 O92.598 Si18 Ti0.108 V0.027 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample LCW2356","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17",""
"9002173","15.946","","15.946","","7.157","","90","","90","","120","","1576.03","","","","","","","","","","","","Harney Peak Granite, Custer County, South Dakota, USA","15","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.639 B3 Ca0.027 F0.204 Fe1.671 H3.396 K0.025 Mg0.636 Mn0.012 Na0.54 O30.796 Si6 Ti0.009 V0.006 Zn0.006 -","- Al6.639 B3 Ca0.027 F0.204 Fe1.671 H3.396 K0.025 Mg0.636 Mn0.012 Na0.54 O30.796 Si6 Ti0.009 V0.006 Zn0.006 -","- Al19.917 B9 Ca0.081 F0.612 Fe5.013 H10.188 K0.075 Mg1.908 Mn0.036 Na1.62 O92.388 Si18 Ti0.027 V0.018 Zn0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample HP2-1","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17",""
"9002174","15.935","","15.935","","7.16","","90","","90","","120","","1574.52","","","","","","","","","","","","","15","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.516 B3 Ca0.156 Cr0.009 F0.06 Fe1.029 H3.094 K0.015 Mg1.359 Mn0.006 Na0.348 O30.94 Si6 Ti0.069 V0.006 -","- Al6.516 B3 Ca0.156 Cr0.009 F0.06 Fe1.029 H3.094 K0.015 Mg1.359 Mn0.006 Na0.348 O30.94 Si6 Ti0.069 V0.006 -","- Al19.548 B9 Ca0.468 Cr0.027 F0.18 Fe3.087 H9.282 K0.045 Mg4.077 Mn0.018 Na1.044 O92.82 Si18 Ti0.207 V0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample O-T16-92","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17",""
"9002175","15.934","","15.934","","7.167","","90","","90","","120","","1575.86","","","","","","","","","","","","","15","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.567 B3 Ca0.016 F0.301 Fe1.05 H3.234 K0.015 Li0.006 Mg1.305 Mn0.018 Na0.684 O30.699 Si6 Ti0.024 V0.006 -","- Al6.567 B3 Ca0.016 F0.301 Fe1.05 H3.234 K0.015 Li0.006 Mg1.305 Mn0.018 Na0.684 O30.699 Si6 Ti0.024 V0.006 -","- Al19.701 B9 Ca0.048 F0.903 Fe3.15 H9.702 K0.045 Li0.018 Mg3.915 Mn0.054 Na2.052 O92.097 Si18 Ti0.072 V0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample SmFalls","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17",""
"9002176","15.935","","15.935","","7.164","","90","","90","","120","","1575.4","","","","","","","","","","","","","13","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.606 B3 Ca0.017 F0.106 Fe1.047 H3.041 K0.04 Mg1.242 Na0.533 O30.894 Si6 Ti0.084 V0.015 -","- Al6.606 B3 Ca0.017 F0.106 Fe1.047 H3.041 K0.04 Mg1.242 Na0.533 O30.894 Si6 Ti0.084 V0.015 -","- Al19.818 B9 Ca0.051 F0.318 Fe3.141 H9.123 K0.12 Mg3.726 Na1.599 O92.682 Si18 Ti0.252 V0.045 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample Ru-T17-92","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17",""
"9002177","15.945","","15.945","","7.169","","90","","90","","120","","1578.48","","","","","","","","","","","","","16","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.318 B3 Ca0.061 Cr0.006 F0.331 Fe0.789 H2.682 K0.031 Li0.006 Mg1.734 Mn0.006 Na0.626 O30.669 Si6 Ti0.123 V0.009 -","- Al6.318 B3 Ca0.061 Cr0.006 F0.331 Fe0.789 H2.682 K0.031 Li0.006 Mg1.734 Mn0.006 Na0.626 O30.669 Si6 Ti0.123 V0.009 -","- Al18.954 B9 Ca0.183 Cr0.018 F0.993 Fe2.367 H8.046 K0.093 Li0.018 Mg5.202 Mn0.018 Na1.878 O92.007 Si18 Ti0.369 V0.027 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample Ru-T18-92","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17",""
"9002178","15.965","","15.965","","7.199","","90","","90","","120","","1589.06","","","","","","","","","","","","","14","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.439 B3 Ca0.368 F0.495 Fe1.158 H3.02 K0.029 Li0.018 Mg2.292 Mn0.012 Na0.471 O30.505 Si6 Ti0.033 -","- Al5.439 B3 Ca0.368 F0.495 Fe1.158 H3.02 K0.029 Li0.018 Mg2.292 Mn0.012 Na0.471 O30.505 Si6 Ti0.033 -","- Al16.317 B9 Ca1.104 F1.485 Fe3.474 H9.06 K0.087 Li0.054 Mg6.876 Mn0.036 Na1.413 O91.515 Si18 Ti0.099 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample #32008","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17",""
"9002179","6.8394","","11.8704","","19.6313","","90","","90.667","","90","","1593.69","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","Pseudowollastonite","- Ca O3 Si -","- Ca O3 Si -","- Ca24 O72 Si24 -","24","3","","Yang, H.; Prewitt, C. T.","On the crystal structure of pseudowollastonite (CaSiO3)","American Mineralogist","1999","84","","929","932","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002180","8.891","","5.624","","10.164","","90","","115.44","","90","","458.95","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","Epidote","- Al2.32 Ca2 Fe0.68 O13 Si3 -","- Al2.32 Ca2 Fe0.68 O13 Si3 -","- Al4.64 Ca4 Fe1.36 O26 Si6 -","2","0.5","","Giuli, G.; Bonazzi, P.; Menchetti, S.","Al-Fe disorder in synthetic epidotes: A single-crystal X-ray diffraction study Sample: CC11c","American Mineralogist","1999","84","","933","936","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002181","11.2469","","11.2469","","4.4851","","90","","90","","120","","491.325","","","","","","","","","","","","","3","P 3","P 3","143","","","BaSi4O9","- Ba O9 Si4 -","- Ba O9 Si4 -","- Ba3 O27 Si12 -","3","1","","Hazen, R. M.; Yang, H.; Finger, L. W.; Fursenko, B. A.","Crystal chemistry of high-pressure BaSi4O9 in the trigonal (P3) barium tetragermanate structure","American Mineralogist","1999","84","","987","989","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002182","5.55","","13.539","","25.134","","90","","93.928","","90","","1884.17","","","","","","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","Ganophyllite","- K0.46 Mn1.988 O9.439 Si3.184 -","- K0.46 Mn1.988 O9.674 Si3.184 -","- K3.68 Mn15.904 O77.392 Si25.472 -","8","1","","Noe, D. C.; Veblen, D. R.","Incommensurate modulation and the crystal structure of ganophyllite","American Mineralogist","1999","84","","1088","1098","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002183","17.649","","17.98","","7.412","","90","","116.22","","90","","2110.03","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Heulandite","- Al0.33 H28.74 Na0.39 O25.14 Si9 -","- Al0.33 H14.28 Na0.39 O25.14 Si9 -","- Al1.32 H57.12 Na1.56 O100.56 Si36 -","4","0.5","","Wust, T.; Stolz, J.; Armbruster, T.","Partially dealuminated heulandite produced by acidic REECl3 solution: A chemical and single-crystal X-ray study Sample: REE293 Tetrahedral sites were refined as Si","American Mineralogist","1999","84","","1126","1134","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:38:57",""
"9002184","17.611","","17.933","","7.398","","90","","116.29","","90","","2094.75","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Heulandite","- Al0.302 H28.74 Na0.38 O24.46 Si9 -","- Al0.302 H12.92 Na0.38 O24.46 Si9 -","- Al1.208 H51.68 Na1.52 O97.84 Si36 -","4","0.5","","Wust, T.; Stolz, J.; Armbruster, T.","Partially dealuminated heulandite produced by acidic REECl3 solution: A chemical and single-crystal X-ray study Sample: REE100 Tetrahedral sites were refined as Si","American Mineralogist","1999","84","","1126","1134","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:38:57",""
"9002185","17.583","","17.695","","7.408","","90","","116.52","","90","","2062.34","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Heulandite","- Al0.283 H12.9 Na0.19 O20.12 Si9 -","- Al0.283 H4.24 Na0.19 O20.12 Si9 -","- Al1.132 H16.96 Na0.76 O80.48 Si36 -","4","0.5","","Wust, T.; Stolz, J.; Armbruster, T.","Partially dealuminated heulandite produced by acidic REECl3 solution: A chemical and single-crystal X-ray study Sample: DEHY323 Tetrahedral sites were refined as Si","American Mineralogist","1999","84","","1126","1134","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:38:57",""
"9002186","17.608","","17.656","","7.414","","90","","116.42","","90","","2064.18","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","","Heulandite","- Al0.412 H25.12 Na0.26 O39.1 Si18 -","- Al0.412 H6.2 Na0.26 O39.1 Si18 -","- Al0.824 H12.4 Na0.52 O78.2 Si36 -","2","0.25","","Wust, T.; Stolz, J.; Armbruster, T.","Partially dealuminated heulandite produced by acidic REECl3 solution: A chemical and single-crystal X-ray study Sample: DEHY378","American Mineralogist","1999","84","","1126","1134","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:38:57",""
"9002187","11.4666","","11.4666","","11.4666","","90","","90","","90","","1507.66","","","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","Pyrope","- Al1.9 Mg3.05 O12 Si3.05 -","- Al1.9 Mg3.05 O12 Si3.05 -","- Al15.2 Mg24.4 O96 Si24.4 -","8","0.0833333","","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.; Ohtaka, O.; Katsura, T.; Ito, E.","Symmetry change of majorite solid-solution in the system Mg3Al2Si3O12-MgSiO3 Sample: x = .05","American Mineralogist","1999","84","","1135","1143","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002188","11.4755","","11.4755","","11.4755","","90","","90","","90","","1511.18","","","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","Pyrope","- Al1.74 Mg3.13 O12 Si3.13 -","- Al1.74 Mg3.13 O12 Si3.13 -","- Al13.92 Mg25.04 O96 Si25.04 -","8","0.0833333","","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.; Ohtaka, O.; Katsura, T.; Ito, E.","Symmetry change of majorite solid-solution in the system Mg3Al2Si3O12-MgSiO3 Sample: x = .13","American Mineralogist","1999","84","","1135","1143","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002189","11.4915","","11.4915","","11.4915","","90","","90","","90","","1517.51","","","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","Pyrope","- Al1.524 Mg3.238 O12 Si3.238 -","- Al1.524 Mg3.238 O12 Si3.238 -","- Al12.192 Mg25.904 O96 Si25.904 -","8","0.0833333","","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.; Ohtaka, O.; Katsura, T.; Ito, E.","Symmetry change of majorite solid-solution in the system Mg3Al2Si3O12-MgSiO3 Sample: x = .24","American Mineralogist","1999","84","","1135","1143","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002190","11.4833","","11.4833","","11.4833","","90","","90","","90","","1514.26","","","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","Majorite","- Al1.252 Mg3.374 O12 Si3.374 -","- Al1.252 Mg3.374 O12 Si3.374 -","- Al10.016 Mg26.992 O96 Si26.992 -","8","0.0833333","","Nakatsuka A; Yoshiasa A; Yamanaka T; Ohtaka O; Katsura T; Ito E","Symmetry change of majorite solid-solution in the system Mg3Al2Si3O12-MgSiO3 Sample: x = .38","American Mineralogist","1999","84","","1135","1143","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002191","11.4876","","11.4876","","11.4876","","90","","90","","90","","1515.96","","","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","Majorite","- Al0.96 Mg3.52 O12 Si3.52 -","- Al0.96 Mg3.52 O12 Si3.52 -","- Al7.68 Mg28.16 O96 Si28.16 -","8","0.0833333","","Nakatsuka A; Yoshiasa A; Yamanaka T; Ohtaka O; Katsura T; Ito E","Symmetry change of majorite solid-solution in the system Mg3Al2Si3O12-MgSiO3 Sample: x = .52","American Mineralogist","1999","84","","1135","1143","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002192","11.4891","","11.4891","","11.4891","","90","","90","","90","","1516.56","","","","","","","","","","","","","4","I a -3 d","-I 4bd 2c 3","230","","","Majorite","- Al0.72 Mg3.64 O12 Si3.64 -","- Al0.72 Mg3.64 O12 Si3.64 -","- Al5.76 Mg29.12 O96 Si29.12 -","8","0.0833333","","Nakatsuka A; Yoshiasa A; Yamanaka T; Ohtaka O; Katsura T; Ito E","Symmetry change of majorite solid-solution in the system Mg3Al2Si3O12-MgSiO3 Sample: x = .64","American Mineralogist","1999","84","","1135","1143","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002193","11.4833","","11.4833","","11.4833","","90","","90","","90","","1514.26","","","","","","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","Majorite","- Al1.252 Mg3.374 O12 Si3.374 -","- Al1.252 Mg3.374 O12 Si3.374 -","- Al10.016 Mg26.992 O96 Si26.992 -","8","0.25","","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.; Ohtaka, O.; Katsura, T.; Ito, E.","Symmetry change of majorite solid-solution in the system Mg3Al2Si3O12-MgSiO3 Sample: x = .38","American Mineralogist","1999","84","","1135","1143","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002194","11.4876","","11.4876","","11.4876","","90","","90","","90","","1515.96","","","","","","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","Majorite","- Al0.96 Mg3.52 O12 Si3.52 -","- Al0.96 Mg3.52 O12 Si3.52 -","- Al7.68 Mg28.16 O96 Si28.16 -","8","0.25","","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.; Ohtaka, O.; Katsura, T.; Ito, E.","Symmetry change of majorite solid-solution in the system Mg3Al2Si3O12-MgSiO3 Sample: x = .52","American Mineralogist","1999","84","","1135","1143","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002195","11.4891","","11.4891","","11.4891","","90","","90","","90","","1516.56","","","","","","","","","","","","","4","I 41/a c d :2","-I 4bd 2c","142","","","Majorite","- Al0.72 Mg3.64 O12 Si3.64 -","- Al0.72 Mg3.64 O12 Si3.64 -","- Al5.76 Mg29.12 O96 Si29.12 -","8","0.25","","Nakatsuka, A.; Yoshiasa, A.; Yamanaka, T.; Ohtaka, O.; Katsura, T.; Ito, E.","Symmetry change of majorite solid-solution in the system Mg3Al2Si3O12-MgSiO3 Sample: x = .64","American Mineralogist","1999","84","","1135","1143","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002196","8.133","","12.773","","7.159","","94.23","","116.64","","87.72","","662.918","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Albite","- Al Na O8 Si3 -","- Al Na O8 Si3 -","- Al4 Na4 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: untreated Note: this sample of feldspar is from Stintino, Sardinia, Italy","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002197","8.141","","12.795","","7.145","","94.04","","116.56","","87.98","","664.049","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Albite","- Al Na O8 Si3 -","- Al Na O8 Si3 -","- Al4 Na4 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1050-3d Note: this sample of feldspar is from Stintino, Sardinia, Italy","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002198","8.17","","12.811","","7.141","","93.79","","116.53","","88.09","","667.248","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Albite","- Al Na O8 Si3 -","- Al Na O8 Si3 -","- Al4 Na4 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1060-6d Note: this sample of feldspar is from Stintino, Sardinia, Italy","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002199","8.14","","12.791","","7.132","","93.94","","116.54","","88.46","","662.748","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Albite","- Al Na O8 Si3 -","- Al Na O8 Si3 -","- Al4 Na4 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1070-7d Note: this sample of feldspar is from Stintino, Sardinia, Italy","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002200","8.142","","12.782","","7.136","","94","","116.51","","88.13","","662.946","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Albite","- Al Na O8 Si3 -","- Al Na O8 Si3 -","- Al4 Na4 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1080-7d Note: this sample of feldspar is from Stintino, Sardinia, Italy","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002201","8.154","","12.794","","7.129","","93.81","","116.54","","88.48","","663.868","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Albite","- Al Na O8 Si3 -","- Al Na O8 Si3 -","- Al4 Na4 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1080-10d Note: this sample of feldspar is from Stintino, Sardinia, Italy","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002202","8.16","","12.802","","7.13","","93.72","","116.42","","88.61","","665.624","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Albite","- Al Na O8 Si3 -","- Al Na O8 Si3 -","- Al4 Na4 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1090-7d Note: this sample of feldspar is from Stintino, Sardinia, Italy","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002203","8.152","","12.831","","7.11","","93.46","","116.52","","89.72","","664.026","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","","Albite","- Al Na O8 Si3 -","- Al Na O8 Si3 -","- Al4 Na4 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1090-12d Note: this sample of feldspar is from Stintino, Sardinia, Italy","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:41:58",""
"9002204","14.767","","5.574","","15.079","","90","","91.96","","90","","1240.44","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","Boralsilite","- Al8 B3 O18.525 Si -","- Al8 B3 O18.525 Si -","- Al32 B12 O74.1 Si4 -","4","0.5","","Peacor, D. R.; Rouse, R. C.; Grew, E. S.","The crystal structure of boralsilite and its relation to a family of boroaluminosilicates, sillimanite, and andalusite","American Mineralogist","1999","84","","1152","1161","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002205","6.9149","","8.5064","","6.4384","","90","","114.684","","90","","344.108","","","","","","","","","","","","","5","A 1 2/a 1","-A 2ya","15","","","Titanite","- Al Ca F O4 Si -","- Al Ca F O4 Si -","- Al4 Ca4 F4 O16 Si4 -","4","0.5","","Troitzsch, U.; Ellis, D. J.","The synthesis and crystal structure of CaAlFSiO4, the Al-F analog of titanite","American Mineralogist","1999","84","","1162","1169","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002206","4.946","","20.502","","7.275","","90","","90","","90","","737.706","","","","","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","Kanemite","- H8 Na O8 Si2 -","- H8 Na O8 Si2 -","- H32 Na4 O32 Si8 -","4","0.5","","Garvie, L. A. J.; Devouard, B.; Groy, T. L.; Camara, F.; Buseck, P. R.","Crystal structure of kanemite, NaHSi2O5.3H2O, from the Aris phonolite, Namibia","American Mineralogist","1999","84","","1170","1175","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002207","9.8929","","17.944","","5.2804","","90","","105.505","","90","","903.254","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.8 Ca1.86 Mg4.34 Na0.94 O24 Si6 -","- Al2.8 Ca1.86 Mg4.34 Na0.94 O24 Si6 -","- Al5.6 Ca3.72 Mg8.68 Na1.88 O48 Si12 -","2","0.25","","Sharma, A.; Jenkins, D. M.","Hydrothermal synthesis of amphiboles along the tremolite-pargasite join and in the ternary system tremolite-pargasite-cummingtonite Sample: PARG 11-7","American Mineralogist","1999","84","","1304","1318","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002208","9.9022","","17.9747","","5.275","","90","","105.384","","90","","905.251","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al2.27 Ca1.7 Mg4.55 Na O24 Si6.48 -","- Al2.27 Ca1.7 Mg4.55 Na O24 Si6.48 -","- Al4.54 Ca3.4 Mg9.1 Na2 O48 Si12.96 -","2","0.25","","Sharma, A.; Jenkins, D. M.","Hydrothermal synthesis of amphiboles along the tremolite-pargasite join and in the ternary system tremolite-pargasite-cummingtonite Sample: PARG 19-11","American Mineralogist","1999","84","","1304","1318","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002209","9.8466","","17.99","","5.2793","","90","","105.099","","90","","902.892","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al1.72 Ca1.84 Mg4.56 Na0.58 O24 Si6.88 -","- Al1.72 Ca1.84 Mg4.56 Na0.58 O24 Si6.88 -","- Al3.44 Ca3.68 Mg9.12 Na1.16 O48 Si13.76 -","2","0.25","","Sharma, A.; Jenkins, D. M.","Hydrothermal synthesis of amphiboles along the tremolite-pargasite join and in the ternary system tremolite-pargasite-cummingtonite Sample: PARG 20-2","American Mineralogist","1999","84","","1304","1318","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002210","9.8184","","18.021","","5.278","","90","","104.829","","90","","902.772","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al1.2 Ca1.68 Mg4.92 Na0.43 O24 Si7.2 -","- Al1.2 Ca1.68 Mg4.92 Na0.43 O24 Si7.2 -","- Al2.4 Ca3.36 Mg9.84 Na0.86 O48 Si14.4 -","2","0.25","","Sharma, A.; Jenkins, D. M.","Hydrothermal synthesis of amphiboles along the tremolite-pargasite join and in the ternary system tremolite-pargasite-cummingtonite Sample: PARG 21-2","American Mineralogist","1999","84","","1304","1318","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002211","9.816","","18.04","","5.2775","","90","","104.741","","90","","903.783","","","","","","","","","","","","","6","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al0.52 Ca1.82 Mg4.98 Na0.14 O24 Si7.68 -","- Al0.52 Ca1.82 Mg4.98 Na0.14 O24 Si7.68 -","- Al1.04 Ca3.64 Mg9.96 Na0.28 O48 Si15.36 -","2","0.25","","Sharma, A.; Jenkins, D. M.","Hydrothermal synthesis of amphiboles along the tremolite-pargasite join and in the ternary system tremolite-pargasite-cummingtonite Sample: PARG 18-3","American Mineralogist","1999","84","","1304","1318","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002212","9.809","","18.054","","5.2763","","90","","104.57","","90","","904.34","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","Tremolite","- Ca1.82 Mg5.18 O24 Si8 -","- Ca1.82 Mg5.18 O24 Si8 -","- Ca3.64 Mg10.36 O48 Si16 -","2","0.25","","Sharma, A.; Jenkins, D. M.","Hydrothermal synthesis of amphiboles along the tremolite-pargasite join and in the ternary system tremolite-pargasite-cummingtonite Sample: PARG 23-13","American Mineralogist","1999","84","","1304","1318","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002213","9.4081","","9.4081","","6.8887","","90","","90","","120","","528.046","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H O13 P3 -","- Ca5 H O13 P3 -","- Ca10 H2 O26 P6 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: H6L, synthetic","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002214","9.4394","","9.4394","","6.8861","","90","","90","","120","","531.365","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H2 O13 P3 -","- Ca5 H2 O13 P3 -","- Ca10 H4 O26 P6 -","2","0.166667","","Wilson, R. M.; Elliot, J. C.; Dowker, S. E. P.","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: H6G, synthetic","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002215","9.4172","","9.4172","","6.8799","","90","","90","","120","","528.392","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H2 O13 P3 -","- Ca5 H2 O13 P3 -","- Ca10 H4 O26 P6 -","2","0.166667","","Wilson, R. M.; Elliot, J. C.; Dowker, S. E. P.","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: H6M, synthetic","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002216","9.4232","","9.4232","","6.8833","","90","","90","","120","","529.327","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","Hydroxylapatite","- Ca5 H2 O13 P3 -","- Ca5 H2 O13 P3 -","- Ca10 H4 O26 P6 -","2","0.166667","","Wilson, R. M.; Elliot, J. C.; Dowker, S. E. P.","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: Prep.63b, synthetic","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002217","9.4623","","9.4623","","6.8863","","90","","90","","120","","533.962","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H1.16 Mg0.05 Na0.1 O11.88 P2.76 -","- Ca4.73 H1.16 Mg0.05 Na0.1 O11.88 P2.76 -","- Ca9.46 H2.32 Mg0.1 Na0.2 O23.76 P5.52 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RC1 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002218","9.4512","","9.4512","","6.8803","","90","","90","","120","","532.245","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H2 Mg0.05 Na0.1 O11.99 P2.79 -","- Ca4.73 H2 Mg0.05 Na0.1 O11.99 P2.79 -","- Ca9.46 H4 Mg0.1 Na0.2 O23.98 P5.58 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RC7 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002219","9.4343","","9.4343","","6.8681","","90","","90","","120","","529.403","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.7 H0.46 Mg0.05 Na0.1 O12.51 P2.61 -","- Ca4.7 H0.46 Mg0.05 Na0.1 O12.51 P2.61 -","- Ca9.4 H0.92 Mg0.1 Na0.2 O25.02 P5.22 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RC8 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002220","9.4564","","9.4564","","6.8821","","90","","90","","120","","532.971","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H1.76 Mg0.02 Na0.1 O11.81 P2.79 -","- Ca4.73 H1.76 Mg0.02 Na0.1 O11.81 P2.79 -","- Ca9.46 H3.52 Mg0.04 Na0.2 O23.62 P5.58 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RE1 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002221","9.4598","","9.4598","","6.8865","","90","","90","","120","","533.695","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H1.58 Mg0.02 Na0.1 O11.73 P2.79 -","- Ca4.73 H1.58 Mg0.02 Na0.1 O11.73 P2.79 -","- Ca9.46 H3.16 Mg0.04 Na0.2 O23.46 P5.58 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RE2 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002222","9.4592","","9.4592","","6.8816","","90","","90","","120","","533.248","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.7 H1.24 Mg0.02 Na0.1 O12.2 P2.73 -","- Ca4.7 H1.24 Mg0.02 Na0.1 O12.2 P2.73 -","- Ca9.4 H2.48 Mg0.04 Na0.2 O24.4 P5.46 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RFP - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002223","9.4586","","9.4586","","6.8811","","90","","90","","120","","533.141","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.76 H1.78 Mg0.02 Na0.1 O12.04 P2.85 -","- Ca4.76 H1.78 Mg0.02 Na0.1 O12.04 P2.85 -","- Ca9.52 H3.56 Mg0.04 Na0.2 O24.08 P5.7 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RFB - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002224","9.4554","","9.4554","","6.8835","","90","","90","","120","","532.966","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.76 H1.62 Mg0.02 Na0.1 O12.25 P2.82 -","- Ca4.76 H1.62 Mg0.02 Na0.1 O12.25 P2.82 -","- Ca9.52 H3.24 Mg0.04 Na0.2 O24.5 P5.64 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RGP - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002225","9.4506","","9.4506","","6.878","","90","","90","","120","","532","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.76 H2 Mg0.05 Na0.1 O12.27 P2.85 -","- Ca4.76 H2 Mg0.05 Na0.1 O12.27 P2.85 -","- Ca9.52 H4 Mg0.1 Na0.2 O24.54 P5.7 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RGB - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002226","9.4586","","9.4586","","6.8809","","90","","90","","120","","533.126","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H1.46 Mg0.02 Na0.1 O12.85 P2.76 -","- Ca4.73 H1.46 Mg0.02 Na0.1 O12.85 P2.76 -","- Ca9.46 H2.92 Mg0.04 Na0.2 O25.7 P5.52 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RHP - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002227","9.4616","","9.4616","","6.8819","","90","","90","","120","","533.541","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.73 H1.1 Mg0.02 Na0.1 O12.36 P2.85 -","- Ca4.73 H1.1 Mg0.02 Na0.1 O12.36 P2.85 -","- Ca9.46 H2.2 Mg0.04 Na0.2 O24.72 P5.7 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RHB - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002228","9.4584","","9.4584","","6.8808","","90","","90","","120","","533.095","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","","Hydroxylapatite-dental","- Ca4.7 H2 Mg0.02 Na0.1 O12.09 P2.76 -","- Ca4.7 H2 Mg0.02 Na0.1 O12.09 P2.76 -","- Ca9.4 H4 Mg0.04 Na0.2 O24.18 P5.52 -","2","0.166667","","Wilson R M; Elliot J C; Dowker S E P","Rietveld refinement of the crystallographic structure of human dental enamel apatites Sample: RQ1 - enamel","American Mineralogist","1999","84","","1406","1414","","","","","","","","","","","","","","","","","","","","","","has coordinates","293656","2024-08-03","07:57:20",""
"9002229","5.368","","9.297","","14.215","","89.86","","97.15","","89.98","","703.899","","","","","","","","","","","","chromian clinochlore-IIb-4","6","C -1","-C 1","2","","","Clinochlore","- Al0.99 H2 I12 Mg2.97 O12 Si3.04 -","- Al0.99 H2 I12 Mg2.97 O12 Si3.04 -","- Al1.98 H4 I24 Mg5.94 O24 Si6.08 -","2","","","Guggenheim, S.; Zhan, W.","Crystal structures of two partially dehydrated chlorites: The ""modified"" chlorite structure","American Mineralogist","1999","84","","1415","1421","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002230","5.372","0.001","9.291","0.002","14.27","0.007","90","","97.34","0.03","90","","706.4","0.4","","","","","","","","","","","chromian clinochlore-IIb-2","6","C 1 2/m 1","-C 2y","12","","","Clinochlore","- Al0.99 H2 Mg2.97 O12 Si3.04 X12 -","- Al0.99 H2 Mg2.97 O12 Si3.04 X12 -","- Al1.98 H4 Mg5.94 O24 Si6.08 X24 -","2","0.25","","Guggenheim, S.; Zhan, W.","Crystal structures of two partially dehydrated chlorites: The ""modified"" chlorite structure","American Mineralogist","1999","84","","1415","1421","","","","","","","","","","","","","","","","","","","","","","has coordinates","288043","2023-12-05","16:05:09",""
"9002231","13.267","","13.267","","6.6023","","90","","90","","90","","1162.09","","","","","","","","","","","","","5","I -4 2 d","I -4 2bw","122","","","Gonnardite","- Al2.15 Ca0.46 Na1.16 O13.4 Si2.85 -","- Al2.15 Ca0.46 Na1.16 O13.4 Si2.85 -","- Al8.6 Ca1.84 Na4.64 O53.6 Si11.4 -","4","0.25","","Artioli, G.; Galli, E.","Gonnardite: Re-examination of holotype material, and discreditation of tetranatrolite","American Mineralogist","1999","84","","1445","1450","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002232","11.2706","","7.1055","","20.807","","90","","90","","90","","1666.29","","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","Wyartite","- C H15 Ca O19 U3 -","- C H15 Ca O19 U3 -","- C4 H60 Ca4 O76 U12 -","4","1","","Burns, P. C.; Finch, R. J.","Wyartite: Crystallographic evidence for the first pentavalent-uranium mineral","American Mineralogist","1999","84","","1456","1460","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002233","13.006","","8.808","","5.85","","90","","90.34","","90","","670.146","","","","","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","Ilvaite","- Al0.04 Ca Fe2.88 H Mg0.03 Mn0.05 O9 Si2 -","- Al0.04 Ca Fe2.88 H Mg0.03 Mn0.05 O9 Si2 -","- Al0.16 Ca4 Fe11.52 H4 Mg0.12 Mn0.2 O36 Si8 -","4","1","","Bonazzi, P.; Bindi, L.","Structural adjustments induced by heat treatment in ilvaite Sample: RM at room temperature","American Mineralogist","1999","84","","1604","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002234","13.015","","8.803","","5.842","","90","","90.16","","90","","669.321","","","","673.15","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","Ilvaite","- Al0.04 Ca Fe2.88 H Mg0.03 Mn0.05 O9 Si2 -","- Al0.04 Ca Fe2.88 H Mg0.03 Mn0.05 O9 Si2 -","- Al0.16 Ca4 Fe11.52 H4 Mg0.12 Mn0.2 O36 Si8 -","4","1","","Bonazzi, P.; Bindi, L.","Structural adjustments induced by heat treatment in ilvaite Sample: RM at T = 400 deg C","American Mineralogist","1999","84","","1604","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002235","13.014","","8.807","","5.846","","90","","90.1","","90","","670.034","","","","723.15","","","","","","","","","8","P 1 21/a 1","-P 2yab","14","","","Ilvaite","- Al0.04 Ca Fe2.88 H Mg0.03 Mn0.05 O9 Si2 -","- Al0.04 Ca Fe2.88 H Mg0.03 Mn0.05 O9 Si2 -","- Al0.16 Ca4 Fe11.52 H4 Mg0.12 Mn0.2 O36 Si8 -","4","1","","Bonazzi, P.; Bindi, L.","Structural adjustments induced by heat treatment in ilvaite Sample: RM at T = 450 deg C","American Mineralogist","1999","84","","1604","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002236","13.005","","8.8","","5.847","","90","","90","","90","","669.154","","","","773.15","","","","","","","","","8","P n a m","-P 2c 2n","62","","","Ilvaite","- Al0.08 Ca Fe2.81 H Mg0.06 Mn0.05 O9 Si2 -","- Al0.08 Ca Fe2.81 H Mg0.06 Mn0.05 O9 Si2 -","- Al0.32 Ca4 Fe11.24 H4 Mg0.24 Mn0.2 O36 Si8 -","4","0.5","","Bonazzi, P.; Bindi, L.","Structural adjustments induced by heat treatment in ilvaite Sample: RM at T = 500 deg C","American Mineralogist","1999","84","","1604","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002237","13.013","","8.802","","5.849","","90","","90","","90","","669.947","","","","823.15","","","","","","","","","8","P n a m","-P 2c 2n","62","","","Ilvaite","- Al0.08 Ca Fe2.81 H Mg0.06 Mn0.05 O9 Si2 -","- Al0.08 Ca Fe2.81 H Mg0.06 Mn0.05 O9 Si2 -","- Al0.32 Ca4 Fe11.24 H4 Mg0.24 Mn0.2 O36 Si8 -","4","0.5","","Bonazzi, P.; Bindi, L.","Structural adjustments induced by heat treatment in ilvaite Sample: RM at T = 550 deg C","American Mineralogist","1999","84","","1604","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002238","13.015","","8.802","","5.847","","90","","90","","90","","669.821","","","","873.15","","","","","","","","","8","P n a m","-P 2c 2n","62","","","Ilvaite","- Al0.08 Ca Fe2.81 H Mg0.06 Mn0.05 O9 Si2 -","- Al0.08 Ca Fe2.81 H Mg0.06 Mn0.05 O9 Si2 -","- Al0.32 Ca4 Fe11.24 H4 Mg0.24 Mn0.2 O36 Si8 -","4","0.5","","Bonazzi, P.; Bindi, L.","Structural adjustments induced by heat treatment in ilvaite Sample: RM at T = 600 deg C","American Mineralogist","1999","84","","1604","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002239","13.012","","8.801","","5.85","","90","","90","","90","","669.934","","","","888.15","","","","","","","","","8","P n a m","-P 2c 2n","62","","","Ilvaite","- Al0.08 Ca Fe2.81 H Mg0.06 Mn0.05 O9 Si2 -","- Al0.08 Ca Fe2.81 H Mg0.06 Mn0.05 O9 Si2 -","- Al0.32 Ca4 Fe11.24 H4 Mg0.24 Mn0.2 O36 Si8 -","4","0.5","","Bonazzi, P.; Bindi, L.","Structural adjustments induced by heat treatment in ilvaite Sample: RM at T = 615 deg C","American Mineralogist","1999","84","","1604","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002240","13.007","","8.805","","5.844","","90","","90","","90","","669.294","","","","898.15","","","","","","","","","7","P n a m","-P 2c 2n","62","","","Ilvaite","- Al0.08 Ca Fe2.81 Mg0.06 Mn0.05 O9 Si2 -","- Al0.08 Ca Fe2.81 Mg0.06 Mn0.05 O9 Si2 -","- Al0.32 Ca4 Fe11.24 Mg0.24 Mn0.2 O36 Si8 -","4","0.5","","Bonazzi, P.; Bindi, L.","Structural adjustments induced by heat treatment in ilvaite Sample: RM at T = 625 deg C","American Mineralogist","1999","84","","1604","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002241","13.008","","8.802","","5.842","","90","","90","","90","","668.888","","","","933.15","","","","","","","","","7","P n a m","-P 2c 2n","62","","","Ilvaite","- Al0.08 Ca Fe2.81 Mg0.06 Mn0.05 O9 Si2 -","- Al0.08 Ca Fe2.81 Mg0.06 Mn0.05 O9 Si2 -","- Al0.32 Ca4 Fe11.24 Mg0.24 Mn0.2 O36 Si8 -","4","0.5","","Bonazzi, P.; Bindi, L.","Structural adjustments induced by heat treatment in ilvaite Sample: RM at T = 660 deg C","American Mineralogist","1999","84","","1604","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002242","13.013","","8.804","","5.841","","90","","90","","90","","669.183","","","","948.15","","","","","","","","","7","P n a m","-P 2c 2n","62","","","Ilvaite","- Al0.08 Ca Fe2.81 Mg0.06 Mn0.05 O9 Si2 -","- Al0.08 Ca Fe2.81 Mg0.06 Mn0.05 O9 Si2 -","- Al0.32 Ca4 Fe11.24 Mg0.24 Mn0.2 O36 Si8 -","4","0.5","","Bonazzi, P.; Bindi, L.","Structural adjustments induced by heat treatment in ilvaite Sample: RM at T = 675 deg C","American Mineralogist","1999","84","","1604","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002243","13.006","","8.804","","5.836","","90","","90","","90","","668.25","","","","973.15","","","","","","","","","7","P n a m","-P 2c 2n","62","","","Ilvaite","- Al0.08 Ca Fe2.81 Mg0.06 Mn0.05 O9 Si2 -","- Al0.08 Ca Fe2.81 Mg0.06 Mn0.05 O9 Si2 -","- Al0.32 Ca4 Fe11.24 Mg0.24 Mn0.2 O36 Si8 -","4","0.5","","Bonazzi, P.; Bindi, L.","Structural adjustments induced by heat treatment in ilvaite Sample: RM at T = 700 deg C","American Mineralogist","1999","84","","1604","1612","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002244","11.274","","7.344","","11.468","","99.18","","97.19","","90.03","","929.772","","","","","","","","","","","","","4","C 1","C 1","1","","","Clinotobermorite","- Ca5 H8 O21 Si6 -","- Ca5 H8 O21 Si6 -","- Ca10 H16 O42 Si12 -","2","","","Merlino, S.; Bonaccorsi, E.; Armbruster, T.","Tobermorites: Their real structure and order-disorder (OD) character","American Mineralogist","1999","84","","1613","1621","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002245","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","- Ca3 H O9 Si3 -","- Ca3 H O9 Si3 -","- Ca12 H4 O36 Si12 -","4","","","Merlino, S.; Bonaccorsi, E.; Armbruster, T.","Tobermorites: Their real structure and order-disorder (OD) character Sample: 9 Angstrom","American Mineralogist","1999","84","","1613","1621","","","","","","","","","","","","","","","","","","","","","","has coordinates","287550","2023-11-11","17:51:29",""
"9002246","6.735","","7.385","","22.487","","90","","90","","123.25","","935.351","","","","","","","","","","","","","4","B 1 1 m","B -2","8","","","Tobermorite","- Ca2 H6 O11 Si3 -","- Ca2 H6 O11 Si3 -","- Ca8 H24 O44 Si12 -","4","1","","Merlino, S.; Bonaccorsi, E.; Armbruster, T.","Tobermorites: Their real structure and order-disorder (OD) character Sample: 11 Angstrom","American Mineralogist","1999","84","","1613","1621","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:35",""
"9002247","16.115","","14.371","","11.254","","90","","90.9","","90","","2605.98","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","Khmaralite","- Al14.27 Be1.47 Fe1.99 Mg5.47 O40 Si4.8 -","- Al14.27 Be1.47 Fe1.99 Mg5.47 O40 Si4.8 -","- Al57.08 Be5.88 Fe7.96 Mg21.88 O160 Si19.2 -","4","1","","Barbier, J.; Grew, E. S.; Moore, P. B.; Su, S.-C.","Khmaralite, a new beryllium-bearing mineral related to sapphirine: A superstructure resulting from partial ordering of Be, Al and Si on tetrahedral sites","American Mineralogist","1999","84","","1650","1660","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9002248","14.131","","13.885","","55.969","","90","","90","","90","","10981.6","","","","","","","","","","","","","5","C m c m","-C 2c 2","63","","","Wolsendorfite","- Ba0.72 H40.16 O126 Pb12.32 U28 -","- Ba0.72 H56 O126 Pb12.32 U28 -","- Ba2.88 H224 O504 Pb49.28 U112 -","4","0.25","","Burns, P. C.","A new complex sheet of uranyl polyhedra in the structure of wolsendorfite","American Mineralogist","1999","84","","1661","1673","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:38:57",""
"9002249","12.559","","12.834","","11.714","","90","","90","","90","","1888.09","","","","","","","","","","","","","10","P c a b","-P 2bc 2ac","61","","","Bederite","- Al0.09 Ca1.03 Fe0.94 H2 Mg0.44 Mn1.89 Na0.1 O13 P3 Zn0.02 -","- Al0.09 Ca1.03 Fe0.94 H2 Mg0.44 Mn1.89 Na0.1 O13 P3 Zn0.02 -","- Al0.72 Ca8.24 Fe7.52 H16 Mg3.52 Mn15.12 Na0.8 O104 P24 Zn0.16 -","8","1","","Galliski, M. A.; Cooper, M. A.; Hawthorne, F. C.; Cerny, P.","Bederite, a new pegmatite phosphate mineral from Nevados de Palermo, Argentina: Description and crystal structure","American Mineralogist","1999","84","","1674","1679","","","","","","","","","","","","","","","","","","","","","","has coordinates","294032","2024-08-07","19:11:21",""
"9002250","11.8322","","6.8624","","10.5297","","90","","111.245","","90","","796.878","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","Pseudowollastonite","- Ca O3 Si -","- Ca O3 Si -","- Ca12 O36 Si12 -","12","1.5","","Yang, H.; Prewitt, C. T.","Crystal structure and compressibility of a two-layer polytype of pseudowollastonite (CaSiO3)","American Mineralogist","1999","84","","1902","1905","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002251","8.5758","","5.7295","","18.5376","","90","","97.691","","90","","902.652","","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Al5.01 Mg4.76 O28 Si6 -","- Al5.01 Mg4.76 O28 Si6 -","- Al10.02 Mg9.52 O56 Si12 -","2","0.5","","Artioli, G.; Fumagalli, P.; Poli, S.","The crystal structure of Mg8(Mg2Al2)Al8Si12(O,OH)56 pumpellyite and its relevance in ultramafic systems at high pressure","American Mineralogist","1999","84","","1906","1914","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002252","5.1627","","5.1627","","8.706","","90","","90","","120","","200.957","","","","","","","","","","","","","4","P 63","P 6c","173","","","Kalsilite","- Al K O4 Si -","- Al K O4 Si -","- Al2 K2 O8 Si2 -","2","0.333333","","Cellai, D.; Gesing, T. M.; Wruck, B.; Carpenter, M. A.","X-ray study of the trigonal-hexagonal phase transition in metamorphic kalsilite","American Mineralogist","1999","84","","1950","1955","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:42",""
"9002505","10.873","","10.5516","","7.4287","","90","","109.74","","90","","802.192","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","Cuspidine","- Ca1.005 F Na0.995 O3.5 P -","- Ca1.005 F Na0.995 O3.5 P -","- Ca8.04 F8 Na7.96 O28 P8 -","8","2","","Piotrowski, A.; Kahlenberg, V.; Fischer, R. X.","Na2Ca2(P2O7)F2, the first diphosphate of the cuspidine family Sample: split position O1","American Mineralogist","1999","85","","1534","1539","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9004515","5.583","","9.542","","10.219","","109.81","","90.57","","97.71","","506.653","","","","","","","","","","","","","6","P -1","-P 1","2","","","Jamesite","- As4 Fe4.8 H10 O26 Pb4 Zn2.2 -","- As4 Fe4.8 H10 O26 Pb4 Zn2.2 -","- As4 Fe4.8 H10 O26 Pb4 Zn2.2 -","1","0.5","","Cooper, M. A.; Hawthorne, F. C.","Local Pb-_ disorder in the crystal structure of jamesite, Pb2ZnFe2(Fe2.8Zn1.2)(AsO4)4(OH)8[(OH)1.2O.8], and revision of the chemical formula","The Canadian Mineralogist","1999","37","","53","60","","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:43",""
"9004516","19.531","","11.061","","15.257","","90","","131.57","","90","","2465.89","","","","","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","Betpakdalite","- As2 Ca2 Fe3 H73 Mg Mo8 O60 -","- As2 Ca2 Fe3 H47 Mg Mo8 O60 -","- As4 Ca4 Fe6 H94 Mg2 Mo16 O120 -","2","0.25","","Cooper, M. A.; Hawthorne, F. C.","The crystal structure of betpakdalite, and a new chemical formula: {Mg(H2O)6}Ca2(H2O)13[Mo8As2Fe3O36(OH)](H2O)4","The Canadian Mineralogist","1999","37","","61","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004517","9.687","","10.7379","","5.5523","","90","","105.32","","90","","557.017","","","","","","","","","","","","La Esperanza mine, Mexico","7","P 1 21/m 1","-P 2yb","11","","","Esperanzaite","- Al2 As2 Ca2 F4 H5 Na0.68 O11 -","- Al2 As2 Ca2 F4 H5 Na0.68 O11 -","- Al4 As4 Ca4 F8 H10 Na1.36 O22 -","2","0.5","","Foord, E. E.; Hughes, J. M.; Cureton, F. E.; Maxwell, C. H.; Falster, A. U.; Sommer, A. J.; Hlava, P. F.","Esperanzaite, NaCa2Al2(AsO4)2F4(OH).2H2O, a new mineral species from the La Esperanza mine, Mexico: Descriptive mineralogy and atomic arrangement","The Canadian Mineralogist","1999","37","","67","72","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004518","11.938","","32.854","","11.017","","90","","90","","90","","4320.99","","","","","","","","","","","","","6","F d d 2","F 2 -2d","43","","","Wooldridgeite","- Ca Cu2 H20 Na2 O24 P4 -","- Ca Cu2 H20 Na2 O24 P4 -","- Ca8 Cu16 H160 Na16 O192 P32 -","8","0.5","","Cooper, M. A.; Hawthorne, F. C.","The crystal structure of wooldridgeite, Na2CaCu2(P2O7)2(H2O)10, a novel copper pyrophosphate mineral","The Canadian Mineralogist","1999","37","","73","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004519","7.0179","","7.0179","","40.56","","90","","90","","120","","1729.99","","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","Nacaphite","- Ca5 F5 Na10 O20 P5 -","- Ca4.99995 F5 Na10 O20 P5 -","- Ca14.9998 F15 Na30.0001 O60 P15 -","3","0.166667","","Sokolova, E. V.; Kabalov, Y. K.; Ferraris, G.; Schneider, J.; Khomyakov, A. P.","Modular approach in solving the crystal structure of a synthetic dimorph of nacaphite, Na2Ca[PO4]F, from powder-diffraction data","The Canadian Mineralogist","1999","37","","83","90","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004520","7.5283","","14.8325","","7.4629","","90","","118.746","","90","","730.634","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","Edoylerite","- Cr Hg3 O4 S2 -","- Cr Hg3 O4 S2 -","- Cr4 Hg12 O16 S8 -","4","1","","Burns, P. C.","The structure of edoylerite determined from a microcrystal","The Canadian Mineralogist","1999","37","","113","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:43",""
"9004521","19.009","","9.018","","16.848","","90","","110.82","","90","","2699.55","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","Poyarkovite","- Cl Hg3 O -","- Cl Hg3 O -","- Cl24 Hg72 O24 -","24","3","","Vasil'ev, V. I.; Pervukhina, N. V.; Romanenko, G. V.; Magarill, S. A.; Borisov, S. V.","New data on the mercury oxide-chloride mineral poyarkovite: The second find, and crystal-structure determination","The Canadian Mineralogist","1999","37","","119","126","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004522","5.3346","","9.2417","","10.182","","90","","100.26","","90","","493.954","","","","","","","","","","","","Silver Crater mine, Ontario, Canada","11","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.02 F0.94 Fe1.23 H1.06 K0.92 Mg1.62 Mn0.06 Na0.08 O11.06 Si2.98 Ti0.09 -","- Al1.02 F0.94 Fe1.23 H1.06 K0.92 Mg1.62 Mn0.06 Na0.08 O11.06 Si2.98 Ti0.09 -","- Al2.04 F1.88 Fe2.46 H2.12 K1.84 Mg3.24 Mn0.12 Na0.16 O22.12 Si5.96 Ti0.18 -","2","0.25","","Russell, R. L.; Guggenheim, S.","The crystal structures of near-end-member phlogopite at high temperatures and heat-treated Fe-rich phlogopite: The influence of the O, OH, F site Note: untreated, room temperature, Fe-rich phlogopite","The Canadian Mineralogist","1999","37","","711","720","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004523","5.3099","","9.185","","10.093","","90","","100.07","","90","","484.667","","","","","","","","","","heat-treated at 904 degrees C for 24 hours","","Silver Crater mine, Ontario, Canada","11","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.004 F0.94 Fe1.17 H1.06 K0.92 Mg1.56 Mn0.06 Na0.04 O11.06 Si2.972 Ti0.144 -","- Al1.004 F0.94 Fe1.17 H1.06 K0.92 Mg1.56 Mn0.06 Na0.04 O11.06 Si2.972 Ti0.144 -","- Al2.008 F1.88 Fe2.34 H2.12 K1.84 Mg3.12 Mn0.12 Na0.08 O22.12 Si5.944 Ti0.288 -","2","0.25","","Russell, R. L.; Guggenheim, S.","The crystal structures of near-end-member phlogopite at high temperatures and heat-treated Fe-rich phlogopite: The influence of the O,OH,F site Sample: heat-treated at 904 degrees C for 24 hours, Fe-rich phlogopite","The Canadian Mineralogist","1999","37","","711","720","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004524","5.303","","9.1805","","10.2483","","90","","100.05","","90","","491.275","","","","293.15","","","","","","heat-treated Fe-rich phlogopite: The influence of the O, OH, F site Sample: T = 20 deg C","","White Well, Australia","9","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.711 F0.068 Fe0.12 H1.932 K0.82 Mg2.28 Na0.115 O11.932 Si2.784 -","- Al1.711 F0.068 Fe0.12 H1.932 K0.82 Mg2.28 Na0.115 O11.932 Si2.784 -","- Al3.422 F0.136 Fe0.24 H3.864 K1.64 Mg4.56 Na0.23 O23.864 Si5.568 -","2","0.25","","Russell, R. L.; Guggenheim, S.","The crystal structures of near-end-member phlogopite at high temperatures and heat-treated Fe-rich phlogopite: The influence of the O, OH, F site Sample: T = 20 deg C","The Canadian Mineralogist","1999","37","","711","720","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004525","5.3193","","9.207","","10.286","","90","","100.042","","90","","496.037","","","","573.15","","","","","","heat-treated Fe-rich phlogopite: The influence of the O, OH, F site Sample: T = 300 deg C","","White Well, Australia","9","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.711 F0.068 Fe0.12 H1.932 K0.82 Mg2.28 Na0.115 O11.932 Si2.784 -","- Al1.711 F0.068 Fe0.12 H1.932 K0.82 Mg2.28 Na0.115 O11.932 Si2.784 -","- Al3.422 F0.136 Fe0.24 H3.864 K1.64 Mg4.56 Na0.23 O23.864 Si5.568 -","2","0.25","","Russell, R. L.; Guggenheim, S.","The crystal structures of near-end-member phlogopite at high temperatures and heat-treated Fe-rich phlogopite: The influence of the O, OH, F site Sample: T = 300 deg C","The Canadian Mineralogist","1999","37","","711","720","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004526","5.3331","","9.2316","","10.3159","","90","","100.004","","90","","500.161","","","","723.15","","","","","","heat-treated Fe-rich phlogopite: The influence of the O, OH, F site Sample: T = 450 deg C","","White Well, Australia","9","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.711 F0.068 Fe0.12 H1.932 K0.82 Mg2.28 Na0.115 O11.932 Si2.784 -","- Al1.711 F0.068 Fe0.12 H1.932 K0.82 Mg2.28 Na0.115 O11.932 Si2.784 -","- Al3.422 F0.136 Fe0.24 H3.864 K1.64 Mg4.56 Na0.23 O23.864 Si5.568 -","2","0.25","","Russell, R. L.; Guggenheim, S.","The crystal structures of near-end-member phlogopite at high temperatures and heat-treated Fe-rich phlogopite: The influence of the O, OH, F site Sample: T = 450 deg C","The Canadian Mineralogist","1999","37","","711","720","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004527","5.342","","9.238","","10.357","","90","","99.99","","90","","503.362","","","","873.15","","","","","","heat-treated Fe-rich phlogopite: The influence of the O, OH, F site Sample: T = 600 deg C","","White Well, Australia","9","C 1 2/m 1","-C 2y","12","","","Phlogopite","- Al1.711 F0.068 Fe0.12 H1.932 K0.82 Mg2.28 Na0.115 O11.932 Si2.784 -","- Al1.711 F0.068 Fe0.12 H1.932 K0.82 Mg2.28 Na0.115 O11.932 Si2.784 -","- Al3.422 F0.136 Fe0.24 H3.864 K1.64 Mg4.56 Na0.23 O23.864 Si5.568 -","2","0.25","","Russell, R. L.; Guggenheim, S.","The crystal structures of near-end-member phlogopite at high temperatures and heat-treated Fe-rich phlogopite: The influence of the O, OH, F site Sample: T = 600 deg C","The Canadian Mineralogist","1999","37","","711","720","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004528","12.52","","12.52","","12.52","","90","","90","","90","","1962.52","","","","","","","","","","","","","7","P 41 3 2","P 4bd 2ab 3","213","","","Choloalite","- Ca0.3 Cl0.92 Cu2.79 O18 Pb2.7 Sb0.21 Te6 -","- Ca0.3 Cl0.92 Cu2.79 O18 Pb2.7 Sb0.21 Te6 -","- Ca1.2 Cl3.68 Cu11.16 O72 Pb10.8 Sb0.84 Te24 -","4","0.166667","","Lam, A. E.; Groat, L. A.; Grice, J. D.; Ercit, T. S.","The crystal structure of choloalite","The Canadian Mineralogist","1999","37","","721","729","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004529","15.533","","15.533","","11.785","","90","","90","","90","","2843.42","","","","","","","","","","","","","9","P 4/n n c :2","-P 4a 2bc","126","","","Vesuvianite","- Al4.36 Ca10 F0.72 Fe0.89 H5 Mg1.67 O38.28 Si9 Ti0.08 -","- Al4.36 Ca10 F0.72 Fe0.89 H5 Mg1.67 O38.28 Si9 Ti0.08 -","- Al17.44 Ca40 F2.88 Fe3.56 H20 Mg6.68 O153.12 Si36 Ti0.32 -","4","0.25","","Lager, G. A.; Xie, Q.; Ross, F. K.; Rossman, G. R.; Armbruster, T.; Rotella, F. J.; Schultz, A. J.","Hydrogen-atom positions in P4/nnc vesuvianite","The Canadian Mineralogist","1999","37","","763","768","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004530","10.262","","10.262","","14.307","","90","","90","","120","","1304.8","","","","","","","","","","","","","11","P 6/m c c","-P 6 2c","192","","","Darapiozite","- Fe0.33 K1.36 Li1.53 Mg0.04 Mn1.46 Na1.22 O30 Si12 Y0.22 Zn1.14 Zr0.28 -","- Fe0.33 K1.36 Li1.53 Mg0.04 Mn1.46 Na1.22 O30 Si12 Y0.22 Zn1.14 Zr0.28 -","- Fe0.66 K2.72 Li3.06 Mg0.08 Mn2.92 Na2.44 O60 Si24 Y0.44 Zn2.28 Zr0.56 -","2","0.0833333","","Ferraris, G.; Prencipe, M.; Puatov, L. A.; Sokolova, E. V.","The crystal structure of darapiosite and a comparison with Li- and Zn-bearing minerals of the milarite group","The Canadian Mineralogist","1999","37","","769","774","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:07",""
"9004531","11.796","","13.89","","6.471","","90","","90","","90","","1060.25","","","","","","","","","","","","","3","P b m a","-P 2a 2ab","57","","","Hanawaltite","- Cl2 Hg7 O3 -","- Cl2 Hg7 O3 -","- Cl8 Hg28 O12 -","4","0.5","","Grice, J. D.","Redetermination of the crystal structure of hanawaltite","The Canadian Mineralogist","1999","37","","775","778","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004532","14.1273","","14.1273","","14.1273","","90","","90","","90","","2819.53","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","","Bideauxite","- Ag Cl3 F H0.36 O Pb2 -","- Ag Cl3 F H O Pb2 -","- Ag16 Cl48 F16 H16 O16 Pb32 -","16","0.0833333","","Cooper M A; Hawthorne F C; Merlino S; Pasero M; Perchiazzi N","Stereoactive lone-pair behavior of Pb in the crystal structure of bideauxite: Pb2AgCl3F(OH) Sample: CH","The Canadian Mineralogist","1999","37","","915","921","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004533","14.1376","","14.1376","","14.1376","","90","","90","","90","","2825.71","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","","Bideauxite","- Ag Cl3 F H0.36 O Pb2 -","- Ag Cl3 F H O Pb2 -","- Ag16 Cl48 F16 H16 O16 Pb32 -","16","0.0833333","","Cooper M A; Hawthorne F C; Merlino S; Pasero M; Perchiazzi N","Stereoactive lone-pair behavior of Pb in the crystal structure of bideauxite: Pb2AgCl3F(OH) Sample MPP","The Canadian Mineralogist","1999","37","","915","921","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004534","3.7976","","3.7976","","13.569","","90","","90","","90","","195.689","","","","","","","","","","","","","5","P m m n :2","-P 2ab 2a","59","","","Kettnerite","- C Bi Ca F O4 -","- C Bi Ca F O4 -","- C2 Bi2 Ca2 F2 O8 -","2","0.25","","Grice, J. D.; Cooper, M. A.; Hawthorne, F. C.","Crystal-structure determination of twinned kettnerite","The Canadian Mineralogist","1999","37","","923","927","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004535","4.84","","9.273","","4.298","","90","","90","","90","","192.9","","","","","","","","","","","","","3","I m m 2","I 2 -2","44","","","Rutherfordine","- C O5 U -","- C O5 U -","- C2 O10 U2 -","2","0.25","","Finch, R. J.; Cooper, M. A.; Hawthorne, F. C.; Ewing, R. C.","Refinement of the crystal structure of rutherfordine","The Canadian Mineralogist","1999","37","","929","938","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004536","9.2411","","12.2948","","3.0213","","90","","90","","90","","343.272","","","","","","","","","","","","Crestmore quarry, California, USA","5","P b a m","-P 2 2ab","55","","","Ludwigite","- Al0.08 B Fe1.214 Mg1.707 O5 -","- Al0.08 B Fe1.2135 Mg1.7065 O5 -","- Al0.32 B4 Fe4.854 Mg6.826 O20 -","4","0.5","","Irwin, M. B.; Peterson, R. C.","The crystal structure of ludwigite","The Canadian Mineralogist","1999","37","","939","943","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004537","11.011","","11.011","","11.011","","90","","90","","90","","1335","","","","","","","","","","","","Wendy Open Pit, El Indio-Tambo Mining Property, Chile","5","I a -3","-I 2b 2c 3","206","","","Walfordite","- Fe0.59 Mg0.05 O8 Te3.28 Ti0.08 -","- Fe0.59 Mg0.05 O8 Te3.28 Ti0.08 -","- Fe4.72 Mg0.4 O64 Te26.24 Ti0.64 -","8","0.166667","","Back, M. E.; Grice, J. D.; Gault, R. A.; Criddle, A. J.; Mandarino, J. A.","Walforite, a new tellurite species from the Wendy Open Pit, El Indio-Tambo Mining Property, Chile","The Canadian Mineralogist","1999","37","","1261","1268","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9004538","7.455","","6.496","","11.207","","114.33","","89.65","","88.69","","494.327","","","","","","","","","","","","","4","P -1","-P 1","2","","","Sidpietersite","- H2 O7 Pb4 S2 -","- H2 O7 Pb4 S2 -","- H4 O14 Pb8 S4 -","2","1","","Cooper, M. A.; Hawthorne, F. C.","The structure topology of sidpietersite, Pb4(SO3S)O2(OH)2, a novel thiosulfate structure","The Canadian Mineralogist","1999","37","","1275","1282","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004539","14.1241","","14.1241","","22.4073","","90","","90","","120","","3871.17","","","","","","","","","","","","","4","R 3 :H","R 3","146","","","","- Cs3 H19 O47 U12 -","- Cs3 H19 O47 U12 -","- Cs9 H57 O141 U36 -","3","0.333333","","Hill, F. C.; Burns, P. C.","The structure of a synthetic Cs uranyl oxide hydrate and its relationship to compreignacite","The Canadian Mineralogist","1999","37","","1283","1288","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37",""
"9004540","6.2261","","6.2261","","12.28","","90","","90","","120","","412.25","","","","","","","","","","","","","4","P 63 2 2","P 6c 2c","182","","","Calciotantite","- Ca Nb1.179 O11 Ta2.821 -","- Ca Nb1.179 O11 Ta2.821 -","- Ca2 Nb2.358 O22 Ta5.642 -","2","0.166667","","Cooper, M. A.; Hawthorne, F. C.; Cerny, P.","Ta-Nb order in the crystal structure of niobium-rich calciotantite","The Canadian Mineralogist","1999","37","","1289","1294","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004541","15.973","","15.973","","7.137","","90","","90","","120","","1576.95","","","","","","","","","","","","","11","R 3 m :H","R 3 -2""","160","","","Foitite","- Al6.99 B2.88 Ca0.002 F0.11 Fe1.71 H4 K0.002 Mg0.3 Na0.414 O30.89 Si6 -","- Al6.99 B2.88 Ca0.002 F0.11 Fe1.71 H3.54 K0.002 Mg0.3 Na0.414 O30.89 Si6 -","- Al20.97 B8.64 Ca0.006 F0.33 Fe5.13 H10.62 K0.006 Mg0.9 Na1.242 O92.67 Si18 -","3","0.166667","","Francis C A; Dyar M D; Williams M L; Hughes J M","The occurrence and crystal structure of foitite from a tungsten-bearing vein at Copper Mountain, Taos County, New Mexico Note: y-coordinate of H3 changed to x/2. Locality: Copper Mountain, Taos County, New Mexico","The Canadian Mineralogist","1999","37","","1431","1438","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9004542","5.389","","9.337","","10.054","","90","","100.53","","90","","497.369","","","","","","","","","","","","Broken Hill Mine, South Africa","12","C 1 2/m 1","-C 2y","12","","","Ferrokinoshitalite","- Al1.56 Ba0.56 F0.64 Fe1.95 H1.36 K0.39 Mg0.78 Mn0.09 Na0.05 O11.36 Si2.44 Ti0.18 -","- Al1.56 Ba0.56 F0.64 Fe1.95 H1.36 K0.39 Mg0.78 Mn0.09 Na0.05 O11.36 Si2.44 Ti0.18 -","- Al3.12 Ba1.12 F1.28 Fe3.9 H2.72 K0.78 Mg1.56 Mn0.18 Na0.1 O22.72 Si4.88 Ti0.36 -","2","0.25","","Guggenheim, S.; Frimmel, H. E.","Ferrokinoshitalite, a new species of brittle mica from the Broken Hill Mine, South Africa: Structural and mineralogical characterization","The Canadian Mineralogist","1999","37","","1445","1452","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20",""
"9004543","6.007","","8.368","","9.189","","99.9","","105.55","","107.71","","407.414","","","","","","","","","","","","Alum Cave Bluff, Tennessee, USA","12","P -1","-P 1","2","","","Coskrenite-(Ce)","- C H7 Ce0.53 Eu0.015 Gd0.005 La0.1 Nd0.28 O10 Pr0.045 S Sm0.02 Y0.005 -","- C H7 Ce0.53 Eu0.015 Gd0.005 La0.1 Nd0.28 O10 Pr0.045 S Sm0.02 Y0.005 -","- C2 H14 Ce1.06 Eu0.03 Gd0.01 La0.2 Nd0.56 O20 Pr0.09 S2 Sm0.04 Y0.01 -","2","1","","Peacor, D. R.; Rouse, R. C.; Essene, E. J.; Lauf, R. J.","Coskrenite-(Ce), (Ce,Nd,La)2(SO4)2(C2O4).8H2O, a new rare-earth oxalate mineral from Alum Cave Bluff, Tennessee: Characterization and crystal structure Locality: Alum Cave Bluff, Tennessee, USA","The Canadian Mineralogist","1999","37","","1453","1462","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004544","7.419","","18.859","","6.395","","90","","90","","90","","894.756","","","","","","","","","","","","","16","P 21 c n","P -2n 2a","33","","","Schuilingite-(Nd)","- C3 H3 Cu0.92 Dy0.13 Er0.03 Eu0.06 Gd0.18 La0.04 Nd0.24 O11 Pb Pr0.03 Sm0.12 Tb0.02 Y0.16 Yb0.01 -","- C3 H3 Cu0.92 Dy0.13 Er0.03 Eu0.06 Gd0.18 La0.04 Nd0.24 O11 Pb Pr0.03 Sm0.12 Tb0.02 Y0.16 Yb0.01 -","- C12 H12 Cu3.68 Dy0.52 Er0.12 Eu0.24 Gd0.72 La0.16 Nd0.96 O44 Pb4 Pr0.12 Sm0.48 Tb0.08 Y0.64 Yb0.04 -","4","1","","Schindler M; Hawthorne F C","The crystal structure of schuilingite-(Nd)","The Canadian Mineralogist","1999","37","","1463","1470","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004545","14.236","","8.206","","24.225","","90","","93.52","","90","","2824.64","","","","","","","","","","","","","8","C 1 c 1","C -2yc","9","","","Arakiite","- Al0.74 As3 Fe1.26 H23 Mg4.23 Mn8.06 O34 Zn0.71 -","- Al0.74 As3 Fe1.26 H23 Mg4.23 Mn8.06 O34 Zn0.71 -","- Al2.96 As12 Fe5.04 H92 Mg16.92 Mn32.24 O136 Zn2.84 -","4","1","","Cooper, M. A.; Hawthorne, F. C.","The effect of differences in coordination on ordering of polyvalent cations in close-packed structures: The crystal structure of arakiite and comparison with hematolite","The Canadian Mineralogist","1999","37","","1471","1482","","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:43",""
"9004546","12.241","","7.008","","6.983","","90","","90.402","","90","","599.021","","","","","","","","","","","","","4","P 1 n 1","P -2yac","7","","","Masuyite","- H6 O14 Pb1.05 U3 -","- H8 O14 Pb1.05 U3 -","- H16 O28 Pb2.1 U6 -","2","1","","Burns, P. C.; Hanchar, J. M.","The structure of masuyite, Pb[(UO2)3O3(OH)2](H2O)3, and its relationship to protasite","The Canadian Mineralogist","1999","37","","1483","1491","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9005378","12.061","","4.836","","5.383","","90","","104.6","","90","","303.836","","","","","","","","","","","","Cetine mine, Siena, Italy","2","C 1 2/c 1","-C 2yc","15","","","Clinocervantite","- O2 Sb -","- O2 Sb -","- O16 Sb8 -","8","1","","Basso, R.; Lucchetti, G.; Zefiro, L.; Palenzona, A.","Clinocervantite, B-Sb2O4, the natural monoclinic polymorph of cervantite from the Cetine mine, Siena, Italy Note: z-coordinate to O2 altered by communications with R Basso, April, 2003","European Journal of Mineralogy","1999","11","","95","100","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005379","7.421","","6.754","","13.624","","90","","90","","90","","682.854","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","","Vergasovaite","- Cu3 Mo0.742 O9 S1.258 -","- Cu3 Mo0.742 O9 S1.258 -","- Cu12 Mo2.968 O36 S5.032 -","4","0.5","","Berlepsch, P.; Armbruster, T.; Brugger, J.; Bykova, E. Y.; Kartashov, P. M.","The crystal structure of vergasovaite Cu3O[(Mo,S)O4SO4], and its relation to synthetic Cu3O[MoO4]2","European Journal of Mineralogy","1999","11","","101","110","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005380","4.946","","20.51","","7.277","","90","","90","","90","","738.197","","","","","","","","","","","","","4","P b c n","-P 2n 2ab","60","","","Kanemite","- H6 Na O8 Si2 -","- H6 Na O8 Si2 -","- H24 Na4 O32 Si8 -","4","0.5","","Vortmann, S.; Rius, J.; Marler, B.; Gies, H.","Structure solution from powder data of the hydrous layer silicate kanemite, a precursor of the industrial ion exchanger SKS-6","European Journal of Mineralogy","1999","11","","125","134","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:52:11",""
"9005381","15.88","","15.88","","7.118","","90","","90","","120","","1554.5","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","Liddicoatite","- Al7 B3 Ca0.483 H3.93 K0.105 Li2 Na0.412 O33 Si6 -","- Al6.99999 B3 Ca0.483 H3.99999 K0.105 Li2.00001 Na0.412 O33 Si6 -","- Al21 B9 Ca1.449 H12 K0.315 Li6.00003 Na1.236 O99 Si18 -","3","0.166667","","Aurisicchio C; Demartin F; Ottolini L; Pezzotta F","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 1 Locality: Madagascar","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9005382","15.882","","15.882","","7.115","","90","","90","","120","","1554.23","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","Liddicoatite","- Al7 B3 Ca0.452 H3.93 K0.04 Li2 Na0.435 O33 Si6 -","- Al6.99999 B3 Ca0.452 H3.99999 K0.04 Li2.00001 Na0.435 O33 Si6 -","- Al21 B9 Ca1.356 H12 K0.12 Li6.00003 Na1.305 O99 Si18 -","3","0.166667","","Aurisicchio C; Demartin F; Ottolini L; Pezzotta F","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 2 Locality: Madagascar","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33",""
"9005383","5.21397","","9.0521","","19.9968","","90","","95.736","","90","","939.071","","","","293","","","","","","heating, from powder neutron diffraction, and thermodynamic consequences Sample: T = 293 K","","","9","C 1 2/c 1","-C 2yc","15","","","Phengite","- Al2.43 F0.12 Fe0.34 H1.88 K0.94 Mg0.04 Na0.03 O11.88 Si3.24 -","- Al2.43 F0.12 Fe0.34 H1.88 K0.94 Mg0.04 Na0.03 O11.88 Si3.24 -","- Al9.72 F0.48 Fe1.36 H7.52 K3.76 Mg0.16 Na0.12 O47.52 Si12.96 -","4","0.5","","Pavese, A.; Ferraris, G.; Pischedda, V.; Ibberson, R.","Tetrahedral order in phengite 2M_1 upon heating, from powder neutron diffraction, and thermodynamic consequences Sample: T = 293 K Note: O5 z-coordinate altered.","European Journal of Mineralogy","1999","11","","309","320","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005384","5.23899","","9.1048","","20.244","","90","","95.684","","90","","960.89","","","","873","","","","","","heating, from powder neutron diffraction, and thermodynamic consequences Sample: T = 873 K","","","9","C 1 2/c 1","-C 2yc","15","","","Phengite","- Al2.43 F0.12 Fe0.34 H1.88 K0.94 Mg0.04 Na0.03 O11.88 Si3.24 -","- Al2.43 F0.12 Fe0.34 H1.88 K0.94 Mg0.04 Na0.03 O11.88 Si3.24 -","- Al9.72 F0.48 Fe1.36 H7.52 K3.76 Mg0.16 Na0.12 O47.52 Si12.96 -","4","0.5","","Pavese, A.; Ferraris, G.; Pischedda, V.; Ibberson, R.","Tetrahedral order in phengite 2M_1 upon heating, from powder neutron diffraction, and thermodynamic consequences Sample: T = 873 K","European Journal of Mineralogy","1999","11","","309","320","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005385","9.8535","","18.0154","","5.2752","","90","","104.892","","90","","904.973","","","","","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","Fluoro-edenite","- Al Ca2 F2 Mg5 Na O22 Si7 -","- Al Ca2 F2 Mg5 Na O22 Si7 -","- Al2 Ca4 F4 Mg10 Na2 O44 Si14 -","2","0.25","","Welch, M. D.; Knight, K. S.","A neutron powder diffraction study of cation ordering in high-temperature synthetic amphiboles","European Journal of Mineralogy","1999","11","","321","331","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005386","9.893","","17.937","","5.2802","","90","","105.518","","90","","902.819","","","","","","","","","","","","","7","C 1 2/m 1","-C 2y","12","","","Pargasite","- Al3 Ca2 H2 Mg4 Na O24 Si6 -","- Al3 Ca2 H2 Mg4 Na O24 Si6 -","- Al6 Ca4 H4 Mg8 Na2 O48 Si12 -","2","0.25","","Welch, M. D.; Knight, K. S.","A neutron powder diffraction study of cation ordering in high-temperature synthetic amphiboles","European Journal of Mineralogy","1999","11","","321","331","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005387","25.104","","25.104","","25.104","","90","","90","","90","","15820.8","","","","","","","","","","","","","4","F d -3 :2","-F 2uv 2vw 3","203","","","Faujasite-Na","- Al3 Na2.92 O12 Si3 -","- Al3 Na2.92 O12 Si3 -","- Al96 Na93.44 O384 Si96 -","32","0.333333","","Porcher, F.; Souhassou, M.; Dusausoy, Y.; Lecomte, C.","The crystal structure of a low-silica dehydrated NaX zeolite","European Journal of Mineralogy","1999","11","","333","343","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005388","9.86","","17.984","","5.291","","90","","105.24","","90","","905.218","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Kaersutite","- Al2.512 Ca1.675 Cl0.008 F0.014 H1.356 K0.199 Mg4.13 Na0.889 O23.978 Si6.168 Ti0.43 -","- Al2.512 Ca1.6752 Cl0.008 F0.014 H1.356 K0.1991 Mg4.13 Na0.8888 O23.978 Si6.168 Ti0.43 -","- Al5.024 Ca3.3504 Cl0.016 F0.028 H2.712 K0.3982 Mg8.26 Na1.7776 O47.956 Si12.336 Ti0.86 -","2","0.25","","Tiepolo, M.; Zanetti, A.; Oberti, R.","Detection, crystal-chemical mechanisms and petrological implications of Ti partitioning in pargasite and kaersutite Sample: K1","European Journal of Mineralogy","1999","11","","345","354","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13",""
"9005389","9.906","","18.015","","5.296","","90","","105.35","","90","","911.391","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Kaersutite","- Al2.319 Ca1.742 Cl0.002 F0.014 H1.305 K0.193 Mg4.12 Na0.913 O23.984 Si6.131 Ti0.57 -","- Al2.3188 Ca1.742 Cl0.002 F0.014 H1.305 K0.1931 Mg4.12 Na0.913 O23.984 Si6.1312 Ti0.57 -","- Al4.6376 Ca3.484 Cl0.004 F0.028 H2.61 K0.3862 Mg8.24 Na1.826 O47.968 Si12.2624 Ti1.14 -","2","0.25","","Tiepolo, M.; Zanetti, A.; Oberti, R.","Detection, crystal-chemical mechanisms and petrological implications of Ti4+ partitioning in pargasite and kaersutite Sample: K2","European Journal of Mineralogy","1999","11","","345","354","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13",""
"9005390","9.907","","18.019","","5.304","","90","","105.38","","90","","912.931","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Kaersutite","- Al2.463 Ca1.734 Cl0.002 F0.009 H1.403 K0.226 Mg4.082 Na0.932 O23.989 Si5.967 Ti0.64 -","- Al2.4628 Ca1.734 Cl0.002 F0.009 H1.403 K0.2261 Mg4.082 Na0.9319 O23.989 Si5.9672 Ti0.64 -","- Al4.9256 Ca3.468 Cl0.004 F0.018 H2.806 K0.4522 Mg8.164 Na1.8638 O47.978 Si11.9344 Ti1.28 -","2","0.25","","Tiepolo, M.; Zanetti, A.; Oberti, R.","Detection, crystal-chemical mechanisms and petrological implications of Ti4+ partitioning in pargasite and kaersutite Sample: K3","European Journal of Mineralogy","1999","11","","345","354","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13",""
"9005391","9.903","","17.995","","5.304","","90","","105.44","","90","","911.084","","","","","","","","","","","","","11","C 1 2/m 1","-C 2y","12","","","Kaersutite","- Al2.61 Ca1.789 Cl0.003 F0.014 H1.378 K0.215 Mg3.976 Na0.901 O23.983 Si5.86 Ti0.67 -","- Al2.61 Ca1.7892 Cl0.003 F0.014 H1.378 K0.2149 Mg3.976 Na0.901 O23.983 Si5.86 Ti0.67 -","- Al5.22 Ca3.5784 Cl0.006 F0.028 H2.756 K0.4298 Mg7.952 Na1.802 O47.966 Si11.72 Ti1.34 -","2","0.25","","Tiepolo, M.; Zanetti, A.; Oberti, R.","Detection, crystal-chemical mechanisms and petrological implications of Ti4+ partitioning in pargasite and kaersutite Sample: K4","European Journal of Mineralogy","1999","11","","345","354","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13",""
"9005392","9.198","","3.091","","9.355","","90","","90","","90","","265.972","","","","","","","","","","","","Inglefield Land, North-West Greenland","8","P n m a","-P 2ac 2n","62","","","Yuanfuliite","- Al0.226 B Cr0.018 Fe0.717 Mg0.963 Mn0.005 O4 Ti0.07 -","- Al0.226 B Cr0.018 Fe0.717 Mg0.963 Mn0.005 O4 Ti0.07 -","- Al0.904 B4 Cr0.072 Fe2.868 Mg3.852 Mn0.02 O16 Ti0.28 -","4","0.5","","Appel, P. W. U.; Bigi, S.; Brigatti, M. F.","Crystal structure and chemistry of yuanfuliite and its relationships with warwickite Sample: 425359","European Journal of Mineralogy","1999","11","","483","491","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005393","9.174","","3.084","","9.337","","90","","90","","90","","264.168","","","","","","","","","","","","Inglefield Land, North-West Greenland","7","P n m a","-P 2ac 2n","62","","","Yuanfuliite","- Al0.283 B Cr0.005 Fe0.665 Mg0.969 O4 Ti0.077 -","- Al0.283 B Cr0.005 Fe0.665 Mg0.969 O4 Ti0.077 -","- Al1.132 B4 Cr0.02 Fe2.66 Mg3.876 O16 Ti0.308 -","4","0.5","","Appel, P. W. U.; Bigi, S.; Brigatti, M. F.","Crystal structure and chemistry of yuanfuliite and its relationships with warwickite Sample: 425360","European Journal of Mineralogy","1999","11","","483","491","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005394","9.0718","","9.0718","","11.57","","90","","90","","120","","824.614","","","","","","","","","","","","Leadhills, Scotland","5","P 3","P 3","143","","","Susannite","- C2 H2 O12 Pb4 S -","- C2 H2 O12 Pb4 S -","- C6 H6 O36 Pb12 S3 -","3","1","","Steele, I. M.; Pluth, J. J.; Livingstone, A.","Crystal structure of susannite, Pb4SO4(CO3)2(OH)2: a trimorph with macphersonite and leadhillite","European Journal of Mineralogy","1999","11","","493","499","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:52:18",""
"9005395","8.4654","","8.4654","","8.4654","","90","","90","","90","","606.656","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Al0.034 Fe1.94 Mg0.035 Mn0.374 O4 Zn0.616 -","- Al0.034 Fe1.94 Mg0.035 Mn0.374 O4 Zn0.616 -","- Al0.272 Fe15.52 Mg0.28 Mn2.992 O32 Zn4.928 -","8","0.0416667","","Lucchesi, S.; Russo, U.; Della Giusta, A.","Cation distribution in natural Zn-spinels: franklinite Sample: FRK2","European Journal of Mineralogy","1999","11","","501","511","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005396","8.4641","","8.4641","","8.4641","","90","","90","","90","","606.376","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Al0.034 Fe1.937 Mg0.043 Mn0.37 O4 Zn0.616 -","- Al0.034 Fe1.937 Mg0.043 Mn0.37 O4 Zn0.616 -","- Al0.272 Fe15.496 Mg0.344 Mn2.96 O32 Zn4.928 -","8","0.0416667","","Lucchesi, S.; Russo, U.; Della Giusta, A.","Cation distribution in natural Zn-spinels: franklinite Sample: FRK3","European Journal of Mineralogy","1999","11","","501","511","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005397","8.4434","","8.4434","","8.4434","","90","","90","","90","","601.938","","","","","","","","","","","","","7","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Al0.141 Fe1.785 Mg0.044 Mn0.351 O4 Ti0.024 Zn0.638 -","- Al0.141 Fe1.785 Mg0.044 Mn0.351 O4 Ti0.024 Zn0.638 -","- Al1.128 Fe14.28 Mg0.352 Mn2.808 O32 Ti0.192 Zn5.104 -","8","0.0416667","","Lucchesi, S.; Russo, U.; Della Giusta, A.","Cation distribution in natural Zn-spinels: franklinite Sample: FRK5","European Journal of Mineralogy","1999","11","","501","511","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005398","8.4431","","8.4431","","8.4431","","90","","90","","90","","601.874","","","","","","","","","","","","","7","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Al0.143 Fe1.761 Mg0.042 Mn0.333 O4 Ti0.026 Zn0.697 -","- Al0.143 Fe1.761 Mg0.042 Mn0.333 O4 Ti0.026 Zn0.697 -","- Al1.144 Fe14.088 Mg0.336 Mn2.664 O32 Ti0.208 Zn5.576 -","8","0.0416667","","Lucchesi, S.; Russo, U.; Della Giusta, A.","Cation distribution in natural Zn-spinels: franklinite Sample: FRK6","European Journal of Mineralogy","1999","11","","501","511","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005399","8.4428","","8.4428","","8.4428","","90","","90","","90","","601.81","","","","","","","","","","","","","7","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Al0.141 Fe1.772 Mg0.037 Mn0.326 O4 Ti0.026 Zn0.698 -","- Al0.141 Fe1.772 Mg0.037 Mn0.326 O4 Ti0.026 Zn0.698 -","- Al1.128 Fe14.176 Mg0.296 Mn2.608 O32 Ti0.208 Zn5.584 -","8","0.0416667","","Lucchesi, S.; Russo, U.; Della Giusta, A.","Cation distribution in natural Zn-spinels: franklinite Sample: FRK7","European Journal of Mineralogy","1999","11","","501","511","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005400","8.4688","","8.4688","","8.4688","","90","","90","","90","","607.387","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Al0.028 Fe1.91 Mg0.035 Mn0.426 O4 Zn0.602 -","- Al0.028 Fe1.91 Mg0.035 Mn0.426 O4 Zn0.602 -","- Al0.224 Fe15.28 Mg0.28 Mn3.408 O32 Zn4.816 -","8","0.0416667","","Lucchesi, S.; Russo, U.; Della Giusta, A.","Cation distribution in natural Zn-spinels: franklinite Sample: FRK8","European Journal of Mineralogy","1999","11","","501","511","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005401","8.4466","","8.4466","","8.4466","","90","","90","","90","","602.623","","","","","","","","","","","","","7","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Al0.129 Fe1.832 Mg0.038 Mn0.328 O4 Ti0.016 Zn0.658 -","- Al0.129 Fe1.832 Mg0.038 Mn0.328 O4 Ti0.016 Zn0.658 -","- Al1.032 Fe14.656 Mg0.304 Mn2.624 O32 Ti0.128 Zn5.264 -","8","0.0416667","","Lucchesi, S.; Russo, U.; Della Giusta, A.","Cation distribution in natural Zn-spinels: franklinite Sample: FRK10","European Journal of Mineralogy","1999","11","","501","511","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005402","8.4585","","8.4585","","8.4585","","90","","90","","90","","605.174","","","","","","","","","","","","","6","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Al0.031 Fe1.924 Mg0.056 Mn0.317 O4 Zn0.67 -","- Al0.031 Fe1.924 Mg0.056 Mn0.317 O4 Zn0.67 -","- Al0.248 Fe15.392 Mg0.448 Mn2.536 O32 Zn5.36 -","8","0.0416667","","Lucchesi, S.; Russo, U.; Della Giusta, A.","Cation distribution in natural Zn-spinels: franklinite Sample: FRK12","European Journal of Mineralogy","1999","11","","501","511","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005403","8.4585","","8.4585","","8.4585","","90","","90","","90","","605.174","","","","","","","","","","","","","7","F d -3 m :2","-F 4vw 2vw 3","227","","","Franklinite","- Al0.06 Fe1.924 Mg0.028 Mn0.323 O4 Ti0.004 Zn0.661 -","- Al0.06 Fe1.924 Mg0.028 Mn0.323 O4 Ti0.004 Zn0.661 -","- Al0.48 Fe15.392 Mg0.224 Mn2.584 O32 Ti0.032 Zn5.288 -","8","0.0416667","","Lucchesi, S.; Russo, U.; Della Giusta, A.","Cation distribution in natural Zn-spinels: franklinite Sample: FRK13","European Journal of Mineralogy","1999","11","","501","511","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005404","7.029","","7.029","","16.789","","90","","90","","120","","718.361","","","","","","","","","","","","","6","R -3 m :H","-R 3 2""","166","","","Hinsdalite","- Al3 H6 O14 P1.38 Pb S0.62 -","- Al3 H6 O14 P1.38 Pb1.00002 S0.62 -","- Al9 H18 O42 P4.14 Pb3.00006 S1.86 -","3","0.0833333","","Kolitsch, U.; Tiekink, E. R. T.; Slade, P. G.; Taylor, M. R.; Pring, A.","Hinsdalite and plumbogummite, their atomic arrangements and disordered lead sites","European Journal of Mineralogy","1999","11","","513","520","","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:45",""
"9005405","7.039","","7.039","","16.761","","90","","90","","120","","719.205","","","","","","","","","","","","","6","R -3 m :H","-R 3 2""","166","","","Plumbogummite","- Al3 As0.1 H6 O14 P1.9 Pb -","- Al3 As0.1 H6 O14 P1.9 Pb1.00002 -","- Al9 As0.3 H18 O42 P5.7 Pb3.00006 -","3","0.0833333","","Kolitsch, U.; Tiekink, E. R. T.; Slade, P. G.; Taylor, M. R.; Pring, A.","Hinsdalite and plumbogummite, their atomic arrangements and disordered lead sites","European Journal of Mineralogy","1999","11","","513","520","","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:45",""
"9005406","5.445","","5.873","","5.104","","114.95","","93.05","","91.92","","147.494","","","","","","","","","","","","","4","P 1","P 1","1","","","Gilmarite","- As Cu3 H3 O7 -","- As Cu3 H3 O7 -","- As Cu3 H3 O7 -","1","1","","Sarp, H.; Cerny, R.","Gilmarite, Cu3(AsO4)(OH)3, a new mineral: its description and crystal structure","European Journal of Mineralogy","1999","11","","549","555","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:52:21",""
"9005407","11.999","","11.999","","11.999","","90","","90","","90","","1727.57","","","","","","","","","","","","Mt. Vulture, Southern Italy","9","I a -3 d","-I 4bd 2c 3","230","","","Melanite","- Al0.67 Ca2.751 Fe1.338 H0.168 Mg0.051 Mn0.069 O12 Si2.88 Ti0.211 -","- Al0.67 Ca2.751 Fe1.338 Mg0.051 Mn0.069 O12 Si2.88 Ti0.211 -","- Al5.36 Ca22.008 Fe10.704 Mg0.408 Mn0.552 O96 Si23.04 Ti1.688 -","8","0.0833333","","Scordari, F.; Schingaro, E.; Pedrazzi, G.","Crystal chemistry of melanites from Mt. Vulture (Southern Italy) Sample: LC2","European Journal of Mineralogy","1999","11","","855","869","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005408","11.999","","11.999","","11.999","","90","","90","","90","","1727.57","","","","","","","","","","","","Mt. Vulture, Southern Italy","9","I a -3 d","-I 4bd 2c 3","230","","","Melanite","- Al0.66 Ca2.751 Fe1.35 H0.168 Mg0.051 Mn0.069 O12 Si2.871 Ti0.221 -","- Al0.66 Ca2.751 Fe1.35 Mg0.051 Mn0.069 O12 Si2.871 Ti0.221 -","- Al5.28 Ca22.008 Fe10.8 Mg0.408 Mn0.552 O96 Si22.968 Ti1.768 -","8","0.0833333","","Scordari, F.; Schingaro, E.; Pedrazzi, G.","Crystal chemistry of melanites from Mt. Vulture (Southern Italy) Sample: LC3","European Journal of Mineralogy","1999","11","","855","869","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005409","11.995","","11.995","","11.995","","90","","90","","90","","1725.84","","","","","","","","","","","","Mt. Vulture, Southern Italy","9","I a -3 d","-I 4bd 2c 3","230","","","Melanite","- Al0.67 Ca2.751 Fe1.339 H0.192 Mg0.051 Mn0.069 O12 Si2.871 Ti0.21 -","- Al0.67 Ca2.751 Fe1.339 Mg0.051 Mn0.069 O12 Si2.871 Ti0.21 -","- Al5.36 Ca22.008 Fe10.712 Mg0.408 Mn0.552 O96 Si22.968 Ti1.68 -","8","0.0833333","","Scordari, F.; Schingaro, E.; Pedrazzi, G.","Crystal chemistry of melanites from Mt. Vulture (Southern Italy) Sample: LC6","European Journal of Mineralogy","1999","11","","855","869","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005410","12.015","","12.015","","12.015","","90","","90","","90","","1734.49","","","","","","","","","","","","Mt. Vulture, Southern Italy","9","I a -3 d","-I 4bd 2c 3","230","","","Melanite","- Al0.55 Ca2.781 Fe1.408 H0.12 Mg0.06 Mn0.069 O12 Si2.85 Ti0.261 -","- Al0.55 Ca2.781 Fe1.408 Mg0.06 Mn0.069 O12 Si2.85 Ti0.261 -","- Al4.4 Ca22.248 Fe11.264 Mg0.48 Mn0.552 O96 Si22.8 Ti2.088 -","8","0.0833333","","Scordari, F.; Schingaro, E.; Pedrazzi, G.","Crystal chemistry of melanites from Mt. Vulture (Southern Italy) Sample: LC9","European Journal of Mineralogy","1999","11","","855","869","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005411","12.013","","12.013","","12.013","","90","","90","","90","","1733.62","","","","","","","","","","","","Mt. Vulture, Southern Italy","9","I a -3 d","-I 4bd 2c 3","230","","","Melanite","- Al0.55 Ca2.799 Fe1.432 H0.12 Mg0.051 Mn0.069 O12 Si2.85 Ti0.231 -","- Al0.55 Ca2.799 Fe1.432 Mg0.051 Mn0.069 O12 Si2.85 Ti0.231 -","- Al4.4 Ca22.392 Fe11.456 Mg0.408 Mn0.552 O96 Si22.8 Ti1.848 -","8","0.0833333","","Scordari, F.; Schingaro, E.; Pedrazzi, G.","Crystal chemistry of melanites from Mt. Vulture (Southern Italy) Sample: LC10","European Journal of Mineralogy","1999","11","","855","869","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005412","12.014","","12.014","","12.014","","90","","90","","90","","1734.06","","","","","","","","","","","","Mt. Vulture, Southern Italy","9","I a -3 d","-I 4bd 2c 3","230","","","Melanite","- Al0.56 Ca2.781 Fe1.411 H0.156 Mg0.06 Mn0.06 O12 Si2.85 Ti0.251 -","- Al0.56 Ca2.781 Fe1.411 Mg0.06 Mn0.06 O12 Si2.85 Ti0.251 -","- Al4.48 Ca22.248 Fe11.288 Mg0.48 Mn0.48 O96 Si22.8 Ti2.008 -","8","0.0833333","","Scordari, F.; Schingaro, E.; Pedrazzi, G.","Crystal chemistry of melanites from Mt. Vulture (Southern Italy) Sample: LC13","European Journal of Mineralogy","1999","11","","855","869","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005413","12.832","","12.832","","12.832","","90","","90","","90","","2112.92","","","","","","","","","","","","Central Pyrenees, France","6","P a -3","-P 2ac 2ab 3","205","","","Nabiasite","- As0.618 Ba H2 Mn9 O26 V5.382 -","- As0.618 Ba H2 Mn9 O26 V5.382 -","- As2.472 Ba4 H8 Mn36 O104 V21.528 -","4","0.166667","","Brugger, J.; Bonin, M.; Schenk, K. J.; Meisser, N.; Berlepsch, P.; Ragu, A.","Description and crystal structure of nabiasite, BaMn9[(V,As)O4]6(OH)2, a new mineral from the Central Pyrenees (France)","European Journal of Mineralogy","1999","11","","879","890","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005414","7.0541","","8.6925","","6.5445","","90","","113.903","","90","","366.876","","","","","","","","","","","","","6","A 1 2/a 1","-A 2ya","15","","","Titanite","- Al0.099 Ca F0.099 O4.901 Si Ti0.901 -","- Al0.099 Ca F0.099 O4.901 Si Ti0.901 -","- Al0.396 Ca4 F0.396 O19.604 Si4 Ti3.604 -","4","0.5","","Troitzsch, U.; Ellis, D. J.; Thompson, J.; Fitz-Gerald J","Crystal structural changes in titanite along the join TiO-AlF Sample: AlF09","European Journal of Mineralogy","1999","11","","955","965","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005415","7.0511","","8.6722","","6.5325","","90","","114.026","","90","","364.845","","","","","","","","","","","","","6","A 1 2/a 1","-A 2ya","15","","","Titanite","- Al0.182 Ca F0.182 O4.818 Si Ti0.818 -","- Al0.182 Ca F0.182 O4.818 Si Ti0.818 -","- Al0.728 Ca4 F0.728 O19.272 Si4 Ti3.272 -","4","0.5","","Troitzsch, U.; Ellis, D. J.; Thompson, J.; Fitz-Gerald J","Crystal structural changes in titanite along the join TiO-AlF Sample: AlF18","European Journal of Mineralogy","1999","11","","955","965","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005416","7.0462","","8.6529","","6.5231","","90","","114.143","","90","","362.925","","","","","","","","","","","","","6","A 1 2/a 1","-A 2ya","15","","","Titanite","- Al0.291 Ca F0.291 O4.709 Si Ti0.709 -","- Al0.291 Ca F0.291 O4.709 Si Ti0.709 -","- Al1.164 Ca4 F1.164 O18.836 Si4 Ti2.836 -","4","0.5","","Troitzsch, U.; Ellis, D. J.; Thompson, J.; Fitz-Gerald J","Crystal structural changes in titanite along the join TiO-AlF Sample: AlF29","European Journal of Mineralogy","1999","11","","955","965","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005417","7.0368","","8.636","","6.5135","","90","","114.232","","90","","360.948","","","","","","","","","","","","","6","A 1 2/a 1","-A 2ya","15","","","Titanite","- Al0.372 Ca F0.372 O4.628 Si Ti0.628 -","- Al0.372 Ca F0.372 O4.628 Si Ti0.628 -","- Al1.488 Ca4 F1.488 O18.512 Si4 Ti2.512 -","4","0.5","","Troitzsch, U.; Ellis, D. J.; Thompson, J.; Fitz-Gerald J","Crystal structural changes in titanite along the join TiO-AlF Sample: AlF37","European Journal of Mineralogy","1999","11","","955","965","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005418","7.0229","","8.613","","6.5023","","90","","114.344","","90","","358.342","","","","","","","","","","","","","6","A 1 2/a 1","-A 2ya","15","","","Titanite","- Al0.489 Ca F0.489 O4.511 Si Ti0.511 -","- Al0.489 Ca F0.489 O4.511 Si Ti0.511 -","- Al1.956 Ca4 F1.956 O18.044 Si4 Ti2.044 -","4","0.5","","Troitzsch, U.; Ellis, D. J.; Thompson, J.; Fitz-Gerald J","Crystal structural changes in titanite along the join TiO-AlF Sample: AlF49","European Journal of Mineralogy","1999","11","","955","965","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005419","6.9904","","8.5759","","6.4798","","90","","114.48","","90","","353.537","","","","","","","","","","","","","6","A 1 2/a 1","-A 2ya","15","","","Titanite","- Al0.672 Ca F0.672 O4.328 Si Ti0.328 -","- Al0.672 Ca F0.672 O4.328 Si Ti0.328 -","- Al2.688 Ca4 F2.688 O17.312 Si4 Ti1.312 -","4","0.5","","Troitzsch, U.; Ellis, D. J.; Thompson, J.; Fitz-Gerald J","Crystal structural changes in titanite along the join TiO-AlF Sample: AlF67","European Journal of Mineralogy","1999","11","","955","965","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005420","6.958","","8.5445","","6.4612","","90","","114.585","","90","","349.312","","","","","","","","","","","","","6","A 1 2/a 1","-A 2ya","15","","","Titanite","- Al0.819 Ca F0.819 O4.181 Si Ti0.181 -","- Al0.819 Ca F0.819 O4.181 Si Ti0.181 -","- Al3.276 Ca4 F3.276 O16.724 Si4 Ti0.724 -","4","0.5","","Troitzsch, U.; Ellis, D. J.; Thompson, J.; Fitz-Gerald J","Crystal structural changes in titanite along the join TiO-AlF Sample: AlF82","European Journal of Mineralogy","1999","11","","955","965","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005421","6.9157","","8.5076","","6.4391","","90","","114.683","","90","","344.236","","","","","","","","","","","","","5","A 1 2/a 1","-A 2ya","15","","","Titanite","- Al Ca F O4 Si -","- Al Ca F O4 Si -","- Al4 Ca4 F4 O16 Si4 -","4","0.5","","Troitzsch, U.; Ellis, D. J.; Thompson, J.; Fitz-Gerald J","Crystal structural changes in titanite along the join TiO-AlF Sample: AlF100","European Journal of Mineralogy","1999","11","","955","965","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005422","10.862","","7.483","","5.15","","90","","90","","90","","418.594","","","","","","","","","","","","","16","P n m a","-P 2ac 2n","62","","","Aeschynite-(Y)","- Ca0.01 Ce0.005 Dy0.065 Er0.034 Gd0.068 Nb0.05 Nd0.011 O6 Pr0.001 Sm0.01 Th0.06 Ti1.95 U0.004 W0.03 Y0.639 Yb0.025 -","- Ca0.01 Ce0.005 Dy0.065 Er0.034 Gd0.068 Nb0.05 Nd0.011 O6 Pr0.001 Sm0.01 Th0.06 Ti1.95 U0.004 W0.03 Y0.639 Yb0.025 -","- Ca0.04 Ce0.02 Dy0.26 Er0.136 Gd0.272 Nb0.2 Nd0.044 O24 Pr0.004 Sm0.04 Th0.24 Ti7.8 U0.016 W0.12 Y2.556 Yb0.1 -","4","0.5","","Bonazzi, P.; Menchetti, S.","Crystal chemistry of aeschynite-(Y) from the Western Alps: residual electron density on difference-Fourier map Sample: TR1 Locality: western Alps","European Journal of Mineralogy","1999","11","6","1043","1049","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005423","10.803","","7.532","","5.18","","90","","90","","90","","421.487","","","","","","","","","","","","","17","P n m a","-P 2ac 2n","62","","","Aeschynite-(Y)","- Ca0.01 Ce0.009 Dy0.071 Er0.043 Gd0.072 La0.001 Nb0.03 Nd0.032 O6.02 Pr0.003 Sm0.034 Th0.12 Ti1.95 U0.02 W0.02 Y0.54 Yb0.03 -","- Ca0.01 Ce0.009 Dy0.071 Er0.043 Gd0.072 La0.001 Nb0.03 Nd0.032 O6.02 Pr0.003 Sm0.034 Th0.12 Ti1.95 U0.02 W0.02 Y0.54 Yb0.03 -","- Ca0.04 Ce0.036 Dy0.284 Er0.172 Gd0.288 La0.004 Nb0.12 Nd0.128 O24.08 Pr0.012 Sm0.136 Th0.48 Ti7.8 U0.08 W0.08 Y2.16 Yb0.12 -","4","0.5","","Bonazzi, P.; Menchetti, S.","Crystal chemistry of aeschynite-(Y) from the Western Alps: residual electron density on difference-Fourier map Sample: MI Locality: western Alps","European Journal of Mineralogy","1999","11","6","1043","1049","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005424","10.904","","7.49","","5.189","","90","","90","","90","","423.791","","","","","","","","","","","","","17","P n m a","-P 2ac 2n","62","","","Aeschynite-(Y)","- Ca0.02 Ce0.011 Dy0.079 Er0.034 Gd0.091 Nb0.09 Nd0.026 O6 Pr0.002 Sm0.016 Ta0.01 Th0.1 Ti1.81 U0.03 W0.11 Y0.55 Yb0.022 -","- Ca0.02 Ce0.011 Dy0.079 Er0.034 Gd0.091 Nb0.09 Nd0.026 O6 Pr0.002 Sm0.016 Ta0.01 Th0.1 Ti1.81 U0.03 W0.11 Y0.55 Yb0.022 -","- Ca0.08 Ce0.044 Dy0.316 Er0.136 Gd0.364 Nb0.36 Nd0.104 O24 Pr0.008 Sm0.064 Ta0.04 Th0.4 Ti7.24 U0.12 W0.44 Y2.2 Yb0.088 -","4","0.5","","Bonazzi, P.; Menchetti, S.","Crystal chemistry of aeschynite-(Y) from the Western Alps: residual electron density on difference-Fourier map Sample: TR2 Locality: western Alps","European Journal of Mineralogy","1999","11","6","1043","1049","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005425","10.881","","7.484","","5.156","","90","","90","","90","","419.871","","","","","","","","","","","","","16","P n m a","-P 2ac 2n","62","","","Aeschynite-(Y)","- Ce0.001 Dy0.076 Er0.041 Fe0.01 Gd0.056 Nb0.17 Nd0.005 O6 Sm0.013 Ta0.01 Th0.04 Ti1.8 U0.08 W0.06 Y0.61 Yb0.025 -","- Ce0.001 Dy0.076 Er0.041 Fe0.01 Gd0.056 Nb0.17 Nd0.005 O6 Sm0.013 Ta0.01 Th0.04 Ti1.8 U0.08 W0.06 Y0.61 Yb0.025 -","- Ce0.004 Dy0.304 Er0.164 Fe0.04 Gd0.224 Nb0.68 Nd0.02 O24 Sm0.052 Ta0.04 Th0.16 Ti7.2 U0.32 W0.24 Y2.44 Yb0.1 -","4","0.5","","Bonazzi, P.; Menchetti, S.","Crystal chemistry of aeschynite-(Y) from the Western Alps: residual electron density on difference-Fourier map Sample: CE - note: O1 z coordinate altered to match reported bond lengths Locality: western Alps","European Journal of Mineralogy","1999","11","6","1043","1049","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005426","11.031","","7.448","","5.188","","90","","90","","90","","426.24","","","","","","","","","","","","","19","P n m a","-P 2ac 2n","62","","","Aeschynite-(Y)","- Ca0.01 Ce0.005 Dy0.042 Er0.023 Fe0.03 Gd0.042 La0.001 Nb0.36 Nd0.015 O6 Pr0.001 Sm0.017 Ta0.22 Th0.07 Ti1.41 U0.04 W0.05 Y0.65 Yb0.018 -","- Ca0.01 Ce0.005 Dy0.042 Er0.023 Fe0.03 Gd0.042 La0.001 Nb0.36 Nd0.015 O6 Pr0.001 Sm0.017 Ta0.22 Th0.07 Ti1.41 U0.04 W0.05 Y0.65 Yb0.018 -","- Ca0.04 Ce0.02 Dy0.168 Er0.092 Fe0.12 Gd0.168 La0.004 Nb1.44 Nd0.06 O24 Pr0.004 Sm0.068 Ta0.88 Th0.28 Ti5.64 U0.16 W0.2 Y2.6 Yb0.072 -","4","0.5","","Bonazzi, P.; Menchetti, S.","Crystal chemistry of aeschynite-(Y) from the Western Alps: residual electron density on difference-Fourier map Sample: VV Locality: western Alps","European Journal of Mineralogy","1999","11","6","1043","1049","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005427","17.675","","17.9572","","7.4091","","90","","116.304","","90","","2108.1","","","","","","","","","","","","volcanoclastites of North-Western Sardinia","7","C 1 2/m 1","-C 2y","12","","","Clinoptilolite-Ca","- Ca0.86 H20.423 K0.64 Mg0.26 Na0.66 O49.42 Si18 -","- Ca0.86 H26.84 K0.64 Mg0.26 Na0.66 O49.42 Si18 -","- Ca1.72 H53.68 K1.28 Mg0.52 Na1.32 O98.84 Si36 -","2","0.25","","Cappelletti, P.; Langella, A.; Cruciani, G.","Crystal-chemistry and synchrotron Rietveld refinement of two different clinoptilolites from volcanoclastites of North-Western Sardinia Sample: LAC1","European Journal of Mineralogy","1999","11","","1051","1060","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9005428","17.6589","","17.9241","","7.4034","","90","","116.243","","90","","2101.79","","","","","","","","","","","","volcanoclastites of North-Western Sardinia","6","C 1 2/m 1","-C 2y","12","","","Clinoptilolite-Ca","- Ca0.74 H11.526 K1.22 Na0.26 O50.12 Si18 -","- Ca0.74 H28.64 K1.22 Na0.26 O50.32 Si18 -","- Ca1.48 H57.28 K2.44 Na0.52 O100.64 Si36 -","2","0.25","","Cappelletti, P.; Langella, A.; Cruciani, G.","Crystal-chemistry and synchrotron Rietveld refinement of two different clinoptilolites from volcanoclastites of North-Western Sardinia Sample: ZC16","European Journal of Mineralogy","1999","11","","1051","1060","","","","","","","","","","","","","","","","","","","","","","has coordinates","283912","2023-05-21","08:41:26",""
"9006586","6.676","","16.547","","7.543","","90","","94.41","","90","","830.791","","","","","","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","Brewsterite-Sr","- Al1.01 H2 O8.79 Si2.99 Sr0.517 -","- Al1.01 H1.58 O8.79 Si2.99 Sr0.517 -","- Al4.04 H6.32 O35.16 Si11.96 Sr2.068 -","4","1","","Alberti, A.; Sacerdoti, M.; Quartieri, S.; Vezzalini, G.","Heating-induced phase transformation in zeolite brewsterite: new 4- and 5-coordinated (Si,Al) sites Sample: BR280R","Physics and Chemistry of Minerals","1999","26","","181","186","10.1007/s002690050175","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09",""
"9006587","2.8654","","2.8654","","2.8654","","90","","90","","90","","23.526","","","","298","","","","0","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 0.0 GPa, T = 298 K, prior to experiment","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006588","2.8658","","2.8658","","2.8658","","90","","90","","90","","23.536","","","","300","","","","0","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 0.0 GPa, T = 300 K, after experiment","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006589","2.8591","","2.8591","","2.8591","","90","","90","","90","","23.372","","","","299","","","","1300000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 1.3 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006590","2.8484","","2.8484","","2.8484","","90","","90","","90","","23.11","","","","299","","","","3000000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 3.0 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006591","2.8409","","2.8409","","2.8409","","90","","90","","90","","22.928","","","","299","","","","4300000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 4.3 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006592","2.8339","","2.8339","","2.8339","","90","","90","","90","","22.759","","","","299","","","","5600000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 5.6 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006593","2.8285","","2.8285","","2.8285","","90","","90","","90","","22.629","","","","299","","","","6600000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 6.6 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006594","2.8213","","2.8213","","2.8213","","90","","90","","90","","22.457","","","","299","","","","8100000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 8.1 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006595","2.8652","","2.8652","","2.8652","","90","","90","","90","","23.521","","","","573","","","","1800000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 1.8 GPa, T = 573 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006596","2.8544","","2.8544","","2.8544","","90","","90","","90","","23.257","","","","573","","","","3600000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 3.6 GPa, T = 573 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006597","2.8468","","2.8468","","2.8468","","90","","90","","90","","23.071","","","","573","","","","4900000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 4.9 GPa, T = 573 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006598","2.8396","","2.8396","","2.8396","","90","","90","","90","","22.897","","","","573","","","","6100000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 6.1 GPa, T = 573 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006599","2.8339","","2.8339","","2.8339","","90","","90","","90","","22.759","","","","572","","","","7200000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 7.2 GPa, T = 572 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006600","2.826","","2.826","","2.826","","90","","90","","90","","22.569","","","","573","","","","8700000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 8.7 GPa, T = 573 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006601","2.8716","","2.8716","","2.8716","","90","","90","","90","","23.679","","","","773","","","","2300000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 2.3 GPa, T = 773 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006602","2.8599","","2.8599","","2.8599","","90","","90","","90","","23.391","","","","773","","","","3900000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 3.9 GPa, T = 773 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006603","2.8515","","2.8515","","2.8515","","90","","90","","90","","23.186","","","","774","","","","5300000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 5.3 GPa, T = 774 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006604","2.8434","","2.8434","","2.8434","","90","","90","","90","","22.989","","","","773","","","","6600000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 6.6 GPa, T = 773 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006605","2.8373","","2.8373","","2.8373","","90","","90","","90","","22.841","","","","774","","","","7700000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 7.7 GPa, T = 774 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006606","2.8317","","2.8317","","2.8317","","90","","90","","90","","22.706","","","","773","","","","8900000","","","","","1","I m -3 m","-I 4 2 3","229","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 8.9 GPa, T = 773 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006607","2.8429","","2.8429","","2.8429","","90","","90","","90","","22.977","","","","298","","","","0","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 0.0 GPa, T = 298 K, prior to the experiment","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006608","2.8436","","2.8436","","2.8436","","90","","90","","90","","22.994","","","","300","","","","0","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 0.0 GPa, T = 300 K, after the experiment","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006609","2.8369","","2.8369","","2.8369","","90","","90","","90","","22.831","","","","299","","","","1300000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 1.3 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006610","2.827","","2.827","","2.827","","90","","90","","90","","22.593","","","","299","","","","3000000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 3.0 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006611","2.819","","2.819","","2.819","","90","","90","","90","","22.402","","","","299","","","","4300000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 4.3 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006612","2.8121","","2.8121","","2.8121","","90","","90","","90","","22.238","","","","299","","","","5600000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 5.6 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006613","2.8063","","2.8063","","2.8063","","90","","90","","90","","22.101","","","","299","","","","6600000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 6.6 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006614","2.7995","","2.7995","","2.7995","","90","","90","","90","","21.94","","","","299","","","","8100000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 8.1 GPa, T = 299 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006615","2.8438","","2.8438","","2.8438","","90","","90","","90","","22.998","","","","573","","","","1800000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 1.8 GPa, T = 573 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006616","2.8335","","2.8335","","2.8335","","90","","90","","90","","22.749","","","","573","","","","3600000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 3.6 GPa, T = 573 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006617","2.8251","","2.8251","","2.8251","","90","","90","","90","","22.548","","","","573","","","","4900000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 4.9 GPa, T = 573 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006618","2.818","","2.818","","2.818","","90","","90","","90","","22.378","","","","573","","","","6100000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 6.1 GPa, T = 573 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006619","2.812","","2.812","","2.812","","90","","90","","90","","22.235","","","","572","","","","7200000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 7.2 GPa, T = 572 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006620","2.8063","","2.8063","","2.8063","","90","","90","","90","","22.101","","","","573","","","","8700000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 8.7 GPa, T = 573 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:02",""
"9006621","2.8492","","2.8492","","2.8492","","90","","90","","90","","23.13","","","","773","","","","2300000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 2.3 GPa, T = 773 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006622","2.8392","","2.8392","","2.8392","","90","","90","","90","","22.887","","","","773","","","","3900000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 3.9 GPa, T = 773 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006623","2.8304","","2.8304","","2.8304","","90","","90","","90","","22.675","","","","774","","","","5300000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 5.3 GPa, T = 774 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006624","2.8224","","2.8224","","2.8224","","90","","90","","90","","22.483","","","","773","","","","6600000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 6.6 GPa, T = 773 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006625","2.8159","","2.8159","","2.8159","","90","","90","","90","","22.328","","","","774","","","","7700000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 7.7 GPa, T = 774 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006626","2.8105","","2.8105","","2.8105","","90","","90","","90","","22.2","","","","773","","","","8900000","","","","","2","I m -3 m","-I 4 2 3","229","","","","- Fe0.91 Si0.09 -","- Fe0.91 Si0.09 -","- Fe1.82 Si0.18 -","2","0.0208333","","Zhang, J.; Guyot, F.","Thermal equation of iron and Fe0.91Si0.09 Sample: P = 8.9 GPa, T = 773 K","Physics and Chemistry of Minerals","1999","26","","206","211","10.1007/s002690050178","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006627","8.067","","8.067","","8.067","","90","","90","","90","","524.972","","","","300","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.971 Fe0.23 Mg0.7 O4 -","- Al1.9709 Fe0.23 Mg0.6997 O4 -","- Al15.7672 Fe1.84 Mg5.5976 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Russo, U.; Hoser, A.","Cation partitioning versus temperature in (Mg0.70Fe0.23)Al1.97O4 synthetic spinel by in situ neutron powder diffraction Sample: T = 300 K","Physics and Chemistry of Minerals","1999","26","","242","250","10.1007/s002690050183","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006628","8.0811","","8.0811","","8.0811","","90","","90","","90","","527.73","","","","523","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.971 Fe0.23 Mg0.7 O4 -","- Al1.9709 Fe0.23 Mg0.6997 O4 -","- Al15.7672 Fe1.84 Mg5.5976 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Russo, U.; Hoser, A.","Cation partitioning versus temperature in (Mg0.70Fe0.23)Al1.97O4 synthetic spinel by in situ neutron powder diffraction Sample: T = 523 K","Physics and Chemistry of Minerals","1999","26","","242","250","10.1007/s002690050183","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006629","8.0973","","8.0973","","8.0973","","90","","90","","90","","530.91","","","","773","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.971 Fe0.23 Mg0.7 O4 -","- Al1.9709 Fe0.23 Mg0.6995 O4 -","- Al15.7672 Fe1.84 Mg5.596 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Russo, U.; Hoser, A.","Cation partitioning versus temperature in (Mg0.70Fe0.23)Al1.97O4 synthetic spinel by in situ neutron powder diffraction Sample: T = 773 K","Physics and Chemistry of Minerals","1999","26","","242","250","10.1007/s002690050183","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006630","8.1115","","8.1115","","8.1115","","90","","90","","90","","533.708","","","","973","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.969 Fe0.23 Mg0.701 O4 -","- Al1.9691 Fe0.23 Mg0.7009 O4 -","- Al15.7528 Fe1.84 Mg5.6072 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Russo, U.; Hoser, A.","Cation partitioning versus temperature in (Mg0.70Fe0.23)Al1.97O4 synthetic spinel by in situ neutron powder diffraction Sample: T = 973 K","Physics and Chemistry of Minerals","1999","26","","242","250","10.1007/s002690050183","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006631","8.1256","","8.1256","","8.1256","","90","","90","","90","","536.496","","","","1123","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.969 Fe0.23 Mg0.701 O4 -","- Al1.9693 Fe0.23 Mg0.7009 O4 -","- Al15.7544 Fe1.84 Mg5.6072 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Russo, U.; Hoser, A.","Cation partitioning versus temperature in (Mg0.70Fe0.23)Al1.97O4 synthetic spinel by in situ neutron powder diffraction Sample: T = 1123 K","Physics and Chemistry of Minerals","1999","26","","242","250","10.1007/s002690050183","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006632","8.1437","","8.1437","","8.1437","","90","","90","","90","","540.089","","","","1273","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.969 Fe0.23 Mg0.701 O4 -","- Al1.9689 Fe0.23 Mg0.7011 O4 -","- Al15.7512 Fe1.84 Mg5.6088 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Russo, U.; Hoser, A.","Cation partitioning versus temperature in (Mg0.70Fe0.23)Al1.97O4 synthetic spinel by in situ neutron powder diffraction Sample: T = 1273 K","Physics and Chemistry of Minerals","1999","26","","242","250","10.1007/s002690050183","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006633","8.1612","","8.1612","","8.1612","","90","","90","","90","","543.578","","","","1423","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.969 Fe0.23 Mg0.701 O4 -","- Al1.9686 Fe0.23 Mg0.7012 O4 -","- Al15.7488 Fe1.84 Mg5.6096 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Russo, U.; Hoser, A.","Cation partitioning versus temperature in (Mg0.70Fe0.23)Al1.97O4 synthetic spinel by in situ neutron powder diffraction Sample: T = 1423 K","Physics and Chemistry of Minerals","1999","26","","242","250","10.1007/s002690050183","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006634","8.1768","","8.1768","","8.1768","","90","","90","","90","","546.701","","","","1573","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.969 Fe0.23 Mg0.701 O4 -","- Al1.9686 Fe0.23 Mg0.7014 O4 -","- Al15.7488 Fe1.84 Mg5.6112 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Russo, U.; Hoser, A.","Cation partitioning versus temperature in (Mg0.70Fe0.23)Al1.97O4 synthetic spinel by in situ neutron powder diffraction Sample: T = 1573 K","Physics and Chemistry of Minerals","1999","26","","242","250","10.1007/s002690050183","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006635","8.1907","","8.1907","","8.1907","","90","","90","","90","","549.494","","","","1723","","","","","","","","Synthetic","4","F d -3 m :2","-F 4vw 2vw 3","227","","","Spinel","- Al1.969 Fe0.23 Mg0.701 O4 -","- Al1.9686 Fe0.23 Mg0.7014 O4 -","- Al15.7488 Fe1.84 Mg5.6112 O32 -","8","0.0416667","","Pavese, A.; Artioli, G.; Russo, U.; Hoser, A.","Cation partitioning versus temperature in (Mg0.70Fe0.23)Al1.97O4 synthetic spinel by in situ neutron powder diffraction Sample: T = 1723 K","Physics and Chemistry of Minerals","1999","26","","242","250","10.1007/s002690050183","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006636","5.674","","11.477","","8.235","","90","","90.21","","90","","536.264","","","","","","","","","","","","","3","C 1 2/m 1 (a+c-1/4,b+1/4,c)","-C 2y (x+1/4,y-1/4,-x+z-1/4)","12","","","Wadsleyite","- Mg1.82 O4 Si -","- Mg1.82 O4 Si -","- Mg14.56 O32 Si8 -","8","","","Kudoh, Y.; Inoue, T.","Mg-vacant structural modules and dilution of the symmetry of hydrous wadsleyite, beta-Mg2-xSiH2xO4 with 0.00<=x<=0.25 Sample: 0.3H-beta","Physics and Chemistry of Minerals","1999","26","","382","388","10.1007/s002690050198","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006637","5.675","","11.579","","8.244","","90","","90.09","","90","","541.719","","","","","","","","","","","","","3","C 1 2/m 1 (a+c-1/4,b+1/4,c)","-C 2y (x+1/4,y-1/4,-x+z-1/4)","12","","","Wadsleyite","- Mg1.72 O4 Si -","- Mg1.72 O4 Si -","- Mg13.76 O32 Si8 -","8","","","Kudoh, Y.; Inoue, T.","Mg-vacant structural modules and dilution of the symmetry of hydrous wadsleyite, beta-Mg2-xSiH2xO4 with 0.00<=x<=0.25 Sample: 0.5H-beta","Physics and Chemistry of Minerals","1999","26","","382","388","10.1007/s002690050198","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006638","5.4652","","5.4652","","7.7476","","90","","90","","90","","231.409","","","","","","","","","","","","","5","I 4/m c m","-I 4 2c","140","","","Loparite","- La0.34 Na0.45 O3 Th0.13 Ti -","- La0.34 Na0.45 O3 Th0.13 Ti -","- La1.36 Na1.8 O12 Th0.52 Ti4 -","4","0.125","","Mitchell, R. H.; Chakhmouradian, A. R.","Solid solubility in the system NaLREETi2O6 - ThTi2O6 (LREE, light rare-earth elements): experimental and analytical data","Physics and Chemistry of Minerals","1999","26","","396","405","10.1007/s002690050200","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006639","9.814","","3.8228","","7.0313","","90","","118.82","","90","","231.119","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","Thorutite","- O6 Th Ti2 -","- O6 Th Ti2 -","- O12 Th2 Ti4 -","2","0.25","","Mitchell, R. H.; Chakhmouradian, A. R.","Solid solubility in the system NaLREETi2O6 - ThTi2O6 (LREE, light rare-earth elements): experimental and analytical data","Physics and Chemistry of Minerals","1999","26","","396","405","10.1007/s002690050200","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006640","5.7005","","11.1651","","9.5847","","90","","90","","90","","610.034","","","","","","","","100","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample in air: P = 0.0001 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006641","5.7007","","11.1653","","9.585","","90","","90","","90","","610.085","","","","","","","","100","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample in diamond anvil cell: P = 0.0001 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006642","5.6804","","11.1174","","9.3842","","90","","90","","90","","592.624","","","","","","","","3106000","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample: P = 3.106 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006643","5.665","","11.0863","","9.2742","","90","","90","","90","","582.456","","","","","","","","5303000","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample: P = 5.303 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006644","5.6512","","11.0598","","9.191","","90","","90","","90","","574.448","","","","","","","","7300000","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample: P = 7.300 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006645","5.6374","","11.0375","","9.1192","","90","","90","","90","","567.422","","","","","","","","9220000","","","","","3","F d d d :2","-F 2uv 2vw","70","","","","- Cr2 O4 Si -","- Cr2 O4 Si -","- Cr16 O32 Si8 -","8","0.25","","Miletich, R.; Nowak, M.; Seifert, F.; Angel, R. J.; Brandstatter, G.","High-pressure crystal chemistry of chromous orthosilicate, Cr2SiO4. A single-crystal X-ray diffraction and electronic absorption spectroscopy study Sample: P = 9.220 GPa","Physics and Chemistry of Minerals","1999","26","","446","459","10.1007/s002690050207","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006646","5.6769","","15.2074","","6.5277","","90","","118.494","","90","","495.279","","","","320","","","","","","","","","4","I 1 2/a 1","","","","","Gypsum (deuterated)","- Ca D4 O6 S -","- Ca D4 O6 S -","- Ca4 D16 O24 S4 -","4","0.5","","Knight, K. S.; Stretton, I. C.; Schofield, P. F.","Temperature evolution between 50 K and 320 K of the thermal expansion tensor of gypsum derived from neutron powder diffraction data Sample: T = 320 K","Physics and Chemistry of Minerals","1999","26","","477","483","10.1007/s002690050210","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:47",""
"9006647","9.841","","9.841","","9.372","","90","","90","","120","","786.034","","","","","","","","","","","","","4","P 6/m c c","-P 6 2c","192","","","","- Al4 Co2 O18 Si5 -","- Al3.99999 Co2 O18 Si5.00001 -","- Al7.99998 Co4 O36 Si10 -","2","0.0833333","","Knorr, K.; Meschke, M.; Winkler, B.","Structural and magnetic properties of Co2Al4Si5O18 and Mn2Al4Si5O18 cordierite","Physics and Chemistry of Minerals","1999","26","","521","529","10.1007/s002690050215","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006648","17.128","","9.764","","9.147","","90","","90","","90","","1529.72","","","","","","","","","","","","","4","C c c m","-C 2 2c","66","","","","- Al4 Mn2 O18 Si5 -","- Al4 Mn2 O18 Si5 -","- Al16 Mn8 O72 Si20 -","4","0.25","","Knorr, K.; Meschke, M.; Winkler, B.","Structural and magnetic properties of Co2Al4Si5O18 and Mn2Al4Si5O18 cordierite","Physics and Chemistry of Minerals","1999","26","","521","529","10.1007/s002690050215","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006649","3.899","","3.899","","3.899","","90","","90","","90","","59.273","","","","300","","","","61000000","","heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample: P = 61 GPa, T = 300 K","heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample: P = 61 GPa","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Dubrovinsky, L. S.; Lazor, P.; Saxena, S. K.; Haggkvist, P.; Weber, H. P.; Le Bihan, T.; Hausermann, D.","Study of laser heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample: P = 61 GPa, T = 300 K","Physics and Chemistry of Minerals","1999","26","","539","545","10.1007/s002690050217","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006650","3.897","","3.897","","3.897","","90","","90","","90","","59.182","","","","1550","","","","61000000","","heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample: P = 61 GPa, T = 1550 K","heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample: P = 61 GPa","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Dubrovinsky, L. S.; Lazor, P.; Saxena, S. K.; Haggkvist, P.; Weber, H. P.; Le Bihan, T.; Hausermann, D.","Study of laser heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample: P = 61 GPa, T = 1550 K","Physics and Chemistry of Minerals","1999","26","","539","545","10.1007/s002690050217","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006651","7.156","","8.875","","6.66","","90","","113.38","","90","","388.244","","","","300","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","Malayaite","- Ca O5 Si Sn -","- Ca O5 Si Sn -","- Ca4 O20 Si4 Sn4 -","4","0.5","","Zhang, M.; Meyer, H. W.; Groat, L. A.; Bismayer, U.; Salje, E. K. H.; Adiwidjaja, G.","An infrared spectroscopic and single-crystal X-ray study of malayaite, CaSnSiO5 Sample: T = 300 K","Physics and Chemistry of Minerals","1999","26","","546","553","10.1007/s002690050218","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006652","7.16","","8.897","","6.672","","90","","113.34","","90","","390.244","","","","450","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","Malayaite","- Ca O5 Si Sn -","- Ca O5 Si Sn -","- Ca4 O20 Si4 Sn4 -","4","0.5","","Zhang, M.; Meyer, H. W.; Groat, L. A.; Bismayer, U.; Salje, E. K. H.; Adiwidjaja, G.","An infrared spectroscopic and single-crystal X-ray study of malayaite, CaSnSiO5 Sample: T = 450 K","Physics and Chemistry of Minerals","1999","26","","546","553","10.1007/s002690050218","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006653","7.166","","8.903","","6.678","","90","","113.39","","90","","391.038","","","","550","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","Malayaite","- Ca O5 Si Sn -","- Ca O5 Si Sn -","- Ca4 O20 Si4 Sn4 -","4","0.5","","Zhang, M.; Meyer, H. W.; Groat, L. A.; Bismayer, U.; Salje, E. K. H.; Adiwidjaja, G.","An infrared spectroscopic and single-crystal X-ray study of malayaite, CaSnSiO5 Sample: T = 550 K Note: U33 for O1 has been altered by personal communication with authors, Dec 2003","Physics and Chemistry of Minerals","1999","26","","546","553","10.1007/s002690050218","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006654","7.173","","8.901","","6.683","","90","","113.36","","90","","391.714","","","","670","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","Malayaite","- Ca O5 Si Sn -","- Ca O5 Si Sn -","- Ca4 O20 Si4 Sn4 -","4","0.5","","Zhang, M.; Meyer, H. W.; Groat, L. A.; Bismayer, U.; Salje, E. K. H.; Adiwidjaja, G.","An infrared spectroscopic and single-crystal X-ray study of malayaite, CaSnSiO5 Sample: T = 670 K","Physics and Chemistry of Minerals","1999","26","","546","553","10.1007/s002690050218","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006655","7.167","","8.912","","6.688","","90","","113.36","","90","","392.163","","","","730","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","Malayaite","- Ca O5 Si Sn -","- Ca O5 Si Sn -","- Ca4 O20 Si4 Sn4 -","4","0.5","","Zhang, M.; Meyer, H. W.; Groat, L. A.; Bismayer, U.; Salje, E. K. H.; Adiwidjaja, G.","An infrared spectroscopic and single-crystal X-ray study of malayaite, CaSnSiO5 Sample: T = 730 K Note: x-coordinate of O1 altered from the value reported","Physics and Chemistry of Minerals","1999","26","","546","553","10.1007/s002690050218","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006656","2.347","","2.347","","3.797","","90","","90","","120","","18.113","","","","300","","","","61000000","","heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample: epsilon iron phase: P = 61 GPa, T = 300 K","heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample: epsilon iron phase: P = 61 GPa","","1","P 63/m m c","-P 6c 2c","194","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0833333","","Dubrovinsky, L. S.; Lazor, P.; Saxena, S. K.; Haggkvist, P.; Weber, H. P.; Le Bihan, T.; Hausermann, D.","Study of laser heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample: epsilon iron phase: P = 61 GPa, T = 300 K","Physics and Chemistry of Minerals","1999","26","","539","545","10.1007/s002690050217","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006657","2.346","","2.346","","3.808","","90","","90","","120","","18.15","","","","1550","","","","61000000","","heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample epsilon iron phase: P = 61 GPa, T = 1550 K","heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample epsilon iron phase: P = 61 GPa","","1","P 63/m m c","-P 6c 2c","194","","","Iron","- Fe -","- Fe -","- Fe2 -","2","0.0833333","","Dubrovinsky, L. S.; Lazor, P.; Saxena, S. K.; Haggkvist, P.; Weber, H. P.; Le Bihan, T.; Hausermann, D.","Study of laser heated iron using third generation synchrotron X-ray radiation facility with imaging plate at high pressures Sample epsilon iron phase: P = 61 GPa, T = 1550 K","Physics and Chemistry of Minerals","1999","26","","539","545","10.1007/s002690050217","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006658","4.4459","","4.4459","","4.4459","","90","","90","","90","","87.878","","","","","","","","0","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 0.00 GPa at beginning of experiment","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006659","4.4464","","4.4464","","4.4464","","90","","90","","90","","87.907","","","","","","","","0","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 0.00 GPa at end of experiment","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006660","4.4397","","4.4397","","4.4397","","90","","90","","90","","87.511","","","","","","","","680000","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 0.68 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006661","4.4326","","4.4326","","4.4326","","90","","90","","90","","87.091","","","","","","","","1430000","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 1.43 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006662","4.4254","","4.4254","","4.4254","","90","","90","","90","","86.668","","","","","","","","2160000","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 2.16 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006663","4.4169","","4.4169","","4.4169","","90","","90","","90","","86.169","","","","","","","","3090000","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 3.09 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006664","4.4106","","4.4106","","4.4106","","90","","90","","90","","85.801","","","","","","","","3730000","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 3.73 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006665","4.4042","","4.4042","","4.4042","","90","","90","","90","","85.428","","","","","","","","4460000","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 4.46 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006666","4.3963","","4.3963","","4.3963","","90","","90","","90","","84.969","","","","","","","","5410000","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 5.41 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006667","4.3891","","4.3891","","4.3891","","90","","90","","90","","84.552","","","","","","","","6170000","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 6.17 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006668","4.3846","","4.3846","","4.3846","","90","","90","","90","","84.293","","","","","","","","6730000","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 6.73 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006669","4.3792","","4.3792","","4.3792","","90","","90","","90","","83.982","","","","","","","","7270000","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 7.27 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006670","4.3726","","4.3726","","4.3726","","90","","90","","90","","83.602","","","","","","","","8090000","","","","","2","F m -3 m","-F 4 2 3","225","","","Manganosite","- Mn O -","- Mn O -","- Mn4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 8.09 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006671","4.6963","","4.6963","","4.6963","","90","","90","","90","","103.578","","","","","","","","0","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 0.00 GPa at beginning of experiment","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006672","4.6969","","4.6969","","4.6969","","90","","90","","90","","103.618","","","","","","","","0","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 0.00 GPa at end of experiment","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006673","4.69","","4.69","","4.69","","90","","90","","90","","103.162","","","","","","","","680000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 0.68 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006674","4.6821","","4.6821","","4.6821","","90","","90","","90","","102.641","","","","","","","","1430000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 1.43 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006675","4.6749","","4.6749","","4.6749","","90","","90","","90","","102.168","","","","","","","","2160000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 2.16 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006676","4.6656","","4.6656","","4.6656","","90","","90","","90","","101.56","","","","","","","","3090000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 3.09 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006677","4.6598","","4.6598","","4.6598","","90","","90","","90","","101.182","","","","","","","","3730000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 3.73 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006678","4.6522","","4.6522","","4.6522","","90","","90","","90","","100.687","","","","","","","","4460000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 4.46 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006679","4.6433","","4.6433","","4.6433","","90","","90","","90","","100.111","","","","","","","","5410000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 5.41 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006680","4.6366","","4.6366","","4.6366","","90","","90","","90","","99.678","","","","","","","","6170000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 6.17 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006681","4.6309","","4.6309","","4.6309","","90","","90","","90","","99.311","","","","","","","","6730000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 6.73 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006682","4.6259","","4.6259","","4.6259","","90","","90","","90","","98.989","","","","","","","","7270000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 7.27 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006683","4.619","","4.619","","4.619","","90","","90","","90","","98.547","","","","","","","","8090000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #1: P = 8.09 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006684","4.6953","","4.6953","","4.6953","","90","","90","","90","","103.512","","","","","","","","0","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #2: P = 0.00 GPa at beginning of experiment","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006685","4.6956","","4.6956","","4.6956","","90","","90","","90","","103.532","","","","","","","","0","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #2: P = 0.00 GPa at end of experiment","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006686","4.6833","","4.6833","","4.6833","","90","","90","","90","","102.72","","","","","","","","1250000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #2: P = 1.25 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006687","4.6708","","4.6708","","4.6708","","90","","90","","90","","101.9","","","","","","","","2560000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #2: P = 2.56 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006688","4.6595","","4.6595","","4.6595","","90","","90","","90","","101.162","","","","","","","","3590000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #2: P = 3.59 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006689","4.6502","","4.6502","","4.6502","","90","","90","","90","","100.558","","","","","","","","4520000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #2: P = 4.52 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006690","4.6438","","4.6438","","4.6438","","90","","90","","90","","100.143","","","","","","","","5300000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #2: P = 5.30 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006691","4.6371","","4.6371","","4.6371","","90","","90","","90","","99.71","","","","","","","","6010000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #2: P = 6.01 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006692","4.6217","","4.6217","","4.6217","","90","","90","","90","","98.72","","","","","","","","7800000","","","","","2","F m -3 m","-F 4 2 3","225","","","Monteponite","- Cd O -","- Cd O -","- Cd4 O4 -","4","0.0208333","","Zhang, J.","Room temperature compressibilities of MnO and CdO: further examination of the role of cation type in bulk modulus systematics Sample from Run #2: P = 7.80 GPa","Physics and Chemistry of Minerals","1999","26","","644","648","10.1007/s002690050229","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006693","5.4223","","5.4223","","12.7041","","90","","90","","120","","323.476","","","","","","","","","","","","","4","P 63/m m c","-P 6c 2c","194","","","","- Al4 Ca O11 Si2 -","- Al3.99999 Ca O11 Si2.00001 -","- Al7.99998 Ca2 O22 Si4.00002 -","2","0.0833333","","Gautron, L.; Angel, R. J.; Miletich, R.","Structural characterisation of the high-pressure phase CaAl4Si2O11 Note: Biso values altered to agree with the anisotropic values, as indicated by Ross Angel, March 2004","Physics and Chemistry of Minerals","1999","27","","47","51","10.1007/s002690050239","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006694","4.815","","4.815","","4.815","","90","","90","","90","","111.632","","","","298","","","","","","heating wire, T = 298 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 298 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006695","4.819","","4.819","","4.819","","90","","90","","90","","111.91","","","","407","","","","","","heating wire, T = 407 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 407 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006696","4.827","","4.827","","4.827","","90","","90","","90","","112.469","","","","500","","","","","","heating wire, T = 500 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 500 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006697","4.833","","4.833","","4.833","","90","","90","","90","","112.889","","","","585","","","","","","heating wire, T = 585 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 585 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006698","4.841","","4.841","","4.841","","90","","90","","90","","113.45","","","","688","","","","","","heating wire, T = 688 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 688 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006699","4.846","","4.846","","4.846","","90","","90","","90","","113.802","","","","778","","","","","","heating wire, T = 778 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 778 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006700","4.857","","4.857","","4.857","","90","","90","","90","","114.579","","","","875","","","","","","heating wire, T = 875 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 875 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006701","4.867","","4.867","","4.867","","90","","90","","90","","115.288","","","","1001","","","","","","heating wire, T = 1001 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 1001 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006702","4.876","","4.876","","4.876","","90","","90","","90","","115.929","","","","1116","","","","","","heating wire, T = 1116 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 1116 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006703","4.882","","4.882","","4.882","","90","","90","","90","","116.357","","","","1222","","","","","","heating wire, T = 1222 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 1222 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006704","4.887","","4.887","","4.887","","90","","90","","90","","116.715","","","","1289","","","","","","heating wire, T = 1289 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 1289 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006705","4.894","","4.894","","4.894","","90","","90","","90","","117.217","","","","1390","","","","","","heating wire, T = 1390 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 1390 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006706","4.902","","4.902","","4.902","","90","","90","","90","","117.793","","","","1485","","","","","","heating wire, T = 1485 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 1485 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006707","4.909","","4.909","","4.909","","90","","90","","90","","118.298","","","","1573","","","","","","heating wire, T = 1573 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 1573 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006708","4.915","","4.915","","4.915","","90","","90","","90","","118.733","","","","1656","","","","","","heating wire, T = 1656 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 1656 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006709","4.926","","4.926","","4.926","","90","","90","","90","","119.532","","","","1812","","","","","","heating wire, T = 1812 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 1812 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006710","4.913","","4.913","","4.913","","90","","90","","90","","118.588","","","","1882","","","","","","heating wire, T = 1882 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 1882 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006711","4.937","","4.937","","4.937","","90","","90","","90","","120.334","","","","1964","","","","","","heating wire, T = 1964 K","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: PtRh10% heating wire, T = 1964 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006712","4.811","","4.811","","4.811","","90","","90","","90","","111.354","","","","300","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 300 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006713","4.819","","4.819","","4.819","","90","","90","","90","","111.91","","","","398","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 398 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006714","4.823","","4.823","","4.823","","90","","90","","90","","112.189","","","","528","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 528 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006715","4.83","","4.83","","4.83","","90","","90","","90","","112.679","","","","664","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 664 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006716","4.842","","4.842","","4.842","","90","","90","","90","","113.521","","","","844","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 844 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006717","4.857","","4.857","","4.857","","90","","90","","90","","114.579","","","","1022","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1022 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006718","4.888","","4.888","","4.888","","90","","90","","90","","116.787","","","","1292","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1292 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006719","4.898","","4.898","","4.898","","90","","90","","90","","117.505","","","","1427","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1427 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006720","4.901","","4.901","","4.901","","90","","90","","90","","117.721","","","","1548","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1548 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006721","4.908","","4.908","","4.908","","90","","90","","90","","118.226","","","","1659","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1659 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006722","4.912","","4.912","","4.912","","90","","90","","90","","118.515","","","","1733","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1733 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006723","4.914","","4.914","","4.914","","90","","90","","90","","118.66","","","","1711","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1711 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006724","4.92","","4.92","","4.92","","90","","90","","90","","119.095","","","","1808","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1808 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006725","4.933","","4.933","","4.933","","90","","90","","90","","120.042","","","","1959","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1959 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006726","4.945","","4.945","","4.945","","90","","90","","90","","120.92","","","","2114","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 2114 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006727","4.956","","4.956","","4.956","","90","","90","","90","","121.729","","","","2222","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 2222 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006728","4.965","","4.965","","4.965","","90","","90","","90","","122.393","","","","2303","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 2303 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006729","4.973","","4.973","","4.973","","90","","90","","90","","122.986","","","","2362","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 2362 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006730","4.977","","4.977","","4.977","","90","","90","","90","","123.283","","","","2407","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 2407 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006731","4.813","","4.813","","4.813","","90","","90","","90","","111.493","","","","298","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 298 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006732","4.891","","4.891","","4.891","","90","","90","","90","","117.002","","","","1473","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 1473 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006733","4.907","","4.907","","4.907","","90","","90","","90","","118.154","","","","1673","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 1673 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006734","4.915","","4.915","","4.915","","90","","90","","90","","118.733","","","","1773","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 1773 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006735","4.925","","4.925","","4.925","","90","","90","","90","","119.459","","","","1873","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 1873 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006736","4.932","","4.932","","4.932","","90","","90","","90","","119.969","","","","1973","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 1973 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006737","4.943","","4.943","","4.943","","90","","90","","90","","120.774","","","","2073","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2073 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006738","4.95","","4.95","","4.95","","90","","90","","90","","121.287","","","","2173","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2173 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006739","4.964","","4.964","","4.964","","90","","90","","90","","122.319","","","","2273","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2273 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006740","4.969","","4.969","","4.969","","90","","90","","90","","122.689","","","","2373","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2373 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006741","4.976","","4.976","","4.976","","90","","90","","90","","123.209","","","","2473","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2473 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006742","4.987","","4.987","","4.987","","90","","90","","90","","124.028","","","","2573","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2573 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006743","4.997","","4.997","","4.997","","90","","90","","90","","124.775","","","","2673","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2673 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006744","5.009","","5.009","","5.009","","90","","90","","90","","125.676","","","","2773","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2773 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006745","5.025","","5.025","","5.025","","90","","90","","90","","126.884","","","","2973","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2973 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006746","5.03","","5.03","","5.03","","90","","90","","90","","127.264","","","","3073","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Lime","- Ca O -","- Ca O -","- Ca4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 3073 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006747","4.21","","4.21","","4.21","","90","","90","","90","","74.618","","","","298","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 298 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006748","4.216","","4.216","","4.216","","90","","90","","90","","74.938","","","","421","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 421 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006749","4.222","","4.222","","4.222","","90","","90","","90","","75.258","","","","505","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 505 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006750","4.226","","4.226","","4.226","","90","","90","","90","","75.472","","","","591","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 591 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006751","4.232","","4.232","","4.232","","90","","90","","90","","75.794","","","","694","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 694 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006752","4.237","","4.237","","4.237","","90","","90","","90","","76.063","","","","790","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 790 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006753","4.244","","4.244","","4.244","","90","","90","","90","","76.441","","","","874","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 874 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006754","4.249","","4.249","","4.249","","90","","90","","90","","76.711","","","","964","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 964 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006755","4.257","","4.257","","4.257","","90","","90","","90","","77.146","","","","1052","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1052 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006756","4.261","","4.261","","4.261","","90","","90","","90","","77.363","","","","1120","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1120 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006757","4.267","","4.267","","4.267","","90","","90","","90","","77.691","","","","1211","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1211 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006758","4.276","","4.276","","4.276","","90","","90","","90","","78.183","","","","1281","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1281 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006759","4.275","","4.275","","4.275","","90","","90","","90","","78.128","","","","1335","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1335 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006760","4.282","","4.282","","4.282","","90","","90","","90","","78.513","","","","1446","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1446 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006761","4.293","","4.293","","4.293","","90","","90","","90","","79.119","","","","1557","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1557 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006762","4.303","","4.303","","4.303","","90","","90","","90","","79.674","","","","1738","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1738 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006763","4.319","","4.319","","4.319","","90","","90","","90","","80.566","","","","1901","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 1901 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006764","4.326","","4.326","","4.326","","90","","90","","90","","80.958","","","","2036","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 2036 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006765","4.336","","4.336","","4.336","","90","","90","","90","","81.521","","","","2153","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 2153 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006766","4.343","","4.343","","4.343","","90","","90","","90","","81.916","","","","2262","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 2262 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006767","4.355","","4.355","","4.355","","90","","90","","90","","82.597","","","","2385","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: IR wire, T = 2385 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006768","4.212","","4.212","","4.212","","90","","90","","90","","74.725","","","","298","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 298 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006769","4.281","","4.281","","4.281","","90","","90","","90","","78.458","","","","1474","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 1474 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006770","4.297","","4.297","","4.297","","90","","90","","90","","79.341","","","","1664","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 1664 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006771","4.305","","4.305","","4.305","","90","","90","","90","","79.785","","","","1773","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 1773 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006772","4.31","","4.31","","4.31","","90","","90","","90","","80.063","","","","1873","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 1873 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006773","4.322","","4.322","","4.322","","90","","90","","90","","80.734","","","","1973","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 1973 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006774","4.324","","4.324","","4.324","","90","","90","","90","","80.846","","","","2073","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2073 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006775","4.343","","4.343","","4.343","","90","","90","","90","","81.916","","","","2273","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2273 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006776","4.352","","4.352","","4.352","","90","","90","","90","","82.426","","","","2373","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2373 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006777","4.358","","4.358","","4.358","","90","","90","","90","","82.768","","","","2473","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2473 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006778","4.371","","4.371","","4.371","","90","","90","","90","","83.511","","","","2573","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2573 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006779","4.381","","4.381","","4.381","","90","","90","","90","","84.085","","","","2673","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2673 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006780","4.396","","4.396","","4.396","","90","","90","","90","","84.952","","","","2773","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2773 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006781","4.403","","4.403","","4.403","","90","","90","","90","","85.358","","","","2873","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2873 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006782","4.408","","4.408","","4.408","","90","","90","","90","","85.649","","","","2973","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","","Periclase","- Mg O -","- Mg O -","- Mg4 O4 -","4","0.0208333","","Fiquet, G.; Richet, P.; Montagnac, G.","High-temperature thermal expansion of lime, periclase, corundum and spinel Sample: Re wire, T = 2973 K","Physics and Chemistry of Minerals","1999","27","","103","111","10.1007/s002690050246","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:03",""
"9006783","8.3327","","8.3327","","8.3327","","90","","90","","90","","578.572","","","","","","","","","","","","","3","F d -3 m :2","-F 4vw 2vw 3","227","","","Magnesiochromite","- Cr2 Mg O4 -","- Cr2 Mg O4 -","- Cr16 Mg8 O32 -","8","0.0416667","","Tabira, Y.; Withers, R. L.","Cation ordering in NiAl2O4 spinel by a 111 systematic row CBED technique Sample: picrochromite","Physics and Chemistry of Minerals","1999","27","","112","118","10.1007/s002690050247","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:14",""
"9009236","9.57","","9.716","","7.313","","98.74","","107.9","","63.86","","580.773","","","","","","","","","","","","Alum Cave Bluff, Tennessee, USA","6","P -1","-P 1","2","","","Destinezite (Diadochite)","- Al0.227 Fe1.773 H13 O15 P S -","- Al0.2275 Fe1.7725 H13 O15 P S -","- Al0.455 Fe3.545 H26 O30 P2 S2 -","2","1","","Peacor, D. R.; Rouse, R. C.; Coskren, T. D.; Essene, E. J.","Destinezite (""diadochite""), Fe2(PO4)(SO4)(OH)*6(H2O): its crystal structure and role as a soil mineral at Alum Cave Bluff,Tennessee Locality: Alum Cave Bluff, Tennessee, USA","Clays and Clay Minerals","1999","47","","1","11","10.1346/CCMN.1999.0470101","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:22",""
"9009404","5.434","","5.434","","12.107","","90","","90","","90","","357.5","","","","","","","","","","","","Monte Cengio, Vicenza, Italy","3","I 41/a :2","-I 4ad","88","","","Wulfenite","- Mo O4 Pb -","- Mo O4 Pb -","- Mo4 O16 Pb4 -","4","0.25","","Lugli, C.; Medici, L.; Saccardo, D.","Natural wulfenite: structural refinement by single-crystal X-ray diffraction","Neues Jahrbuch fur Mineralogie, Monatshefte","1999","1999","","281","288","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009405","4.6","","5.757","","17.38","","90","","91.87","","90","","460.016","","","","","","","","","","","","Clara mine, Oberwolfach, Black Forest, Germany","5","P 1 21/c 1","-P 2ybc","14","","","Cornwallite","- As1.8 Cu5 H4 O12 P0.2 -","- As1.8 Cu5 H4 O12 P0.2 -","- As3.6 Cu10 H8 O24 P0.4 -","2","0.5","","Arlt, T.; Armbruster, T.","Single-crystal X-ray structure refinement of cornwallite, Cu5(AsO4)2(OH)4: A comparison with its polymorph cornubite and the (PO4)-analogue pseudomalachite Locality: Clara mine, Oberwolfach, Black Forest, Germany Note: Biso for O2 and O4 switched to match calculated values","Neues Jahrbuch fur Mineralogie, Monatshefte","1999","1999","","468","480","","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:44",""
"9009512","7.41","","7.41","","17.484","","90","","90","","120","","831.396","","","","","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","Dussertite","- As2 Ba Fe2.52 O14 Sb0.48 -","- As2 Ba Fe2.52 O14 Sb0.48 -","- As6 Ba3 Fe7.56 O42 Sb1.44 -","3","0.0833333","","Kolitsch, U.; Slade, P. G.; Tiekink, E. R. T.; Pring, A.","The structure of antimonian dussertite and the role of antimony in oxysalt minerals Locality: Clara mine, Black Forest, Germany","Mineralogical Magazine","1999","63","","17","26","10.1180/002646199548277","","","","","","","","","","","","","","","","","","","","","has coordinates","303137","2025-11-01","16:23:45",""
"9009513","4.2023","","9.202","","16.6608","","90","","91.829","","90","","643.938","","","","","","","","","","","","Bounds Cliff, St Endellion, Cornwall","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","","Steele, I. M.; Pluth, J. J.; Stanley, C. J.","Crystal structure of barstowite (3PbCl2PbCO3H2O)","Mineralogical Magazine","1999","63","","901","907","10.1180/minmag.1999.063.6.09","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31",""
"9009775","19.4119","","20.2777","","10.0831","","90","","105.273","","90","","3828.81","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Ba3 Fe21.85 O53 Ti9.15 -","- Ba3 Fe21.85 O53 Ti9.15 -","- Ba12 Fe87.4 O212 Ti36.6 -","4","0.5","","Vanderah, T. A.; Wong-Ng W; Toby, B. H.; Browning, V. M.; Shull, R. D.; Geyer, R. G.; Roth, R. S.","Characterization of ternary compounds in the BaO:Fe2O3:TiO2 system: Ba6Fe45Ti17O106 and BaFe11Ti3O23 Note: data from neutron and synchrotron radiation on powder","Journal of Solid State Chemistry","1999","143","","182","197","10.1006/jssc.1999.8075","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009776","19.561","","8.6614","","10.12","","90","","105.62","","90","","1651.27","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ba Fe11.04 O23 Ti2.96 -","- Ba Fe11.04 O23 Ti2.96 -","- Ba4 Fe44.16 O92 Ti11.84 -","4","0.5","","Vanderah, T. A.; Wong-Ng W; Toby, B. H.; Browning, V. M.; Shull, R. D.; Geyer, R. G.; Roth, R. S.","Characterization of ternary compounds in the BaO:Fe2O3:TiO2 system: Ba6Fe45Ti17O106 and BaFe11Ti3O23 Note: data from single-crystal X-ray diffraction","Journal of Solid State Chemistry","1999","143","","182","197","10.1006/jssc.1999.8075","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009808","9.499","","9.503","","9.535","","90","","103.26","","90","","837.768","","","","","","","","","","","","Synthetic","5","P 1 21/n 1","-P 2yn","14","","","Tinsleyite","- Al2 H5 K O11 P2 -","- Al2 H5 K O11 P2 -","- Al8 H20 K4 O44 P8 -","4","1","","Dick, S.","Uber die struktur von synthetischem tinsleyit K[Al2(PO4)2(OH)(H2O)]*(H2O)","Zeitschrift fur Naturforschung B","1999","54","","1385","1390","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""
"9009920","8.4025","","8.4025","","8.4025","","90","","90","","90","","593.233","","","","","","","","","","","","","4","F d -3 m :1","F 4d 2 3 -1d","227","","","","- Fe2 Ni0.5 O4 Zn0.5 -","- Fe2 Ni0.5 O4 Zn0.5 -","- Fe16 Ni4 O32 Zn4 -","8","0.0416667","","Wolska, E.; Wolski, W.; Piszora, P.; Pietrusik, M.; Subrt, J.; Grygar, T.; Nejezchleba, M.","X-ray powder diffraction and Mossbauer studies on the formation of Cd0.5Ni0.5Fe2O4/Zn0.5Ni0.5Fe2O4 spinel solid solutions","International Journal of Inorganic Materials","1999","1","","187","192","10.1016/S1466-6049(99)00028-8","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009921","8.4426","","8.4426","","8.4426","","90","","90","","90","","601.767","","","","","","","","","","","","","5","F d -3 m :1","F 4d 2 3 -1d","227","","","","- Cd0.1 Fe2 Ni0.5 O4 Zn0.4 -","- Cd0.1 Fe2 Ni0.5 O4 Zn0.4 -","- Cd0.8 Fe16 Ni4 O32 Zn3.2 -","8","0.0416667","","Wolska, E.; Wolski, W.; Piszora, P.; Pietrusik, M.; Subrt, J.; Grygar, T.; Nejezchleba, M.","X-ray powder diffraction and Mossbauer studies on the formation of Cd0.5Ni0.5Fe2O4/Zn0.5Ni0.5Fe2O4 spinel solid solutions","International Journal of Inorganic Materials","1999","1","","187","192","10.1016/S1466-6049(99)00028-8","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009922","8.4626","","8.4626","","8.4626","","90","","90","","90","","606.054","","","","","","","","","","","","","5","F d -3 m :1","F 4d 2 3 -1d","227","","","","- Cd0.2 Fe2 Ni0.5 O4 Zn0.3 -","- Cd0.2 Fe2 Ni0.5 O4 Zn0.3 -","- Cd1.6 Fe16 Ni4 O32 Zn2.4 -","8","0.0416667","","Wolska, E.; Wolski, W.; Piszora, P.; Pietrusik, M.; Subrt, J.; Grygar, T.; Nejezchleba, M.","X-ray powder diffraction and Mossbauer studies on the formation of Cd0.5Ni0.5Fe2O4/Zn0.5Ni0.5Fe2O4 spinel solid solutions","International Journal of Inorganic Materials","1999","1","","187","192","10.1016/S1466-6049(99)00028-8","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009923","8.5013","","8.5013","","8.5013","","90","","90","","90","","614.407","","","","","","","","","","","","","5","F d -3 m :1","F 4d 2 3 -1d","227","","","","- Cd0.3 Fe2 Ni0.5 O4 Zn0.2 -","- Cd0.3 Fe2 Ni0.5 O4 Zn0.2 -","- Cd2.4 Fe16 Ni4 O32 Zn1.6 -","8","0.0416667","","Wolska, E.; Wolski, W.; Piszora, P.; Pietrusik, M.; Subrt, J.; Grygar, T.; Nejezchleba, M.","X-ray powder diffraction and Mossbauer studies on the formation of Cd0.5Ni0.5Fe2O4/Zn0.5Ni0.5Fe2O4 spinel solid solutions","International Journal of Inorganic Materials","1999","1","","187","192","10.1016/S1466-6049(99)00028-8","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009924","8.5203","","8.5203","","8.5203","","90","","90","","90","","618.536","","","","","","","","","","","","","5","F d -3 m :1","F 4d 2 3 -1d","227","","","","- Cd0.4 Fe2 Ni0.5 O4 Zn0.1 -","- Cd0.4 Fe2 Ni0.5 O4 Zn0.1 -","- Cd3.2 Fe16 Ni4 O32 Zn0.8 -","8","0.0416667","","Wolska, E.; Wolski, W.; Piszora, P.; Pietrusik, M.; Subrt, J.; Grygar, T.; Nejezchleba, M.","X-ray powder diffraction and Mossbauer studies on the formation of Cd0.5Ni0.5Fe2O4/Zn0.5Ni0.5Fe2O4 spinel solid solutions","International Journal of Inorganic Materials","1999","1","","187","192","10.1016/S1466-6049(99)00028-8","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009925","8.5665","","8.5665","","8.5665","","90","","90","","90","","628.652","","","","","","","","","","","","","4","F d -3 m :1","F 4d 2 3 -1d","227","","","","- Cd0.5 Fe2 Ni0.5 O4 -","- Cd0.5 Fe2 Ni0.5 O4 -","- Cd4 Fe16 Ni4 O32 -","8","0.0416667","","Wolska, E.; Wolski, W.; Piszora, P.; Pietrusik, M.; Subrt, J.; Grygar, T.; Nejezchleba, M.","X-ray powder diffraction and Mossbauer studies on the formation of Cd0.5Ni0.5Fe2O4/Zn0.5Ni0.5Fe2O4 spinel solid solutions","International Journal of Inorganic Materials","1999","1","","187","192","10.1016/S1466-6049(99)00028-8","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009956","13.598","","18.177","","17.79","","90","","90","","90","","4397.17","","","","","","","","","","","","Kuiu Island, Alaska, USA","7","A m m a","-A 2a 2a","63","","","Barrerite","- Al3.974 Ca0.56 H56 K0.864 Na2.476 O47.17 Si14.026 -","- Al3.9744 Ca0.56 H22.34 K0.864 Na2.476 O47.17 Si14.0256 -","- Al15.8976 Ca2.24 H89.36 K3.456 Na9.904 O188.68 Si56.1024 -","4","0.25","","Sacerdoti, M.; Sani, A.; Vezzalini, G.","Structural refinement of two barrerites from Alaska Note: sample 1","Microporous and Mesoporous Materials","1999","30","","103","109","10.1016/S1387-1811(99)00028-1","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9009957","13.586","","18.184","","17.812","","90","","90","","90","","4400.42","","","","","","","","","","","","Kuiu Island, Alaska, USA","7","A m m a","-A 2a 2a","63","","","Barrerite","- Al3.974 Ca0.97 H58 K1.68 Na2.79 O46.3 Si14.026 -","- Al3.9744 Ca0.97 H20.6 K1.68 Na2.79 O46.3 Si14.0256 -","- Al15.8976 Ca3.88 H82.4 K6.72 Na11.16 O185.2 Si56.1024 -","4","0.25","","Sacerdoti, M.; Sani, A.; Vezzalini, G.","Structural refinement of two barrerites from Alaska Note: sample 3","Microporous and Mesoporous Materials","1999","30","","103","109","10.1016/S1387-1811(99)00028-1","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58",""
"9010544","14.2646","","14.2646","","30.186","","90","","90","","120","","5319.31","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","14","R -3 m :H","-R 3 2""","166","","","Eudialyte","- Ca5.58 Ce0.234 Cl0.684 Fe1.77 H1.356 K0.3 La0.096 Mn1.38 Na14.19 Nb0.318 O76.256 Si25.68 Sr0.12 Zr3 -","- Ca5.58 Ce0.234 Cl0.684 Fe1.77 K0.3 La0.096 Mn1.38 Na14.19 Nb0.318 O76.256 Si25.68 Sr0.12 Zr3 -","- Ca16.74 Ce0.702 Cl2.052 Fe5.31 K0.9 La0.288 Mn4.14 Na42.57 Nb0.954 O228.768 Si77.04 Sr0.36 Zr9 -","3","0.0833333","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #1 Note: additional sites with low but unreported occupancies excluded","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010545","14.2277","","14.2277","","29.987","","90","","90","","120","","5256.94","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","18","R 3 m :H","R 3 -2""","160","","","Eudialyte","- Ca4.68 Ce0.45 Cl0.764 Fe2.28 H1.244 K0.3 La0.33 Mn1.86 Na13.02 Nb0.62 Nd0.12 O78.494 Si25.12 Sr0.12 Ta0.04 Ti0.06 Y0.18 Zr3 -","- Ca4.68 Ce0.45 Cl0.764 Fe2.28 K0.3 La0.33 Mn1.86 Na13.02 Nb0.62 Nd0.12 O78.494 Si25.12 Sr0.12 Ta0.04 Ti0.06 Y0.18 Zr3 -","- Ca14.04 Ce1.35 Cl2.292 Fe6.84 K0.9 La0.99 Mn5.58 Na39.06 Nb1.86 Nd0.36 O235.482 Si75.36 Sr0.36 Ta0.12 Ti0.18 Y0.54 Zr9 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #2","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010546","14.2602","","14.2602","","29.98","","90","","90","","120","","5279.75","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","17","R 3 m :H","R 3 -2""","160","","","Kentbrooksite","- Ca4.8 Ce0.75 Cl1.08 Fe1.47 H0.93 K0.24 La0.51 Mn2.34 Na13.08 Nb0.78 Nd0.15 O76.47 Si24.93 Sr0.06 Ta0.07 Y0.18 Zr3 -","- Ca4.8 Ce0.75 Cl1.08 Fe1.47 K0.24 La0.51 Mn2.34 Na13.08 Nb0.78 Nd0.15 O76.47 Si24.93 Sr0.06 Ta0.07 Y0.18 Zr3 -","- Ca14.4 Ce2.25 Cl3.24 Fe4.41 K0.72 La1.53 Mn7.02 Na39.24 Nb2.34 Nd0.45 O229.41 Si74.79 Sr0.18 Ta0.21 Y0.54 Zr9 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #3 Note: additional sites with low but unreported occupancies excluded","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010547","14.1854","","14.1854","","30.101","","90","","90","","120","","5245.6","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","17","R 3 m :H","R 3 -2""","160","","","Kentbrooksite","- Ca3.72 Ce0.39 Cl0.4 Fe1.05 H1.58 K0.24 La0.24 Mn3.42 Na13.35 Nb0.79 Nd0.09 O76.7 Si25.33 Sr0.12 Ti0.12 Y0.12 Zr2.76 -","- Ca3.72 Ce0.39 Cl0.4 Fe1.05 K0.24 La0.24 Mn3.42 Na13.35 Nb0.79 Nd0.09 O76.7 Si25.33 Sr0.12 Ti0.12 Y0.12 Zr2.76 -","- Ca11.16 Ce1.17 Cl1.2 Fe3.15 K0.72 La0.72 Mn10.26 Na40.05 Nb2.37 Nd0.27 O230.1 Si75.99 Sr0.36 Ti0.36 Y0.36 Zr8.28 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #4 Note: additional sites with low but unreported occupancies excluded","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010548","14.2084","","14.2084","","29.959","","90","","90","","120","","5237.79","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","16","R 3 :H","R 3","146","","","Oneillite","- Ca1.77 Ce1.08 Cl0.721 Fe1.425 H1.269 K0.195 La0.63 Mn3.72 Na13.59 Nb0.93 Nd0.33 O76.769 Pr0.09 Si25 Y0.24 Zr3.18 -","- Ca1.77 Ce1.08 Cl0.721 Fe1.425 K0.195 La0.63 Mn3.72 Na13.59 Nb0.93 Nd0.33 O76.769 Pr0.09 Si25 Y0.24 Zr3.18 -","- Ca5.31 Ce3.24 Cl2.163 Fe4.275 K0.585 La1.89 Mn11.16 Na40.77 Nb2.79 Nd0.99 O230.307 Pr0.27 Si75 Y0.72 Zr9.54 -","3","0.333333","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #5","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010549","14.2959","","14.2959","","30.084","","90","","90","","120","","5324.63","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","15","R 3 m :H","R 3 -2""","160","","","Khomyakovite","- Ca6.39 Ce0.039 Cl0.636 Fe2.1 H1.362 K0.36 La0.036 Mn0.81 Na11.37 Nb0.31 O77.092 Si25 Sr2.745 W0.52 Zr2.97 -","- Ca6.39 Ce0.039 Cl0.636 Fe2.1 K0.36 La0.036 Mn0.81 Na11.37 Nb0.31 O77.092 Si25 Sr2.745 W0.52 Zr2.97 -","- Ca19.17 Ce0.117 Cl1.908 Fe6.3 K1.08 La0.108 Mn2.43 Na34.11 Nb0.93 O231.276 Si75 Sr8.235 W1.56 Zr8.91 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #6","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010550","14.256","","14.256","","30.351","","90","","90","","120","","5341.94","","","","","","","","","","","","Kipawa alkaline complex, Villedieu township, Temiscaminque County, Quebec, Canada","14","R -3 m :H","-R 3 2""","166","","","Eudialyte","- Ca8.04 Ce0.15 Cl0.972 Fe1.53 H1.036 K0.18 La0.09 Mn0.72 Na11.82 Nb0.288 O75.776 Si25.708 Y0.66 Zr3 -","- Ca8.04 Ce0.15 Cl0.972 Fe1.53 K0.18 La0.09 Mn0.72 Na11.82 Nb0.288 O75.776 Si25.708 Y0.66 Zr3 -","- Ca24.12 Ce0.45 Cl2.916 Fe4.59 K0.54 La0.27 Mn2.16 Na35.46 Nb0.864 O227.328 Si77.124 Y1.98 Zr9 -","3","0.0833333","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Locality: Kipawa alkaline complex, Villedieu township, Temiscaminque County, Quebec, Canada Sample: #7 Note: additional sites with low but unreported occupancies excluded","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010551","14.225","","14.225","","30.302","","90","","90","","120","","5310.15","","","","","","","","","","","","Kipawa alkaline complex, Villedieu township, Temiscaminque County, Quebec, Canada","23","R -3 m :H","-R 3 2""","166","","","Eudialyte","- Ca6.42 Ce0.24 Cl0.96 Dy0.06 Er0.06 F0.534 Fe1.56 Gd0.06 H0.51 K0.42 La0.06 Mg0.096 Mn0.54 Na12.324 Nb0.16 Nd0.06 O75.13 Si25.62 Sr0.06 Ti0.22 Y0.78 Yb0.06 Zr3 -","- Ca6.42 Ce0.24 Cl0.96 Dy0.06 Er0.06 F0.534 Fe1.56 Gd0.06 K0.42 La0.06 Mg0.096 Mn0.54 Na12.324 Nb0.16 Nd0.06 O75.13 Si25.62 Sr0.06 Ti0.22 Y0.78 Yb0.06 Zr3 -","- Ca19.26 Ce0.72 Cl2.88 Dy0.18 Er0.18 F1.602 Fe4.68 Gd0.18 K1.26 La0.18 Mg0.288 Mn1.62 Na36.972 Nb0.48 Nd0.18 O225.39 Si76.86 Sr0.18 Ti0.66 Y2.34 Yb0.18 Zr9 -","3","0.0833333","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Locality: Kipawa alkaline complex, Villedieu township, Temiscaminque County, Quebec, Canada Sample: #8 Note: additional sites with low but unreported occupancies excluded","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010552","14.1697","","14.1697","","30.142","","90","","90","","120","","5241.12","","","","","","","","","","","","Saint-Amable sill, Varennes, Verchares County, Canada","16","R -3 m :H","-R 3 2""","166","","","Eudialyte","- Ca3.78 Ce0.18 Cl0.444 Fe1.53 H0.564 K0.36 La0.18 Mn2.28 Na13.5 Nb0.08 O75.144 Si25.92 Sr0.12 Ti0.75 Y0.18 Zr2.67 -","- Ca3.78 Ce0.18 Cl0.444 Fe1.53 K0.36 La0.18 Mn2.28 Na13.5 Nb0.08 O75.144 Si25.92 Sr0.12 Ti0.75 Y0.18 Zr2.67 -","- Ca11.34 Ce0.54 Cl1.332 Fe4.59 K1.08 La0.54 Mn6.84 Na40.5 Nb0.24 O225.432 Si77.76 Sr0.36 Ti2.25 Y0.54 Zr8.01 -","3","0.0833333","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #9 Note: additional sites with low but unreported occupancies excluded","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010553","14.273","","14.273","","30.131","","90","","90","","120","","5315.87","","","","","","","","","","","","Gardiner complex, East Greenland","15","R -3 m :H","-R 3 2""","166","","","Eudialyte","- Ca6.6 Ce0.03 Cl0.998 Fe1.89 H0.998 K0.36 Mn0.69 Na13.08 Nb0.16 O75.098 Si25.88 Sr0.66 Ti0.21 Y0.09 Zr2.79 -","- Ca6.6 Ce0.03 Cl0.998 Fe1.89 K0.36 Mn0.69 Na13.08 Nb0.16 O75.098 Si25.88 Sr0.66 Ti0.21 Y0.09 Zr2.79 -","- Ca19.8 Ce0.09 Cl2.994 Fe5.67 K1.08 Mn2.07 Na39.24 Nb0.48 O225.294 Si77.64 Sr1.98 Ti0.63 Y0.27 Zr8.37 -","3","0.0833333","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #10 Note: additional sites with low but unreported occupancies excluded","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010554","14.271","","14.271","","30.16","","90","","90","","120","","5319.5","","","","","","","","","","","","Gardiner complex, East Greenland","17","R 3 m :H","R 3 -2""","160","","","Eudialyte","- Ba0.06 Ca6.78 Ce0.06 Cl0.841 Fe1.05 H1.139 K0.3 La0.06 Mn1.44 Na11.64 Nb0.715 O76.004 Si25.38 Sr1.32 Ti0.345 Y0.06 Zr2.58 -","- Ba0.06 Ca6.78 Ce0.06 Cl0.841 Fe1.05 K0.3 La0.06 Mn1.44 Na11.64 Nb0.715 O76.004 Si25.38 Sr1.32 Ti0.345 Y0.06 Zr2.58 -","- Ba0.18 Ca20.34 Ce0.18 Cl2.523 Fe3.15 K0.9 La0.18 Mn4.32 Na34.92 Nb2.145 O228.012 Si76.14 Sr3.96 Ti1.035 Y0.18 Zr7.74 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #11","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010555","14.2691","","14.2691","","30.163","","90","","90","","120","","5318.61","","","","","","","","","","","","Gardiner complex, East Greenland","15","R -3 m :H","-R 3 2""","166","","","Eudialyte","- Ca6.63 Ce0.03 Cl Fe1.77 H K0.27 Mn0.75 Na13.26 Nb0.26 O76.26 Si25.7 Sr0.75 Ti0.21 Y0.06 Zr2.79 -","- Ca6.63 Ce0.03 Cl Fe1.77 K0.27 Mn0.75 Na13.26 Nb0.26 O76.26 Si25.7 Sr0.75 Ti0.21 Y0.06 Zr2.79 -","- Ca19.89 Ce0.09 Cl3 Fe5.31 K0.81 Mn2.25 Na39.78 Nb0.78 O228.78 Si77.1 Sr2.25 Ti0.63 Y0.18 Zr8.37 -","3","0.0833333","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #12 Note: additional sites with low but unreported occupancies excluded","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010556","14.199","","14.199","","30.139","","90","","90","","120","","5262.29","","","","","","","","","","","","Amdrup Fjord, Kangerdlugssuaq intrusion, Eastern Greenland","20","R 3 m :H","R 3 -2""","160","","","Kentbrooksite","- Al0.15 Ca3.36 Ce0.71 Cl0.269 F1.541 Fe0.75 H0.192 Hf0.06 K0.3 La0.58 Mn3.78 Na13.93 Nb0.55 Nd0.138 O75.752 Si25.11 Sr0.15 Ti0.2 Y0.42 Zr2.95 -","- Al0.15 Ca3.36 Ce0.69 Cl0.269 F1.541 Fe0.75 Hf0.06 K0.3 La0.57 Mn3.78 Na12.96 Nb0.55 Nd0.138 O75.752 Si25.11 Sr0.15 Ti0.2 Y0.42 Zr2.95 -","- Al0.45 Ca10.08 Ce2.07 Cl0.807 F4.623 Fe2.25 Hf0.18 K0.9 La1.71 Mn11.34 Na38.88 Nb1.65 Nd0.414 O227.256 Si75.33 Sr0.45 Ti0.6 Y1.26 Zr8.85 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #13","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","285096","2023-07-08","08:53:35",""
"9010557","14.2257","","14.2257","","30.006","","90","","90","","120","","5258.79","","","","","","","","","","","","","17","R -3 m :H","-R 3 2""","166","","","Eudialyte","- Ca5.22 Ce0.192 Cl1.6 Fe2.61 H0.4 K0.3 La0.018 Mn0.6 Na14.28 Nb0.128 Nd0.036 O74.94 Si25.918 Sr0.06 Ti0.09 Y0.18 Zr2.85 -","- Ca5.22 Ce0.192 Cl1.6 Fe2.61 K0.3 La0.018 Mn0.6 Na14.28 Nb0.128 Nd0.036 O74.94 Si25.918 Sr0.06 Ti0.09 Y0.18 Zr2.85 -","- Ca15.66 Ce0.576 Cl4.8 Fe7.83 K0.9 La0.054 Mn1.8 Na42.84 Nb0.384 Nd0.108 O224.82 Si77.754 Sr0.18 Ti0.27 Y0.54 Zr8.55 -","3","0.0833333","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Loclaity: Narssarssuk pegmatite, South Greenland Sample: #14 Note: additional sites with low but unreported occupancies excluded","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34",""
"9010558","14.242","","14.242","","30.004","","90","","90","","120","","5270.5","","","","","","","","","","","","Illimaussaq complex, South Greenland","16","R -3 m :H","-R 3 2""","166","","","Eudialyte","- Ca5.61 Ce0.24 Cl1.162 Fe3.24 H0.84 K0.3 La0.132 Mn0.24 Na14.04 Nb0.2 Nd0.138 O75.54 Si25.83 Sr0.06 Y0.12 Zr2.94 -","- Ca5.61 Ce0.24 Cl1.162 Fe3.24 K0.3 La0.132 Mn0.24 Na14.04 Nb0.2 Nd0.138 O75.54 Si25.83 Sr0.06 Y0.12 Zr2.94 -","- Ca16.83 Ce0.72 Cl3.486 Fe9.72 K0.9 La0.396 Mn0.72 Na42.12 Nb0.6 Nd0.414 O226.62 Si77.49 Sr0.18 Y0.36 Zr8.82 -","3","0.0833333","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #15 Note: additional sites with low but unreported occupancies excluded Note: y(M3a) adjusted to satisfy symmetry constraints","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34",""
"9010559","14.2784","","14.2784","","30.089","","90","","90","","120","","5312.48","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","16","R 3 m :H","R 3 -2""","160","","","Kentbrooksite","- Ca4.95 Ce0.582 Cl0.45 Fe1.05 H1.549 K0.33 La0.408 Mn2.49 Na13.05 Nb0.95 Nd0.15 O77.549 Si24.93 Sr0.72 Y0.24 Zr2.97 -","- Ca4.95 Ce0.582 Cl0.45 Fe1.05 K0.33 La0.408 Mn2.49 Na13.05 Nb0.95 Nd0.15 O77.549 Si24.93 Sr0.72 Y0.24 Zr2.97 -","- Ca14.85 Ce1.746 Cl1.35 Fe3.15 K0.99 La1.224 Mn7.47 Na39.15 Nb2.85 Nd0.45 O232.647 Si74.79 Sr2.16 Y0.72 Zr8.91 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #16","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010560","14.22","","14.22","","30.15","","90","","90","","120","","5279.8","","","","","","","","","","","","Locality: Burpala massif, Siberia, Russia","20","R 3 m :H","R 3 -2""","160","","","Kentbrooksite","- Al0.84 Ba0.03 Ca3.51 Ce0.573 Cl0.798 F1.2 Fe1.5 K0.285 La0.327 Mn2.16 Na12.96 Nb0.46 Nd0.327 O74.93 Si24.94 Sr0.57 Ti0.36 Y0.51 Yb0.141 Zr3.086 -","- Al0.84 Ba0.03 Ca3.51 Ce0.573 Cl0.798 F1.2 Fe1.5 K0.285 La0.327 Mn2.16 Na12.96 Nb0.46 Nd0.327 O74.93 Si24.94 Sr0.57 Ti0.36 Y0.51 Yb0.141 Zr3.086 -","- Al2.52 Ba0.09 Ca10.53 Ce1.719 Cl2.394 F3.6 Fe4.5 K0.855 La0.981 Mn6.48 Na38.88 Nb1.38 Nd0.981 O224.79 Si74.82 Sr1.71 Ti1.08 Y1.53 Yb0.423 Zr9.258 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #17 Note: additional sites with low but unreported occupancies excluded Note: X2d reported but missing z-coordinate","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51",""
"9010716","15.88","","15.88","","7.118","","90","","90","","120","","1554.5","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","Liddicoatite","- Al7 B3 Ca0.483 H3.333 K0.105 Li2 Na0.412 O31 Si6 -","- Al6.99999 B3 Ca0.483 H3.33333 K0.105 Li2.00001 Na0.412 O31 Si6 -","- Al21 B9 Ca1.449 H9.99999 K0.315 Li6.00003 Na1.236 O93 Si18 -","3","0.166667","","Aurisicchio, C.; Demartin, F.; Ottolini, L.; Pezzotta, F.","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 1 Locality: Madagascar","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34",""
"9010717","15.882","","15.882","","7.115","","90","","90","","120","","1554.23","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","Liddicoatite","- Al7 B3 Ca0.452 H3.333 K0.04 Li2 Na0.435 O31 Si6 -","- Al6.99999 B3 Ca0.452 H3.33333 K0.04 Li2.00001 Na0.435 O31 Si6 -","- Al21 B9 Ca1.356 H9.99999 K0.12 Li6.00003 Na1.305 O93 Si18 -","3","0.166667","","Aurisicchio, C.; Demartin, F.; Ottolini, L.; Pezzotta, F.","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 2 Locality: Madagascar","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34",""
"9011518","6.03","","13.744","","5.562","","90","","95.75","","90","","458.639","","","","","","","","","","","","Tolbachik volcano, Kamchatka, Russia","4","P 1 21/c 1","-P 2ybc","14","","","Georgbokiite","- Cl2 Cu5 O8 Se2 -","- Cl2 Cu5 O8 Se2 -","- Cl4 Cu10 O16 Se4 -","2","0.5","","Krivovichev, S. V.; Shuvalov, R. R.; Semenova, T. F.; Filatov, S. K.","Crystal chemistry of inorganic compounds based on chains of oxocentered tetrahedra. III. Crystal structure of georgbokiite, Cu5O2(SeO3)2Cl2","Zeitschrift fur Kristallographie","1999","214","","135","138","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:44",""
"9011519","10.205","","10.504","","7.01","","90.38","","110.1","","71.82","","666.159","","","","","","","","","","","","Waidhaus, Bavaria, Germany","5","P -1","-P 1","2","","","Kastningite","- Al2 H18 Mn O18 P2 -","- Al2 H18 Mn O18 P2 -","- Al4 H36 Mn2 O36 P4 -","2","1","","Adiwidjaja, G.; Friese, K.; Klaska, K. H.; Schluter, J.","The crystal structure of kastningite (Mn,Fe,Mg)(H2O)4[Al2(OH)2(H2O)2(PO4)2]*2H2O - a new hydroxyl aquated orthophosphate hydrate mineral Locality: Waidhaus, Bavaria, Germany Note: changed sign of Oh1(y)","Zeitschrift fur Kristallographie","1999","214","","465","468","","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9011644","8.0242","","4.7961","","4.776","","90","","90","","90","","183.804","","","","","","","","38400000","","","","","1","C m c e","-C 2ac 2","64","Silicon","","","- Si -","- Si -","- Si16 -","16","1","","Hanfland, M.; Schwarz, U.; Syassen, K.; Takemura, K.","Crystal structure of the high-pressure phase silicon VI Locality: synthetic Sample: at P = 38.4 GPa Note: phase VI","Physical Review Letters","1999","82","","1197","1200","10.1103/PhysRevLett.82.1197","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011645","7.9686","","4.7759","","4.7546","","90","","90","","90","","180.947","","","","","","","","42500000","","","","","1","C m c e","-C 2ac 2","64","Silicon","","","- Si -","- Si -","- Si16 -","16","1","","Hanfland, M.; Schwarz, U.; Syassen, K.; Takemura, K.","Crystal structure of the high-pressure phase silicon VI Locality: synthetic Sample: at P = 42.5 GPa Note: phase VI","Physical Review Letters","1999","82","","1197","1200","10.1103/PhysRevLett.82.1197","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011646","7.92","","4.7586","","4.7361","","90","","90","","90","","178.495","","","","","","","","45500000","","","","","1","C m c e","-C 2ac 2","64","Silicon","","","- Si -","- Si -","- Si16 -","16","1","","Hanfland, M.; Schwarz, U.; Syassen, K.; Takemura, K.","Crystal structure of the high-pressure phase silicon VI Locality: synthetic Sample: at P = 45.5 GPa Note: phase VI","Physical Review Letters","1999","82","","1197","1200","10.1103/PhysRevLett.82.1197","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011666","5.5463","","5.5463","","5.5463","","90","","90","","90","","170.612","","","","","","","","0","","","","Synthetic","2","F m -3 m","-F 4 2 3","225","","","Chlorargyrite","- Ag Cl -","- Ag Cl -","- Ag4 Cl4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 0.0 GPa, Phase I","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011667","5.461","","5.461","","5.461","","90","","90","","90","","162.861","","","","","","","","2500000","","","","Synthetic","2","F m -3 m","-F 4 2 3","225","","","Chlorargyrite","- Ag Cl -","- Ag Cl -","- Ag4 Cl4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 2.5 GPa, Phase I","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011668","5.4138","","5.4138","","5.4138","","90","","90","","90","","158.674","","","","","","","","3900000","","","","","2","F m -3 m","-F 4 2 3","225","","","Chlorargyrite","- Ag Cl -","- Ag Cl -","- Ag4 Cl4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 3.9 GPa, Phase I","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011669","5.382","","5.382","","5.382","","90","","90","","90","","155.895","","","","","","","","5200000","","","","Synthetic","2","F m -3 m","-F 4 2 3","225","","","Chlorargyrite","- Ag Cl -","- Ag Cl -","- Ag4 Cl4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 5.2 Gpa, Phase I","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011670","5.3537","","5.3537","","5.3537","","90","","90","","90","","153.448","","","","","","","","6200000","","","","Synthetic","2","F m -3 m","-F 4 2 3","225","","","Chlorargyrite","- Ag Cl -","- Ag Cl -","- Ag4 Cl4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 6.2 Gpa, Phase I","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011671","5.346","","5.346","","5.346","","90","","90","","90","","152.787","","","","","","","","6600000","","","","Synthetic","2","F m -3 m","-F 4 2 3","225","","","Chlorargyrite","- Ag Cl -","- Ag Cl -","- Ag4 Cl4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 6.6 GPa, Phase I","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011672","3.587","","3.992","","5.307","","90","","98.4","","90","","75.177","","","","","","","","6600000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Cl -","- Ag Cl -","- Ag2 Cl2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 6.6 Gpa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011673","3.561","","3.994","","5.271","","90","","99.12","","90","","74.02","","","","","","","","7600000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Cl -","- Ag Cl -","- Ag2 Cl2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 7.6 Gpa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011674","3.548","","3.997","","5.259","","90","","99.75","","90","","73.503","","","","","","","","7900000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Cl -","- Ag Cl -","- Ag2 Cl2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 7.9 Gpa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011675","3.53","","4.011","","5.243","","90","","100.69","","90","","72.946","","","","","","","","8600000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Cl -","- Ag Cl -","- Ag2 Cl2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 8.6 Gpa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011676","3.497","","4.009","","5.214","","90","","102.11","","90","","71.471","","","","","","","","10000000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Cl -","- Ag Cl -","- Ag2 Cl2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 10.0 Gpa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011677","3.481","","4.016","","5.191","","90","","102.87","","90","","70.746","","","","","","","","10800000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Cl -","- Ag Cl -","- Ag2 Cl2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 10.8 GPa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011678","3.399","","10.124","","4.032","","90","","90","","90","","138.747","","","","","","","","10800000","","","","","2","C m c m","-C 2c 2","63","","","","- Ag Cl -","- Ag Cl -","- Ag4 Cl4 -","4","0.25","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 10.8 Gpa, Phase III","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011679","3.369","","10.023","","4.053","","90","","90","","90","","136.86","","","","","","","","12700000","","","","","2","C m c m","-C 2c 2","63","","","","- Ag Cl -","- Ag Cl -","- Ag4 Cl4 -","4","0.25","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 12.7 GPa, Phase III","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011680","3.337","","9.907","","4.095","","90","","90","","90","","135.379","","","","","","","","14200000","","","","","2","C m c m","-C 2c 2","63","","","","- Ag Cl -","- Ag Cl -","- Ag4 Cl4 -","4","0.25","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 14.2 GPa, Phase III","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011681","3.32","","9.835","","4.108","","90","","90","","90","","134.135","","","","","","","","16100000","","","","","2","C m c m","-C 2c 2","63","","","","- Ag Cl -","- Ag Cl -","- Ag4 Cl4 -","4","0.25","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 16.1 Gpa, Phase III","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011682","5.7721","","5.7721","","5.7721","","90","","90","","90","","192.31","","","","","","","","0","","","","Synthetic","2","F m -3 m","-F 4 2 3","225","","","Bromargyrite","- Ag Br -","- Ag Br -","- Ag4 Br4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 0.0 GPa, Phase I","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011683","5.7103","","5.7103","","5.7103","","90","","90","","90","","186.199","","","","","","","","1500000","","","","Synthetic","2","F m -3 m","-F 4 2 3","225","","","Bromargyrite","- Ag Br -","- Ag Br -","- Ag4 Br4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 1.5 GPa, Phase I","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011684","5.6344","","5.6344","","5.6344","","90","","90","","90","","178.872","","","","","","","","3900000","","","","Synthetic","2","F m -3 m","-F 4 2 3","225","","","Bromargyrite","- Ag Br -","- Ag Br -","- Ag4 Br4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 3.9 GPa, Phase I","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011685","5.5673","","5.5673","","5.5673","","90","","90","","90","","172.558","","","","","","","","6200000","","","","Synthetic","2","F m -3 m","-F 4 2 3","225","","","Bromargyrite","- Ag Br -","- Ag Br -","- Ag4 Br4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 6.2 GPa, Phase I","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011686","5.5203","","5.5203","","5.5203","","90","","90","","90","","168.224","","","","","","","","7900000","","","","Synthetic","2","F m -3 m","-F 4 2 3","225","","","Bromargyrite","- Ag Br -","- Ag Br -","- Ag4 Br4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 7.9 GPa, Phase I","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011687","3.821","","3.98","","5.513","","90","","95.9","","90","","83.395","","","","","","","","7900000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Br -","- Ag Br -","- Ag2 Br2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 7.9 GPa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011688","3.818","","3.981","","5.51","","90","","96.07","","90","","83.279","","","","","","","","8100000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Br -","- Ag Br -","- Ag2 Br2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 8.1 GPa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011689","3.791","","3.984","","5.496","","90","","97.05","","90","","82.38","","","","","","","","9000000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Br -","- Ag Br -","- Ag2 Br2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 9.0 GPa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011690","3.787","","3.985","","5.487","","90","","97.94","","90","","82.012","","","","","","","","9300000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Br -","- Ag Br -","- Ag2 Br2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 9.3 GPa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011691","3.749","","4.007","","5.464","","90","","98.56","","90","","81.167","","","","","","","","10200000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Br -","- Ag Br -","- Ag2 Br2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 10.2 GPa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011692","3.691","","4.018","","5.45","","90","","100.87","","90","","79.376","","","","","","","","12700000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag Br -","- Ag Br -","- Ag2 Br2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 12.7 GPa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011693","6.4991","","6.4991","","6.4991","","90","","90","","90","","274.511","","","","","","","","0","","","","Synthetic","2","F -4 3 m","F -4 2 3","216","","","Miersite","- Ag I -","- Ag I -","- Ag4 I4 -","4","0.0416667","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 0.0 GPa, Phase II'","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011694","4.599","","4.599","","7.524","","90","","90","","120","","137.818","","","","","","","","0","","","","","2","P 63 m c","P 6c -2c","186","","","Iodargyrite","- Ag I -","- Ag I -","- Ag2 I2 -","2","0.166667","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 0.0 GPa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011695","6.0339","","6.0339","","6.0339","","90","","90","","90","","219.682","","","","","","","","1500000","","","","","2","F m -3 m","-F 4 2 3","225","","","Miersite","- Ag I -","- Ag I -","- Ag4 I4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 1.5 GPa, Phase III","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011696","5.9577","","5.9577","","5.9577","","90","","90","","90","","211.464","","","","","","","","3400000","","","","","2","F m -3 m","-F 4 2 3","225","","","Miersite","- Ag I -","- Ag I -","- Ag4 I4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 3.4 GPa, Phase III","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011697","5.857","","5.857","","5.857","","90","","90","","90","","200.921","","","","","","","","6400000","","","","","2","F m -3 m","-F 4 2 3","225","","","Miersite","- Ag I -","- Ag I -","- Ag4 I4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 6.4 GPa, Phase III","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011698","5.7894","","5.7894","","5.7894","","90","","90","","90","","194.044","","","","","","","","8900000","","","","","2","F m -3 m","-F 4 2 3","225","","","Miersite","- Ag I -","- Ag I -","- Ag4 I4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 8.9 GPa, Phase III","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011699","5.732","","5.732","","5.732","","90","","90","","90","","188.33","","","","","","","","11100000","","","","","2","F m -3 m","-F 4 2 3","225","","","Miersite","- Ag I -","- Ag I -","- Ag4 I4 -","4","0.0208333","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 11.1 GPa, Phase III","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011700","4.056","","4.057","","5.615","","90","","98.43","","90","","91.398","","","","","","","","11300000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag I -","- Ag I -","- Ag2 I2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 11.3 GPa, Phase V","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011701","4.052","","4.052","","5.604","","90","","98.7","","90","","90.952","","","","","","","","11700000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag I -","- Ag I -","- Ag2 I2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 11.7 GPa, Phase V","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011702","4.007","","4.064","","5.546","","90","","100.39","","90","","88.833","","","","","","","","14300000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag I -","- Ag I -","- Ag2 I2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 14.3 GPa, Phase V","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011703","4.001","","4.067","","5.545","","90","","100.55","","90","","88.703","","","","","","","","14500000","","","","","2","P 1 21 1","P 2yb","4","","","","- Ag I -","- Ag I -","- Ag2 I2 -","2","1","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 14.5 GPa, Phase V","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011762","12.422","","12.422","","12.422","","90","","90","","90","","1916.79","","","","","","","","","","","","Bellberg volcano, Eifel, Germany","7","I a -3 d","-I 4bd 2c 3","230","","","Schaferite","- Ca2.301 Mg1.85 Mn0.15 Na0.699 O12 P0.18 V2.82 -","- Ca2.301 Mg1.85 Mn0.15 Na0.699 O12 P0.18 V2.82 -","- Ca18.408 Mg14.8 Mn1.2 Na5.592 O96 P1.44 V22.56 -","8","0.0833333","","Krause, W.; Blass, G.; Effenberger, H.","Schaferite, a new vanadium garnet from the Bellberg volcano, Eifel, Germany","Neues Jahrbuch fur Mineralogie, Monatshefte","1999","1999","","123","124","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011763","9.027","","6.239","","7.433","","90","","115.19","","90","","378.812","","","","","","","","","","","","Schneeberg, Saxony, Germany","7","C 1 2/m 1","-C 2y","12","","","Cobaltlotharmeyerite","- As2 Ca Co0.97 Fe0.67 H2 Ni0.36 O10 -","- As2 Ca Co0.97 Fe0.67 H2 Ni0.36 O10 -","- As4 Ca2 Co1.94 Fe1.34 H4 Ni0.72 O20 -","2","0.25","","Krause, W.; Effenberger, H.; Bernhardt, H. J.; Martin, M.","Cobaltlotharmeyerite, Ca(Co,Fe,Ni)2(AsO4)2(OH,H2O)2, a new mineral from Schneeberg, Germany","Neues Jahrbuch fur Mineralogie, Monatshefte","1999","1999","","505","517","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:27",""
"9011764","7.243","","7.243","","17.38539","","90","","90","","120","","789.863","","","","","","","","","","","","Spring Creek mine, South Australia","7","R -3 m :H","-R 3 2""","166","","","Springcreekite","- Ba F0.06 Fe1.29 H16.14 O13.94 P2 V1.71 -","- Ba F0.06 Fe1.29 H7.74 O13.94 P2 V1.71 -","- Ba3 F0.18 Fe3.87 H23.22 O41.82 P6 V5.13 -","3","0.0833333","","Kolitsch, U.; Taylor, M. R.; Fallon, G. D.; Pring, A.","Springcreekite, BaV(3+)3(PO4)2(OH,H2O)6, a new member of the crandallite group, from the Spring Creek mine, South Australia: the first natural V(3+)-member of the alunite family and its crystal structure Locality: Spring Creek mine, South Australia","Neues Jahrbuch fur Mineralogie, Monatshefte","1999","1999","","529","544","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:27",""
"9011805","12.16","","12.16","","7.56","","90","","90","","90","","1117.86","","","","","","","","","","","","McBride Province, Australia","7","I 4/m","-I 4","87","","","Silvialite","- C0.478 Al4.872 Ca2.452 Na1.548 O27.524 S0.522 Si7.128 -","- C0.478 Al4.872 Ca2.452 Na1.548 O27.524 S0.522 Si7.128 -","- C0.956 Al9.744 Ca4.904 Na3.096 O55.048 S1.044 Si14.256 -","2","0.125","","Teertstra, D. K.; Schindler, M.; Sherriff, B. L.; Hawthorne, F. C.","Silvialite, a new sulfate-dominant member of the scapolite group with an Al-Si composition near the I4/m-P42/n phase transition","Mineralogical Magazine","1999","63","","321","329","10.1180/002646199548547","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011938","10.502","","10.502","","14.184","","90","","90","","120","","1354.79","","","","","","","","","","","","","7","P 6/m c c","-P 6 2c","192","","","Shibkovite","- Ca1.26 K2.26 Mn0.4 Na0.34 O30 Si12 Zn3 -","- Ca1.26 K2.26 Mn0.4 Na0.34 O30 Si12 Zn3 -","- Ca2.52 K4.52 Mn0.8 Na0.68 O60 Si24 Zn6 -","2","0.0833333","","Sokolova, E. V.; Rybakov, V. B.; Pautov, L. A.","Crystal structure of shibkovite","Doklady Akademii Nauk SSSR","1999","369","","378","380","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9012229","5.103","","6.653","","9.012","","73.4","","78.03","","76.76","","282.09","","","","","","","","","","","","Synthetic","5","P -1","-P 1","2","","","Rodalquilarite","- Cl Fe2 H3 O12 Te4 -","- Cl Fe2 H3 O12 Te4 -","- Cl Fe2 H3 O12 Te4 -","1","0.5","","Feger, C. R.; Kolis, J. W.; Gorny, K.; Pennington, C.","Rodalquilarite revisited: the hydrothermal synthesis and structural reinvestigation of H3Fe2(TeO3)4Cl","Journal of Solid State Chemistry","1999","143","","254","259","10.1006/jssc.1998.8102","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012350","6.943","","6.943","","17.227","","90","","90","","120","","719.175","","","","2","","","","","","","","","5","R -3 m :H","-R 3 2""","166","","","Alunite (deuterated)","- Al3 D12 K0.875 O14.125 S2 -","- Al3 D12 K0.875 O14.125 S2 -","- Al9 D36 K2.625 O42.375 S6 -","3","0.0833333","","Schukow, H.; Breitinger, D. K.; Zeiske, T.; Kubanek, F.; Mohr, J.; Schwab, R. G.","Localization of hydrogen and content of oxonium cations in alunite via neutron diffraction Locality: synthetic Sample: T = 2 K","Zeitschrift fur Anorganische und Allgemeine Chemie","1999","625","","1047","1050","10.1002/(SICI)1521-3749(199906)625:6<1047::AID-ZAAC1047>3.0.CO;2-F","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012529","7.573","","15.838","","9.3126","","90","","113.55","","90","","1023.93","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- Ca2 H4 In O13 P3 -","- Ca2 H4 In O13 P3 -","- Ca8 H16 In4 O52 P12 -","4","0.5","","X. Tang; A. Jones; A. Lachgar; B. J. Gross; J. L. Yarger","Synthesis, crystal structure, NMR studies, and thermal stability of mixed iron-indium phosphates with quasi-one-dimensional frameworks","Inorganic Chemistry","1999","38","","6032","6038","10.1021/ic9905906","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9012635","15.1","","17.6","","5.29","","90","","100.5","","90","","1382.33","","","","","","","","","","","","Yubileinaya pegmatite, Karnasurt Mountain, Lovozero Massif,","6","C 1 2/m 1","-C 2y","12","","","Raite","- H19.2 Mn3 Na3 O32 Si8 Ti0.25 -","- H22 Mn3 Na3 O32 Si8 Ti0.25 -","- H44 Mn6 Na6 O64 Si16 Ti0.5 -","2","0.25","","Pushcharovsky, D. Y.; Pekov, I. V.; Pluth, J. J.; Smith, J. V.; Ferraris, G.; Vinogradova, S. A.; Arakcheeva, A. V.; Soboleva, S. V.; Semenov, E. I.","Raite, manganonordite-(Ce), and ferronordite-(Ce) from the Lovozero massif: Crystal structures and mineralogical geochemistry Kola Peninsula, Russia","Crystallography Reports","1999","44","","565","574","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07",""
"9012636","14.44","","5.187","","19.82","","90","","90","","90","","1484.52","","","","","","","","","","","","Lovozero Massif","13","P c c a","-P 2a 2ac","54","","","Manganonordite-(Ce)","- Ba0.019 Ca0.051 Ce0.52 Fe0.23 La0.43 Mg0.1 Mn0.42 Na2.949 Nd0.05 O17 Si6 Sr0.981 Zn0.24 -","- Ba0.019 Ca0.051 Ce0.52 Fe0.23 La0.43 Mg0.1 Mn0.42 Na2.949 Nd0.05 O17 Si6 Sr0.981 Zn0.24 -","- Ba0.076 Ca0.204 Ce2.08 Fe0.92 La1.72 Mg0.4 Mn1.68 Na11.796 Nd0.2 O68 Si24 Sr3.924 Zn0.96 -","4","0.5","","Pushcharovsky, D. Y.; Pekov, I. V.; Pluth, J. J.; Smith, J.; Ferraris, G.; Vinogradova, S. A.; Arakcheeva, A. V.; Soboleva, S. V.; Semenov, E. I.","Raite, manganonordite-(Ce), and ferronordite-(Ce) from the Lovozero massif: Crystal structures and mineralogical geochemistry","Crystallography Reports","1999","44","","565","574","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012637","14.46","","5.194","","19.874","","90","","90","","90","","1492.64","","","","","","","","","","","","Lovozero Massif","14","P c c a","-P 2a 2ac","54","","","Ferronordite-(Ce)","- Ba0.02 Ca0.099 Ce0.51 Fe0.42 La0.42 Mg0.1 Mn0.26 Na2.901 Nd0.04 O17 Pr0.03 Si6 Sr0.98 Zn0.22 -","- Ba0.02 Ca0.099 Ce0.51 Fe0.42 La0.42 Mg0.1 Mn0.26 Na2.901 Nd0.04 O17 Pr0.03 Si6 Sr0.98 Zn0.22 -","- Ba0.08 Ca0.396 Ce2.04 Fe1.68 La1.68 Mg0.4 Mn1.04 Na11.604 Nd0.16 O68 Pr0.12 Si24 Sr3.92 Zn0.88 -","4","0.5","","Pushcharovsky, D. Y.; Pekov, I. V.; Pluth, J. J.; Smith, J.; Ferraris, G.; Vinogradova, S. A.; Arakcheeva, A. V.; Soboleva, S. V.; Semenov, E. I.","Raite, manganonordite-(Ce), and ferronordite-(Ce) from the Lovozero massif: Crystal structures and mineralogical geochemistry","Crystallography Reports","1999","44","","565","574","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012638","14.182","","14.182","","30.37","","90","","90","","120","","5289.94","","","","","","","","","","","","Alluaiv mountain, Lovozero massif, Kola Peninsula, Russia","18","R 3 :H","R 3","146","","","Kentbrooksite","- Ca2.1 Ce0.579 Cl0.3 F0.5 Fe0.15 H3.816 Hf0.051 K0.099 La0.342 Mn3.6 Na16.002 Nb0.4 Nd0.228 O77.11 Si25.6 Sr0.45 Ti0.099 Zr3.3 -","- Ca2.1 Ce0.579 Cl0.3 F0.5 Fe0.15 H6.86 Hf0.051 K0.099 La0.342 Mn3.6 Na16.002 Nb0.4 Nd0.228 O77.11 Si25.6 Sr0.45 Ti0.099 Zr3.3 -","- Ca6.3 Ce1.737 Cl0.9 F1.5 Fe0.45 H20.58 Hf0.153 K0.297 La1.026 Mn10.8 Na48.006 Nb1.2 Nd0.684 O231.33 Si76.8 Sr1.35 Ti0.297 Zr9.9 -","3","0.333333","","Rastsvetaeva, R. K.; Khomyakov, A. P.; Nekrasov, Y. V.","Crystal structure of a novel analog of eudialyte with R3 symmetry","Crystallography Reports","1999","44","","765","769","","","","","","","","","","","","","","","","","","","","","","has coordinates","283907","2023-05-21","07:14:43",""
"9012639","14.182","","14.182","","30.37","","90","","90","","120","","5289.94","","","","","","","","","","","","Alluaiv mountain, Lovozero alakaline massif, Kola Peninsula, Russia","19","R 3 :H","R 3","146","","","","- Ca2.1 Ce0.54 Cl0.17 F0.28 Fe0.15 H3.78 Hf0.051 K0.099 La0.312 Mn3.6 Na16.002 Nb0.4 Nd0.198 O77.11 Si25.6 Sr0.45 Ti0.099 Y0.099 Zr3.3 -","- Ca2.1 Ce0.54 Cl0.17 F0.28 Fe0.15 H6.86 Hf0.051 K0.099 La0.312 Mn3.6 Na16.002 Nb0.4 Nd0.198 O77.11 Si25.6 Sr0.45 Ti0.099 Y0.099 Zr3.3 -","- Ca6.3 Ce1.62 Cl0.51 F0.84 Fe0.45 H20.58 Hf0.153 K0.297 La0.936 Mn10.8 Na48.006 Nb1.2 Nd0.594 O231.33 Si76.8 Sr1.35 Ti0.297 Y0.297 Zr9.9 -","3","0.333333","","Rastsvetaeva, R. K.; Khomyakov, A. P.; Nekrasov, Y. V.","Crystal structure of a novel analog of eudialyte with R3 symmetry Locality: Alluaiv mountain, Lovozero alakaline massif, Kola Peninsula, Russia","Crystallography Reports","1999","44","","824","828","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34",""
"9012893","19.776","","5.99","","11.119","","90","","90","","90","","1317.14","","","","","","","","","","","","Suolun, China","4","F d 2 d","F -2d -2d","43","","","Suolunite","- Ca H2 O4 Si -","- Ca H2 O4 Si -","- Ca16 H32 O64 Si16 -","16","1","","Ma, Z.; Shi, N.; Mou, G.; Liao, L.","Crystal structure refinement of suolunite and its significance to the cement techniques","Chinese Science Bulletin","1999","44","","2125","2130","10.1007/BF03182693","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013439","12.089","","6.903","","6.3537","","90","","90.089","","90","","530.218","","","","","","","","","","","","Synthetic","5","C 1 2 1","C 2y","5","","","Omongwaite","- Ca2.572 H4 Na0.856 O13.42 S3 -","- Ca2.572 H2.84 Na0.856 O13.42 S3 -","- Ca5.144 H5.68 Na1.712 O26.84 S6 -","2","0.5","","Freyer, D.; Reck, G.; Bremer, M.; Voigt, W.","Thermal behaviour and crystal structure of sodium-containing hemihydrates of calcium sulfate Note: subcell","Monatshefte fur Chemie","1999","130","","1179","1193","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07",""
"9013440","24.1781","","13.805","","12.7074","","90","","90.089","","90","","4241.45","","","","","","","","","","","","Synthetic","5","C 1 2 1","C 2y","5","","","Omongwaite","- Ca2.572 H4 Na0.858 O13.442 S3 -","- Ca2.572 H2.885 Na0.85775 O13.4425 S3 -","- Ca41.152 H46.16 Na13.724 O215.08 S48 -","16","4","","Freyer, D.; Reck, G.; Bremer, M.; Voigt, W.","Thermal behaviour and crystal structure of sodium-containing hemihydrates of calcium sulfate Note: supercell","Monatshefte fur Chemie","1999","130","","1179","1193","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34",""
"9014084","15.882","","15.882","","7.115","","90","","90","","120","","1554.23","","","","","","","","","","","","Madagascar","10","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7 B3 Ca0.452 F0.327 H3.39 K0.04 Li2 Na0.435 O30.672 Si6 -","- Al6.99999 B3 Ca0.452 F0.327 H3.39 K0.04 Li2.00001 Na0.435 O30.672 Si6 -","- Al21 B9 Ca1.356 F0.981 H10.17 K0.12 Li6.00003 Na1.305 O92.016 Si18 -","3","0.166667","","Aurisicchio, C.; Demartin, F.; Ottolini, L.; Pezzotta, F.","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 2","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34",""
"9014297","10.20141","","5.98348","","4.75534","","90","","90","","90","","290.266","","","","","","","","","","","","Synthetic","3","P n m a","-P 2ac 2n","62","","","Forsterite","- Mg2 O4 Si -","- Mg2 O4 Si -","- Mg8 O16 Si4 -","4","0.5","","Yamazaki, S.; Toraya, H.","Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo","Journal of Applied Crystallography","1999","32","","51","59","10.1107/S0021889898010206","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17",""
"9014320","10.60016","","6.25753","","4.90338","","90","","90","","90","","325.245","","","","","","","","","","","","Synthetic","3","P n m a","-P 2ac 2n","62","","","Tephroite","- Mn2 O4 Si -","- Mn2 O4 Si -","- Mn8 O16 Si4 -","4","0.5","","Yamazaki, S.; Toraya, H.","Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1","Journal of Applied Crystallography","1999","32","","51","59","10.1107/S0021889898010206","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17",""
"9014601","15.88","","15.88","","7.118","","90","","90","","120","","1554.5","","","","","","","","","","","","Madagascar","10","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7 B3 Ca0.483 F0.327 H3.291 K0.105 Li2 Na0.412 O30.672 Si6 -","- Al6.99999 B3 Ca0.483 F0.327 H3.291 K0.105 Li2.00001 Na0.412 O30.672 Si6 -","- Al21 B9 Ca1.449 F0.981 H9.873 K0.315 Li6.00003 Na1.236 O92.016 Si18 -","3","0.166667","","Aurisicchio, C.; Demartin, F.; Ottolini, L.; Pezzotta, F.","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 1","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34",""
"9014894","7.6199","","13.0265","","6.7374","","90","","90","","90","","668.759","","","","","","","","","","","","Synthetic","4","C c m 21","C 2c -2c","36","","","","- Ba O7 Si2 Zn2 -","- Ba O7 Si2 Zn2 -","- Ba4 O28 Si8 Zn8 -","4","0.5","","Lin, J. H.; Lu, G. X.; Du, J.; Su, M. Z.; Loong, C. K.; Richardson, J. W.","Phase transition and crystal structure of BaZn2Si2O7 Note: T = 350 C","Journal of Physics and Chemistry of Solids","1999","60","","975","983","10.1016/S0022-3697(99)00004-9","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18",""
"9015074","10.451","","6.12446","","4.80757","","90","","90","","90","","307.717","","","","","","","","","","","","Synthetic","4","P n m a","-P 2ac 2n","62","","","Forsterite","- Mg Mn O4 Si -","- Mg Mn O4 Si -","- Mg4 Mn4 O16 Si4 -","4","0.5","","Yamazaki, S.; Toraya, H.","Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo","Journal of Applied Crystallography","1999","32","","51","59","10.1107/S0021889898010206","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18",""
"9015192","10.451","","6.12446","","4.80757","","90","","90","","90","","307.717","","","","","","","","","","","","Synthetic","4","P n m a","-P 2ac 2n","62","","","Tephroite","- Mg Mn O4 Si -","- Mg Mn O4 Si -","- Mg4 Mn4 O16 Si4 -","4","0.5","","Yamazaki, S.; Toraya, H.","Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1","Journal of Applied Crystallography","1999","32","","51","59","10.1107/S0021889898010206","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19",""
"9015204","15.935","","15.935","","7.16","","90","","90","","120","","1574.52","","","","","","","","","","","","Bald Mountain, Rangeley, Oxford County, Maine","15","R 3 m :H","R 3 -2""","160","","","Oxy-schorl","- Al6.516 B3 Ca0.156 Cr0.009 F0.06 Fe1.026 H3.094 K0.015 Mg1.359 Mn0.006 Na0.348 O30.94 Si6 Ti0.069 V0.006 -","- Al6.516 B3 Ca0.156 Cr0.009 F0.06 Fe1.026 H3.094 K0.015 Mg1.359 Mn0.006 Na0.348 O30.94 Si6 Ti0.069 V0.006 -","- Al19.548 B9 Ca0.468 Cr0.027 F0.18 Fe3.078 H9.282 K0.045 Mg4.077 Mn0.018 Na1.044 O92.82 Si18 Ti0.207 V0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample O-T16-92","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9015496","16.3","","16.3","","7.169","","90","","90","","120","","1649.55","","","","","","","","","","","","Esquire #7, Big Creek, Fresno County, California, USA","6","P 6/m m m","-P 6 2","191","","","Verplanckite","- Ba6 Cl6.391 Mn2.01 O18 Si6 Ti0.99 -","- Ba6 Cl6.391 Mn2.01 O18 Si6 Ti0.99 -","- Ba12 Cl12.782 Mn4.02 O36 Si12 Ti1.98 -","2","0.0833333","","Basciano, L. C.","Mineralogy and crystal structures of barium silicate minerals from Fresno County, California","Master's Thesis, University of British Columbia","1999","1999","","1","164","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19",""
"9015658","10.20141","","5.98348","","4.75534","","90","","90","","90","","290.266","","","","","","","","","","","","Synthetic","3","P n m a","-P 2ac 2n","62","","","Forsterite","- Mg2 O4 Si -","- Mg2 O4 Si -","- Mg8 O16 Si4 -","4","0.5","","Yamazaki, S.; Toraya, H.","Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1","Journal of Applied Crystallography","1999","32","","51","59","10.1107/S0021889898010206","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19",""
"9015849","10.60016","","6.25753","","4.90338","","90","","90","","90","","325.245","","","","","","","","","","","","Synthetic","3","P n m a","-P 2ac 2n","62","","","Tephroite","- Mn2 O4 Si -","- Mn2 O4 Si -","- Mn8 O16 Si4 -","4","0.5","","Yamazaki, S.; Toraya, H.","Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo","Journal of Applied Crystallography","1999","32","","51","59","10.1107/S0021889898010206","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:53",""
"9016116","10.52411","","6.17903","","4.83927","","90","","90","","90","","314.692","","","","","","","","","","","","Synthetic","4","P n m a","-P 2ac 2n","62","","","Tephroite","- Mg0.6 Mn1.4 O4 Si -","- Mg0.6 Mn1.4 O4 Si -","- Mg2.4 Mn5.6 O16 Si4 -","4","0.5","","Yamazaki, S.; Toraya, H.","Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = eo","Journal of Applied Crystallography","1999","32","","51","59","10.1107/S0021889898010206","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54",""
"9016391","15.935","","15.935","","7.164","","90","","90","","120","","1575.4","","","","","","","","","","","","Noisy Brook gneiss, Roxbury, Oxford County, Maine, USA","13","R 3 m :H","R 3 -2""","160","","","Oxy-schorl","- Al6.606 B3 Ca0.017 F0.106 Fe1.044 H3.041 K0.04 Mg1.242 Na0.533 O30.894 Si6 Ti0.084 V0.015 -","- Al6.606 B3 Ca0.017 F0.106 Fe1.044 H3.041 K0.04 Mg1.242 Na0.533 O30.894 Si6 Ti0.084 V0.015 -","- Al19.818 B9 Ca0.051 F0.318 Fe3.132 H9.123 K0.12 Mg3.726 Na1.599 O92.682 Si18 Ti0.252 V0.045 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample Ru-T17-92","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9016401","15.965","","15.965","","7.199","","90","","90","","120","","1589.06","","","","","","","","","","","","Tait farm, Dungannon Township, Hastings County, Ontario, Canada","14","R 3 m :H","R 3 -2""","160","","","Fluor-dravite","- Al5.439 B3 Ca0.368 F0.495 Fe1.143 H3.02 K0.029 Li0.018 Mg2.292 Mn0.012 Na0.471 O30.505 Si6 Ti0.033 -","- Al5.439 B3 Ca0.368 F0.495 Fe1.143 H3.02 K0.029 Li0.018 Mg2.292 Mn0.012 Na0.471 O30.505 Si6 Ti0.033 -","- Al16.317 B9 Ca1.104 F1.485 Fe3.429 H9.06 K0.087 Li0.054 Mg6.876 Mn0.036 Na1.413 O91.515 Si18 Ti0.099 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample #32008","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9016435","10.52411","","6.17903","","4.83927","","90","","90","","90","","314.692","","","","","","","","","","","","Synthetic","4","P n m a","-P 2ac 2n","62","","","Tephroite","- Mg0.6 Mn1.4 O4 Si -","- Mg0.6 Mn1.4 O4 Si -","- Mg2.4 Mn5.6 O16 Si4 -","4","0.5","","Yamazaki, S.; Toraya, H.","Rietveld refinement of site-occupancy parameters of Mg2-xMnxSiO4 using a new weight function in least-squares fitting Note: e = 1","Journal of Applied Crystallography","1999","32","","51","59","10.1107/S0021889898010206","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54",""
"9016473","15.934","","15.934","","7.167","","90","","90","","120","","1575.86","","","","","","","","","","","","Small Falls pegmatite, Rumford, Oxford County, Maine, USA","15","R 3 m :H","R 3 -2""","160","","","Fluor-schorl","- Al6.567 B3 Ca0.016 F0.301 Fe1.047 H3.234 K0.015 Li0.006 Mg1.305 Mn0.018 Na0.684 O30.699 Si6 Ti0.024 V0.006 -","- Al6.567 B3 Ca0.016 F0.301 Fe1.047 H3.234 K0.015 Li0.006 Mg1.305 Mn0.018 Na0.684 O30.699 Si6 Ti0.024 V0.006 -","- Al19.701 B9 Ca0.048 F0.903 Fe3.141 H9.702 K0.045 Li0.018 Mg3.915 Mn0.054 Na2.052 O92.097 Si18 Ti0.072 V0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample SmFalls","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""
"9016690","6.733","","9.608","","6.685","","69.64","","102.29","","96.89","","395.65","","","","","","","","","","","","Esquire #7, Big Creek, Fresno County, California, USA","4","P -1","-P 1","2","","","Walstromite","- Ba Ca2 O9 Si3 -","- Ba Ca2 O9 Si3 -","- Ba2 Ca4 O18 Si6 -","2","1","","Basciano, L. C.","Mineralogy and crystal structures of barium silicate minerals from Fresno County, California","Master's Thesis, University of British Columbia","1999","1999","","1","164","","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:47",""
"9016771","8.133","","12.773","","7.159","","94.23","","116.64","","87.72","","662.918","","","","","","","","","","","","Stintino, Sardinia, Italy","6","C -1","-C 1","2","","","Albite","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al4 Ca0.04 K0.016 Na3.984 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: untreated","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9016772","8.141","","12.795","","7.145","","94.04","","116.56","","87.98","","664.049","","","","","","","","","","","","Stintino, Sardinia, Italy","6","C -1","-C 1","2","","","Albite","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al4 Ca0.04 K0.016 Na3.984 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1050-3d","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9016773","8.17","","12.811","","7.141","","93.79","","116.53","","88.09","","667.248","","","","","","","","","","","","Stintino, Sardinia, Italy","6","C -1","-C 1","2","","","Albite","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al4 Ca0.04 K0.016 Na3.984 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1060-6d","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9016774","8.14","","12.791","","7.132","","93.94","","116.54","","88.46","","662.748","","","","","","","","","","","","Stintino, Sardinia, Italy","6","C -1","-C 1","2","","","Albite","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al4 Ca0.04 K0.016 Na3.984 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1070-7d","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9016775","8.142","","12.782","","7.136","","94","","116.51","","88.13","","662.946","","","","","","","","","","","","Stintino, Sardinia, Italy","6","C -1","-C 1","2","","","Albite","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al4 Ca0.04 K0.016 Na3.984 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1080-7d","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9016776","8.154","","12.794","","7.129","","93.81","","116.54","","88.48","","663.868","","","","","","","","","","","","Stintino, Sardinia, Italy","6","C -1","-C 1","2","","","Albite","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al4 Ca0.04 K0.016 Na3.984 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1080-10d","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9016777","8.16","","12.802","","7.13","","93.72","","116.42","","88.61","","665.624","","","","","","","","","","","","Stintino, Sardinia, Italy","6","C -1","-C 1","2","","","Albite","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al4 Ca0.04 K0.016 Na3.984 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1090-7d","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""
"9016778","8.152","","12.831","","7.11","","93.46","","116.52","","89.72","","664.026","","","","","","","","","","","","Stintino, Sardinia, Italy","6","C -1","-C 1","2","","","Albite","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al Ca0.01 K0.004 Na0.996 O8 Si3 -","- Al4 Ca0.04 K0.016 Na3.984 O32 Si12 -","4","","","Meneghinello, E.; Alberti, A.; Cruciani, G.","Order-disorder process in the tetrahedral sites af albite Sample: 1090-12d","American Mineralogist","1999","84","","1144","1151","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11",""